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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
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13955 |
1wa8 ![]() ![]() |
cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H ALA 1 H ALA 1 -6.090 29.000 3.319 2 HA ALA 1 HA ALA 1 -6.522 27.523 1.251 3 1HB ALA 1 3HB ALA 1 -8.825 29.125 1.354 4 2HB ALA 1 2HB ALA 1 -8.319 28.074 0.010 5 3HB ALA 1 1HB ALA 1 -7.871 29.796 0.010 6 H GLU 2 H GLU 2 -5.046 27.939 -0.467 7 HA GLU 2 HA GLU 2 -3.317 30.168 0.140 8 1HB GLU 2 1HB GLU 2 -2.694 27.602 -0.370 9 2HB GLU 2 2HB GLU 2 -2.691 28.174 -2.026 10 1HG GLU 2 1HG GLU 2 -0.715 29.263 -1.742 11 2HG GLU 2 2HG GLU 2 -1.287 30.071 -0.296 12 HE2 GLU 2 HE GLU 2 0.503 28.481 1.747 13 H MET 3 H MET 3 -4.673 28.611 -2.864 14 HA MET 3 HA MET 3 -5.277 31.262 -3.831 15 1HB MET 3 1HB MET 3 -3.462 29.235 -5.245 16 2HB MET 3 2HB MET 3 -4.190 30.590 -6.085 17 1HG MET 3 1HG MET 3 -2.321 30.805 -3.673 18 2HG MET 3 2HG MET 3 -1.868 31.117 -5.337 19 1HE MET 3 1HE MET 3 -1.568 32.645 -2.837 20 2HE MET 3 2HE MET 3 -1.366 34.099 -3.843 21 3HE MET 3 3HE MET 3 -2.598 34.070 -2.559 22 H LYS 4 H LYS 4 -6.312 30.904 -6.244 23 HA LYS 4 HA LYS 4 -8.300 28.799 -5.822 24 1HB LYS 4 1HB LYS 4 -9.521 30.209 -7.631 25 2HB LYS 4 2HB LYS 4 -9.462 30.787 -5.978 26 1HG LYS 4 1HG LYS 4 -7.110 31.654 -7.532 27 2HG LYS 4 2HG LYS 4 -8.610 32.189 -8.263 28 1HD LYS 4 1HD LYS 4 -9.321 33.077 -5.979 29 2HD LYS 4 2HD LYS 4 -7.722 32.679 -5.382 30 1HE LYS 4 1HE LYS 4 -7.801 34.295 -7.904 31 2HE LYS 4 2HE LYS 4 -8.371 35.110 -6.462 32 H THR 5 H THR 5 -6.819 30.445 -8.705 33 HA THR 5 HA THR 5 -6.414 27.749 -9.827 34 HB THR 5 HB THR 5 -8.166 28.665 -11.135 35 HG1 THR 5 1HG THR 5 -6.936 29.432 -13.064 36 1HG2 THR 5 3HG2 THR 5 -8.063 30.991 -10.079 37 2HG2 THR 5 1HG2 THR 5 -6.691 31.347 -11.155 38 3HG2 THR 5 2HG2 THR 5 -8.297 31.005 -11.843 39 H ASP 6 H ASP 6 -4.896 30.402 -8.488 40 HA ASP 6 HA ASP 6 -3.003 31.359 -9.924 41 1HB ASP 6 1HB ASP 6 -2.756 29.926 -7.262 42 2HB ASP 6 2HB ASP 6 -1.334 30.653 -7.984 43 HD2 ASP 6 HD ASP 6 -1.588 33.496 -7.478 44 H ALA 7 H ALA 7 -1.471 30.633 -11.419 45 HA ALA 7 HA ALA 7 -1.285 28.078 -12.298 46 1HB ALA 7 1HB ALA 7 0.455 30.508 -12.391 47 2HB ALA 7 2HB ALA 7 1.183 28.967 -12.903 48 3HB ALA 7 3HB ALA 7 -0.277 29.575 -13.718 49 H ALA 8 H ALA 8 0.098 29.486 -9.377 50 HA ALA 8 HA ALA 8 2.120 27.548 -8.996 51 1HB ALA 8 2HB ALA 8 2.507 29.433 -7.734 52 2HB ALA 8 1HB ALA 8 1.658 28.457 -6.511 53 3HB ALA 8 3HB ALA 8 0.777 29.710 -7.418 54 H THR 9 H THR 9 -1.286 27.916 -7.818 55 HA THR 9 HA THR 9 -1.219 25.502 -6.323 56 HB THR 9 HB THR 9 -2.766 27.696 -6.261 57 HG1 THR 9 1HG THR 9 -3.847 24.986 -5.991 58 1HG2 THR 9 2HG2 THR 9 -4.283 25.702 -8.025 59 2HG2 THR 9 3HG2 THR 9 -5.048 27.050 -7.150 60 3HG2 THR 9 1HG2 THR 9 -3.876 27.382 -8.448 61 H LEU 10 H LEU 10 -2.550 26.369 -9.575 62 HA LEU 10 HA LEU 10 -3.610 23.896 -10.157 63 1HB LEU 10 1HB LEU 10 -2.484 26.115 -11.839 64 2HB LEU 10 2HB LEU 10 -3.084 24.642 -12.575 65 HG LEU 10 HG LEU 10 -4.677 26.555 -10.846 66 1HD1 LEU 10 3HD1 LEU 10 -4.679 26.025 -13.826 67 2HD1 LEU 10 1HD1 LEU 10 -5.951 26.930 -12.971 68 3HD1 LEU 10 2HD1 LEU 10 -4.279 27.541 -12.983 69 1HD2 LEU 10 2HD2 LEU 10 -5.327 23.849 -11.967 70 2HD2 LEU 10 3HD2 LEU 10 -5.692 24.540 -10.368 71 3HD2 LEU 10 1HD2 LEU 10 -6.606 25.075 -11.799 72 H ALA 11 H ALA 11 -0.292 25.165 -10.914 73 HA ALA 11 HA ALA 11 0.663 22.855 -12.090 74 1HB ALA 11 1HB ALA 11 1.936 25.143 -10.570 75 2HB ALA 11 2HB ALA 11 2.917 23.816 -11.237 76 3HB ALA 11 3HB ALA 11 1.935 24.829 -12.322 77 H GLN 12 H GLN 12 0.305 23.778 -8.646 78 HA GLN 12 HA GLN 12 1.864 21.692 -7.654 79 1HB GLN 12 1HB GLN 12 0.794 23.895 -6.549 80 2HB GLN 12 2HB GLN 12 -0.459 22.768 -6.071 81 1HG GLN 12 1HG GLN 12 2.514 22.299 -5.551 82 2HG GLN 12 2HG GLN 12 1.436 23.044 -4.387 83 1HE2 GLN 12 1HE2 GLN 12 2.813 20.222 -5.368 84 2HE2 GLN 12 2HE2 GLN 12 1.737 19.060 -4.667 85 H GLU 13 H GLU 13 -1.539 21.953 -8.685 86 HA GLU 13 HA GLU 13 -2.115 19.354 -7.596 87 1HB GLU 13 1HB GLU 13 -3.866 21.226 -9.250 88 2HB GLU 13 2HB GLU 13 -4.414 19.782 -8.422 89 1HG GLU 13 1HG GLU 13 -4.330 20.769 -6.330 90 2HG GLU 13 2HG GLU 13 -2.926 21.742 -6.722 91 HE2 GLU 13 HE GLU 13 -4.794 23.239 -5.579 92 H ALA 14 H ALA 14 -1.584 20.989 -10.749 93 HA ALA 14 HA ALA 14 -2.358 18.855 -12.380 94 1HB ALA 14 2HB ALA 14 -1.525 21.464 -12.709 95 2HB ALA 14 3HB ALA 14 -0.139 20.548 -13.350 96 3HB ALA 14 1HB ALA 14 -1.765 20.293 -14.029 97 H GLY 15 H GLY 15 0.911 19.865 -11.153 98 1HA GLY 15 2HA GLY 15 2.771 18.662 -10.769 99 2HA GLY 15 1HA GLY 15 2.421 17.860 -12.287 100 H ASN 16 H ASN 16 0.304 17.784 -9.381 101 HA ASN 16 HA ASN 16 1.293 15.272 -8.549 102 1HB ASN 16 1HB ASN 16 0.337 16.562 -6.796 103 2HB ASN 16 2HB ASN 16 -1.022 17.074 -7.777 104 1HD2 ASN 16 1HD2 ASN 16 -2.798 16.348 -6.889 105 2HD2 ASN 16 2HD2 ASN 16 -3.111 14.737 -6.336 106 H PHE 17 H PHE 17 -1.277 16.536 -10.664 107 HA PHE 17 HA PHE 17 -2.825 14.163 -10.729 108 1HB PHE 17 1HB PHE 17 -3.687 16.437 -11.290 109 2HB PHE 17 2HB PHE 17 -2.480 16.618 -12.548 110 HD1 PHE 17 1HD PHE 17 -5.419 14.549 -11.591 111 HD2 PHE 17 2HD PHE 17 -2.974 15.998 -14.743 112 HE1 PHE 17 1HE PHE 17 -7.031 13.613 -13.273 113 HE2 PHE 17 2HE PHE 17 -4.585 15.061 -16.424 114 HZ PHE 17 HZ PHE 17 -6.594 13.880 -15.669 115 H GLU 18 H GLU 18 -0.517 15.703 -13.084 116 HA GLU 18 HA GLU 18 -0.602 14.001 -15.090 117 1HB GLU 18 1HB GLU 18 1.612 15.537 -13.803 118 2HB GLU 18 2HB GLU 18 2.116 14.297 -14.934 119 1HG GLU 18 1HG GLU 18 1.392 15.493 -16.735 120 2HG GLU 18 2HG GLU 18 -0.152 15.846 -15.986 121 HE2 GLU 18 HE GLU 18 2.033 17.750 -17.258 122 H ARG 19 H ARG 19 0.854 13.348 -11.883 123 HA ARG 19 HA ARG 19 2.117 10.987 -12.642 124 1HB ARG 19 1HB ARG 19 2.071 12.558 -10.374 125 2HB ARG 19 2HB ARG 19 1.111 11.196 -9.831 126 1HG ARG 19 1HG ARG 19 2.884 9.663 -10.076 127 2HG ARG 19 2HG ARG 19 3.703 10.636 -11.281 128 1HD ARG 19 1HD ARG 19 3.551 12.214 -8.875 129 2HD ARG 19 2HD ARG 19 4.102 10.616 -8.413 130 HE ARG 19 HE ARG 19 6.081 10.929 -9.673 131 2HH1 ARG 19 1HH ARG 19 7.219 13.741 -11.364 132 1HH2 ARG 19 2HH2 ARG 19 3.808 13.576 -10.292 133 2HH2 ARG 19 1HH2 ARG 19 4.980 14.557 -11.107 134 H ILE 20 H ILE 20 -1.131 11.761 -11.268 135 HA ILE 20 HA ILE 20 -1.912 9.086 -10.882 136 HB ILE 20 HB ILE 20 -3.593 11.561 -11.294 137 1HG1 ILE 20 1HG1 ILE 20 -2.835 10.390 -8.625 138 2HG1 ILE 20 2HG1 ILE 20 -1.766 11.518 -9.435 139 1HG2 ILE 20 2HG2 ILE 20 -4.675 9.234 -11.498 140 2HG2 ILE 20 3HG2 ILE 20 -4.384 9.100 -9.747 141 3HG2 ILE 20 1HG2 ILE 20 -5.406 10.412 -10.382 142 1HD1 ILE 20 1HD1 ILE 20 -4.238 12.771 -9.697 143 2HD1 ILE 20 2HD1 ILE 20 -4.346 12.016 -8.089 144 3HD1 ILE 20 3HD1 ILE 20 -3.020 13.145 -8.454 145 H SER 21 H SER 21 -2.337 11.435 -13.594 146 HA SER 21 HA SER 21 -3.938 9.797 -15.128 147 1HB SER 21 1HB SER 21 -2.103 12.123 -15.682 148 2HB SER 21 2HB SER 21 -2.732 11.227 -17.050 149 HG SER 21 HG SER 21 -4.560 12.042 -15.006 150 H GLY 22 H GLY 22 -0.336 10.270 -15.123 151 1HA GLY 22 2HA GLY 22 1.340 8.976 -15.871 152 2HA GLY 22 1HA GLY 22 0.284 8.506 -17.188 153 H ASP 23 H ASP 23 0.331 7.934 -13.590 154 HA ASP 23 HA ASP 23 1.024 5.308 -13.717 155 1HB ASP 23 1HB ASP 23 -0.521 7.011 -11.769 156 2HB ASP 23 2HB ASP 23 -0.545 5.278 -11.512 157 HD2 ASP 23 HD ASP 23 2.604 7.022 -12.387 158 H LEU 24 H LEU 24 -2.274 6.844 -13.578 159 HA LEU 24 HA LEU 24 -3.799 4.564 -13.548 160 1HB LEU 24 1HB LEU 24 -4.530 6.932 -13.241 161 2HB LEU 24 2HB LEU 24 -4.439 7.146 -14.978 162 HG LEU 24 HG LEU 24 -6.081 5.102 -15.056 163 1HD1 LEU 24 3HD1 LEU 24 -5.758 4.877 -12.470 164 2HD1 LEU 24 1HD1 LEU 24 -6.989 6.161 -12.400 165 3HD1 LEU 24 2HD1 LEU 24 -7.360 4.615 -13.202 166 1HD2 LEU 24 3HD2 LEU 24 -6.712 7.970 -14.410 167 2HD2 LEU 24 1HD2 LEU 24 -6.850 7.096 -15.955 168 3HD2 LEU 24 2HD2 LEU 24 -8.015 6.781 -14.647 169 H LYS 25 H LYS 25 -2.344 6.307 -16.356 170 HA LYS 25 HA LYS 25 -3.508 4.598 -18.276 171 1HB LYS 25 1HB LYS 25 -2.899 6.580 -19.224 172 2HB LYS 25 2HB LYS 25 -1.474 6.766 -18.222 173 1HG LYS 25 1HG LYS 25 -0.128 5.526 -19.646 174 2HG LYS 25 2HG LYS 25 -1.427 4.449 -20.118 175 1HD LYS 25 1HD LYS 25 -0.680 5.954 -21.987 176 2HD LYS 25 2HD LYS 25 -2.383 6.130 -21.612 177 1HE LYS 25 1HE LYS 25 -2.124 8.271 -20.757 178 2HE LYS 25 2HE LYS 25 -0.535 7.937 -20.098 179 H THR 26 H THR 26 -0.445 4.584 -16.406 180 HA THR 26 HA THR 26 0.810 2.528 -17.832 181 HB THR 26 HB THR 26 1.033 3.872 -15.145 182 HG1 THR 26 1HG THR 26 2.057 4.429 -17.308 183 1HG2 THR 26 2HG2 THR 26 1.946 1.084 -15.740 184 2HG2 THR 26 3HG2 THR 26 3.209 2.186 -15.141 185 3HG2 THR 26 1HG2 THR 26 1.746 1.896 -14.169 186 H GLN 27 H GLN 27 -1.459 2.443 -15.033 187 HA GLN 27 HA GLN 27 -1.232 -0.323 -14.719 188 1HB GLN 27 1HB GLN 27 -3.571 1.470 -13.938 189 2HB GLN 27 2HB GLN 27 -3.198 -0.101 -13.258 190 1HG GLN 27 1HG GLN 27 -1.115 2.102 -13.174 191 2HG GLN 27 2HG GLN 27 -2.417 2.095 -12.001 192 1HE2 GLN 27 1HE2 GLN 27 0.602 1.509 -12.052 193 2HE2 GLN 27 2HE2 GLN 27 0.781 0.051 -11.135 194 H ILE 28 H ILE 28 -3.527 1.799 -16.527 195 HA ILE 28 HA ILE 28 -5.306 -0.183 -17.301 196 HB ILE 28 HB ILE 28 -4.564 2.540 -18.215 197 1HG1 ILE 28 1HG1 ILE 28 -7.283 1.329 -17.677 198 2HG1 ILE 28 2HG1 ILE 28 -6.248 1.928 -16.396 199 1HG2 ILE 28 1HG2 ILE 28 -5.776 0.474 -19.988 200 2HG2 ILE 28 2HG2 ILE 28 -6.483 2.108 -20.010 201 3HG2 ILE 28 3HG2 ILE 28 -4.757 1.880 -20.383 202 1HD1 ILE 28 3HD1 ILE 28 -6.902 3.660 -18.807 203 2HD1 ILE 28 1HD1 ILE 28 -7.993 3.571 -17.403 204 3HD1 ILE 28 2HD1 ILE 28 -6.329 4.169 -17.200 205 H ASP 29 H ASP 29 -2.398 1.129 -19.039 206 HA ASP 29 HA ASP 29 -2.582 -0.481 -21.221 207 1HB ASP 29 1HB ASP 29 -0.637 1.249 -19.999 208 2HB ASP 29 2HB ASP 29 0.200 -0.227 -20.437 209 HD2 ASP 29 HD ASP 29 -0.613 -0.281 -23.594 210 H GLN 30 H GLN 30 -1.187 -1.069 -17.952 211 HA GLN 30 HA GLN 30 0.168 -3.392 -18.501 212 1HB GLN 30 1HB GLN 30 -0.975 -2.078 -16.076 213 2HB GLN 30 2HB GLN 30 -0.645 -3.792 -15.917 214 1HG GLN 30 1HG GLN 30 1.661 -3.527 -16.202 215 2HG GLN 30 2HG GLN 30 1.487 -2.097 -17.200 216 1HE2 GLN 30 1HE2 GLN 30 3.179 -1.269 -15.817 217 2HE2 GLN 30 2HE2 GLN 30 2.786 -0.517 -14.307 218 H VAL 31 H VAL 31 -3.280 -2.854 -17.557 219 HA VAL 31 HA VAL 31 -3.911 -5.597 -17.410 220 HB VAL 31 HB VAL 31 -5.493 -3.049 -17.677 221 1HG1 VAL 31 1HG1 VAL 31 -6.664 -4.965 -18.836 222 2HG1 VAL 31 2HG1 VAL 31 -6.707 -5.796 -17.263 223 3HG1 VAL 31 3HG1 VAL 31 -7.553 -4.244 -17.473 224 1HG2 VAL 31 3HG2 VAL 31 -4.258 -4.278 -15.517 225 2HG2 VAL 31 1HG2 VAL 31 -5.545 -3.052 -15.436 226 3HG2 VAL 31 2HG2 VAL 31 -5.958 -4.782 -15.365 227 H GLU 32 H GLU 32 -4.352 -3.078 -19.983 228 HA GLU 32 HA GLU 32 -5.636 -4.617 -21.800 229 1HB GLU 32 1HB GLU 32 -3.743 -2.286 -21.990 230 2HB GLU 32 2HB GLU 32 -4.179 -3.102 -23.478 231 1HG GLU 32 1HG GLU 32 -6.640 -2.854 -22.753 232 2HG GLU 32 2HG GLU 32 -6.072 -1.805 -21.469 233 HE2 GLU 32 HE GLU 32 -7.324 -1.108 -24.554 234 H SER 33 H SER 33 -2.111 -4.443 -21.090 235 HA SER 33 HA SER 33 -1.467 -6.173 -23.239 236 1HB SER 33 1HB SER 33 -0.058 -4.584 -21.237 237 2HB SER 33 2HB SER 33 0.653 -6.182 -21.346 238 HG SER 33 HG SER 33 1.705 -5.176 -22.971 239 H THR 34 H THR 34 -1.594 -6.458 -19.618 240 HA THR 34 HA THR 34 -0.854 -9.117 -19.428 241 HB THR 34 HB THR 34 -2.423 -7.121 -17.792 242 HG1 THR 34 1HG THR 34 -0.513 -7.446 -16.575 243 1HG2 THR 34 1HG2 THR 34 -3.522 -9.463 -17.506 244 2HG2 THR 34 2HG2 THR 34 -1.946 -9.993 -16.872 245 3HG2 THR 34 3HG2 THR 34 -2.857 -8.714 -16.034 246 H ALA 35 H ALA 35 -4.132 -7.694 -19.948 247 HA ALA 35 HA ALA 35 -5.575 -10.028 -19.782 248 1HB ALA 35 1HB ALA 35 -7.300 -8.783 -20.721 249 2HB ALA 35 3HB ALA 35 -6.220 -7.947 -21.863 250 3HB ALA 35 2HB ALA 35 -6.223 -7.490 -20.142 251 H GLY 36 H GLY 36 -3.421 -8.815 -22.343 252 1HA GLY 36 2HA GLY 36 -2.548 -9.868 -24.133 253 2HA GLY 36 1HA GLY 36 -4.214 -10.227 -24.542 254 H SER 37 H SER 37 -2.300 -11.399 -21.703 255 HA SER 37 HA SER 37 -1.820 -13.910 -22.866 256 1HB SER 37 1HB SER 37 -1.506 -12.688 -20.129 257 2HB SER 37 2HB SER 37 -1.417 -14.433 -20.265 258 HG SER 37 HG SER 37 0.092 -13.365 -22.262 259 H LEU 38 H LEU 38 -4.398 -12.479 -20.862 260 HA LEU 38 HA LEU 38 -5.556 -14.913 -20.039 261 1HB LEU 38 1HB LEU 38 -6.390 -12.043 -20.134 262 2HB LEU 38 2HB LEU 38 -7.603 -13.271 -19.831 263 HG LEU 38 HG LEU 38 -6.996 -12.649 -17.697 264 1HD1 LEU 38 3HD1 LEU 38 -6.556 -15.175 -18.332 265 2HD1 LEU 38 1HD1 LEU 38 -4.882 -14.753 -17.897 266 3HD1 LEU 38 2HD1 LEU 38 -6.190 -14.547 -16.707 267 1HD2 LEU 38 2HD2 LEU 38 -4.691 -11.624 -18.916 268 2HD2 LEU 38 3HD2 LEU 38 -5.197 -11.440 -17.219 269 3HD2 LEU 38 1HD2 LEU 38 -4.106 -12.768 -17.684 270 H GLN 39 H GLN 39 -6.591 -12.533 -22.590 271 HA GLN 39 HA GLN 39 -8.550 -14.138 -23.631 272 1HB GLN 39 1HB GLN 39 -8.023 -12.729 -25.796 273 2HB GLN 39 2HB GLN 39 -8.639 -11.925 -24.365 274 1HG GLN 39 1HG GLN 39 -5.744 -12.107 -24.173 275 2HG GLN 39 2HG GLN 39 -6.170 -11.429 -25.732 276 1HE2 GLN 39 1HE2 GLN 39 -7.955 -11.234 -22.681 277 2HE2 GLN 39 2HE2 GLN 39 -7.873 -9.516 -22.477 278 H GLY 40 H GLY 40 -5.130 -14.562 -23.696 279 1HA GLY 40 2HA GLY 40 -3.745 -15.708 -25.140 280 2HA GLY 40 1HA GLY 40 -5.103 -16.079 -26.184 281 H GLN 41 H GLN 41 -6.237 -16.673 -23.094 282 HA GLN 41 HA GLN 41 -5.951 -19.480 -23.497 283 1HB GLN 41 1HB GLN 41 -3.880 -19.166 -22.306 284 2HB GLN 41 2HB GLN 41 -4.625 -18.094 -21.137 285 1HG GLN 41 1HG GLN 41 -6.157 -20.122 -20.529 286 2HG GLN 41 2HG GLN 41 -5.012 -21.098 -21.426 287 1HE2 GLN 41 1HE2 GLN 41 -5.723 -19.500 -18.517 288 2HE2 GLN 41 2HE2 GLN 41 -4.245 -19.784 -17.660 289 H TRP 42 H TRP 42 -8.020 -20.177 -23.210 290 HA TRP 42 HA TRP 42 -9.389 -19.629 -20.780 291 1HB TRP 42 1HB TRP 42 -10.316 -18.239 -23.292 292 2HB TRP 42 2HB TRP 42 -11.386 -18.584 -21.947 293 HD1 TRP 42 HD TRP 42 -9.387 -15.811 -23.160 294 HE1 TRP 42 1HE TRP 42 -8.755 -14.021 -21.327 295 HE3 TRP 42 3HE TRP 42 -10.515 -18.740 -19.159 296 HZ2 TRP 42 2HZ TRP 42 -8.797 -14.030 -18.473 297 HZ3 TRP 42 3HZ TRP 42 -10.191 -17.773 -16.884 298 HH2 TRP 42 HH TRP 42 -9.364 -15.504 -16.506 299 H ARG 43 H ARG 43 -11.683 -20.713 -20.964 300 HA ARG 43 HA ARG 43 -11.705 -22.698 -23.054 301 1HB ARG 43 1HB ARG 43 -11.616 -23.303 -20.067 302 2HB ARG 43 2HB ARG 43 -12.288 -24.453 -21.206 303 1HG ARG 43 1HG ARG 43 -10.090 -25.188 -21.221 304 2HG ARG 43 2HG ARG 43 -9.981 -24.003 -22.506 305 1HD ARG 43 1HD ARG 43 -8.457 -22.811 -21.318 306 2HD ARG 43 2HD ARG 43 -9.600 -22.612 -20.004 307 HE ARG 43 HE ARG 43 -8.725 -25.183 -19.601 308 2HH1 ARG 43 1HH ARG 43 -5.574 -24.804 -18.189 309 1HH2 ARG 43 2HH2 ARG 43 -6.983 -22.142 -20.125 310 2HH2 ARG 43 1HH2 ARG 43 -5.600 -22.632 -19.203 311 H GLY 44 H GLY 44 -13.521 -21.180 -23.662 312 1HA GLY 44 2HA GLY 44 -16.026 -22.189 -22.949 313 2HA GLY 44 1HA GLY 44 -15.709 -20.693 -23.806 314 H ALA 45 H ALA 45 -17.291 -19.429 -22.747 315 HA ALA 45 HA ALA 45 -18.184 -18.180 -21.154 316 1HB ALA 45 3HB ALA 45 -18.899 -19.562 -19.535 317 2HB ALA 45 1HB ALA 45 -17.551 -20.683 -19.845 318 3HB ALA 45 2HB ALA 45 -17.342 -19.333 -18.703 319 H ALA 46 H ALA 46 -15.345 -19.246 -19.195 320 HA ALA 46 HA ALA 46 -14.642 -16.747 -18.346 321 1HB ALA 46 2HB ALA 46 -12.449 -18.703 -18.891 322 2HB ALA 46 1HB ALA 46 -13.793 -19.262 -17.867 323 3HB ALA 46 3HB ALA 46 -12.854 -17.826 -17.396 324 H GLY 47 H GLY 47 -14.120 -18.287 -21.487 325 1HA GLY 47 2HA GLY 47 -13.055 -17.607 -23.354 326 2HA GLY 47 1HA GLY 47 -12.002 -16.611 -22.369 327 H THR 48 H THR 48 -15.471 -16.725 -23.462 328 HA THR 48 HA THR 48 -15.327 -14.190 -24.680 329 HB THR 48 HB THR 48 -17.854 -14.539 -24.768 330 HG1 THR 48 1HG THR 48 -18.449 -16.673 -23.792 331 1HG2 THR 48 3HG2 THR 48 -16.163 -17.020 -25.385 332 2HG2 THR 48 1HG2 THR 48 -17.801 -16.710 -26.010 333 3HG2 THR 48 2HG2 THR 48 -16.447 -15.665 -26.503 334 H ALA 49 H ALA 49 -16.332 -15.273 -21.413 335 HA ALA 49 HA ALA 49 -17.520 -12.912 -20.592 336 1HB ALA 49 2HB ALA 49 -16.027 -15.137 -19.177 337 2HB ALA 49 1HB ALA 49 -17.781 -14.835 -19.240 338 3HB ALA 49 3HB ALA 49 -16.728 -13.767 -18.281 339 H ALA 50 H ALA 50 -14.060 -13.983 -20.396 340 HA ALA 50 HA ALA 50 -13.253 -11.468 -19.298 341 1HB ALA 50 2HB ALA 50 -10.954 -12.478 -19.699 342 2HB ALA 50 1HB ALA 50 -11.783 -13.904 -20.369 343 3HB ALA 50 3HB ALA 50 -12.039 -13.443 -18.669 344 H GLN 51 H GLN 51 -12.557 -13.186 -22.433 345 HA GLN 51 HA GLN 51 -11.237 -11.297 -23.723 346 1HB GLN 51 1HB GLN 51 -11.663 -13.351 -24.848 347 2HB GLN 51 2HB GLN 51 -13.402 -13.180 -24.705 348 1HG GLN 51 1HG GLN 51 -11.980 -11.002 -26.199 349 2HG GLN 51 2HG GLN 51 -12.021 -12.571 -26.978 350 1HE2 GLN 51 1HE2 GLN 51 -13.727 -9.745 -26.171 351 2HE2 GLN 51 2HE2 GLN 51 -15.288 -10.161 -26.795 352 H ALA 52 H ALA 52 -14.827 -11.390 -23.300 353 HA ALA 52 HA ALA 52 -15.317 -9.086 -24.843 354 1HB ALA 52 2HB ALA 52 -17.031 -10.765 -24.356 355 2HB ALA 52 1HB ALA 52 -17.539 -9.182 -23.721 356 3HB ALA 52 3HB ALA 52 -16.905 -10.423 -22.614 357 H ALA 53 H ALA 53 -14.984 -9.649 -21.272 358 HA ALA 53 HA ALA 53 -15.406 -7.047 -20.468 359 1HB ALA 53 2HB ALA 53 -13.669 -9.276 -19.345 360 2HB ALA 53 3HB ALA 53 -14.003 -7.759 -18.477 361 3HB ALA 53 1HB ALA 53 -15.339 -8.861 -18.888 362 H VAL 54 H VAL 54 -12.628 -8.556 -22.068 363 HA VAL 54 HA VAL 54 -10.804 -6.473 -21.391 364 HB VAL 54 HB VAL 54 -10.662 -8.504 -23.624 365 1HG1 VAL 54 2HG1 VAL 54 -9.015 -6.413 -23.248 366 2HG1 VAL 54 3HG1 VAL 54 -8.256 -7.574 -22.133 367 3HG1 VAL 54 1HG1 VAL 54 -8.454 -7.990 -23.852 368 1HG2 VAL 54 1HG2 VAL 54 -10.980 -9.121 -20.956 369 2HG2 VAL 54 2HG2 VAL 54 -10.210 -10.163 -22.176 370 3HG2 VAL 54 3HG2 VAL 54 -9.210 -9.115 -21.142 371 H VAL 55 H VAL 55 -13.076 -7.200 -24.066 372 HA VAL 55 HA VAL 55 -12.115 -5.198 -25.795 373 HB VAL 55 HB VAL 55 -14.597 -6.851 -25.536 374 1HG1 VAL 55 2HG1 VAL 55 -14.411 -4.253 -26.898 375 2HG1 VAL 55 3HG1 VAL 55 -14.938 -5.581 -27.959 376 3HG1 VAL 55 1HG1 VAL 55 -15.838 -5.224 -26.465 377 1HG2 VAL 55 3HG2 VAL 55 -12.173 -7.288 -26.726 378 2HG2 VAL 55 1HG2 VAL 55 -13.693 -8.093 -27.187 379 3HG2 VAL 55 2HG2 VAL 55 -13.131 -6.667 -28.092 380 H ARG 56 H ARG 56 -14.942 -5.301 -23.512 381 HA ARG 56 HA ARG 56 -15.771 -2.748 -23.961 382 1HB ARG 56 1HB ARG 56 -15.920 -4.604 -21.564 383 2HB ARG 56 2HB ARG 56 -16.546 -2.974 -21.420 384 1HG ARG 56 1HG ARG 56 -18.376 -3.432 -22.712 385 2HG ARG 56 2HG ARG 56 -17.431 -4.294 -23.910 386 1HD ARG 56 1HD ARG 56 -17.397 -6.320 -22.483 387 2HD ARG 56 2HD ARG 56 -18.231 -5.465 -21.201 388 HE ARG 56 HE ARG 56 -19.418 -6.471 -23.703 389 2HH1 ARG 56 1HH ARG 56 -22.636 -5.513 -22.810 390 1HH2 ARG 56 2HH2 ARG 56 -19.843 -4.345 -20.900 391 2HH2 ARG 56 1HH2 ARG 56 -21.568 -4.294 -21.044 392 H PHE 57 H PHE 57 -13.478 -3.995 -21.427 393 HA PHE 57 HA PHE 57 -12.963 -1.533 -20.247 394 1HB PHE 57 1HB PHE 57 -12.201 -3.433 -19.051 395 2HB PHE 57 2HB PHE 57 -11.718 -4.274 -20.511 396 HD1 PHE 57 1HD PHE 57 -10.705 -1.715 -18.063 397 HD2 PHE 57 2HD PHE 57 -9.492 -4.094 -21.361 398 HE1 PHE 57 1HE PHE 57 -8.310 -1.105 -17.622 399 HE2 PHE 57 2HE PHE 57 -7.097 -3.484 -20.920 400 HZ PHE 57 HZ PHE 57 -6.535 -1.997 -19.056 401 H GLN 58 H GLN 58 -11.293 -3.284 -22.940 402 HA GLN 58 HA GLN 58 -9.178 -1.570 -23.197 403 1HB GLN 58 1HB GLN 58 -10.662 -3.342 -25.159 404 2HB GLN 58 2HB GLN 58 -9.317 -2.359 -25.703 405 1HG GLN 58 1HG GLN 58 -8.734 -3.835 -23.200 406 2HG GLN 58 2HG GLN 58 -9.113 -4.891 -24.546 407 1HE2 GLN 58 1HE2 GLN 58 -6.988 -5.639 -24.574 408 2HE2 GLN 58 2HE2 GLN 58 -5.682 -4.726 -25.254 409 H GLU 59 H GLU 59 -12.319 -1.531 -25.039 410 HA GLU 59 HA GLU 59 -11.792 0.756 -26.448 411 1HB GLU 59 1HB GLU 59 -14.271 -0.719 -25.614 412 2HB GLU 59 2HB GLU 59 -14.486 0.900 -26.249 413 1HG GLU 59 1HG GLU 59 -12.638 -0.911 -27.778 414 2HG GLU 59 2HG GLU 59 -14.346 -1.301 -27.839 415 HE2 GLU 59 HE GLU 59 -13.928 0.156 -30.520 416 H ALA 60 H ALA 60 -12.720 0.301 -23.068 417 HA ALA 60 HA ALA 60 -13.538 3.040 -22.729 418 1HB ALA 60 2HB ALA 60 -12.950 0.890 -20.657 419 2HB ALA 60 3HB ALA 60 -13.896 2.380 -20.424 420 3HB ALA 60 1HB ALA 60 -14.516 1.088 -21.479 421 H ALA 61 H ALA 61 -10.609 1.059 -22.480 422 HA ALA 61 HA ALA 61 -9.119 2.619 -20.754 423 1HB ALA 61 1HB ALA 61 -8.761 0.362 -22.366 424 2HB ALA 61 2HB ALA 61 -7.583 1.537 -22.999 425 3HB ALA 61 3HB ALA 61 -7.553 1.085 -21.278 426 H ASN 62 H ASN 62 -9.593 2.880 -24.333 427 HA ASN 62 HA ASN 62 -7.832 4.977 -24.675 428 1HB ASN 62 1HB ASN 62 -10.382 4.732 -26.311 429 2HB ASN 62 2HB ASN 62 -8.777 5.169 -26.862 430 1HD2 ASN 62 1HD2 ASN 62 -10.827 2.561 -25.712 431 2HD2 ASN 62 2HD2 ASN 62 -9.929 1.237 -26.377 432 H LYS 63 H LYS 63 -11.426 4.850 -24.133 433 HA LYS 63 HA LYS 63 -12.019 7.507 -24.343 434 1HB LYS 63 1HB LYS 63 -13.177 5.336 -22.581 435 2HB LYS 63 2HB LYS 63 -13.871 6.942 -22.680 436 1HG LYS 63 1HG LYS 63 -13.937 6.629 -25.237 437 2HG LYS 63 2HG LYS 63 -13.517 4.950 -24.962 438 1HD LYS 63 1HD LYS 63 -15.937 5.088 -25.138 439 2HD LYS 63 2HD LYS 63 -15.543 4.723 -23.470 440 1HE LYS 63 1HE LYS 63 -16.768 6.533 -22.857 441 2HE LYS 63 2HE LYS 63 -15.530 7.546 -23.574 442 H GLN 64 H GLN 64 -10.676 5.709 -21.516 443 HA GLN 64 HA GLN 64 -10.744 7.977 -19.857 444 1HB GLN 64 1HB GLN 64 -9.786 5.180 -19.711 445 2HB GLN 64 2HB GLN 64 -8.814 6.294 -18.771 446 1HG GLN 64 1HG GLN 64 -11.535 7.028 -18.295 447 2HG GLN 64 2HG GLN 64 -11.485 5.278 -18.209 448 1HE2 GLN 64 1HE2 GLN 64 -9.733 4.311 -16.906 449 2HE2 GLN 64 2HE2 GLN 64 -9.269 5.079 -15.424 450 H LYS 65 H LYS 65 -8.193 6.363 -21.848 451 HA LYS 65 HA LYS 65 -6.055 7.918 -21.056 452 1HB LYS 65 1HB LYS 65 -6.714 6.085 -23.236 453 2HB LYS 65 2HB LYS 65 -5.616 7.351 -23.747 454 1HG LYS 65 1HG LYS 65 -4.106 5.778 -22.899 455 2HG LYS 65 2HG LYS 65 -4.336 6.802 -21.496 456 1HD LYS 65 1HD LYS 65 -4.769 4.797 -20.452 457 2HD LYS 65 2HD LYS 65 -6.385 5.068 -21.073 458 1HE LYS 65 1HE LYS 65 -5.864 2.839 -21.743 459 2HE LYS 65 2HE LYS 65 -5.638 3.791 -23.197 460 H GLN 66 H GLN 66 -8.800 8.645 -23.184 461 HA GLN 66 HA GLN 66 -7.574 10.903 -24.345 462 1HB GLN 66 1HB GLN 66 -9.779 9.390 -24.936 463 2HB GLN 66 2HB GLN 66 -10.554 10.779 -24.202 464 1HG GLN 66 1HG GLN 66 -10.355 11.206 -26.590 465 2HG GLN 66 2HG GLN 66 -9.258 12.288 -25.754 466 1HE2 GLN 66 1HE2 GLN 66 -8.488 12.229 -28.092 467 2HE2 GLN 66 2HE2 GLN 66 -7.216 11.118 -28.474 468 H GLU 67 H GLU 67 -10.133 10.461 -21.798 469 HA GLU 67 HA GLU 67 -10.323 13.169 -21.226 470 1HB GLU 67 1HB GLU 67 -11.077 10.628 -19.768 471 2HB GLU 67 2HB GLU 67 -11.240 12.170 -18.951 472 1HG GLU 67 1HG GLU 67 -12.472 11.529 -21.672 473 2HG GLU 67 2HG GLU 67 -13.338 11.435 -20.152 474 HE2 GLU 67 HE GLU 67 -13.092 13.331 -22.611 475 H LEU 68 H LEU 68 -7.907 10.778 -20.442 476 HA LEU 68 HA LEU 68 -6.989 11.987 -18.043 477 1HB LEU 68 1HB LEU 68 -6.623 9.592 -19.321 478 2HB LEU 68 2HB LEU 68 -5.091 10.389 -19.615 479 HG LEU 68 HG LEU 68 -4.598 10.563 -17.307 480 1HD1 LEU 68 3HD1 LEU 68 -7.509 10.398 -16.986 481 2HD1 LEU 68 1HD1 LEU 68 -6.597 9.449 -15.788 482 3HD1 LEU 68 2HD1 LEU 68 -6.279 11.191 -15.973 483 1HD2 LEU 68 1HD2 LEU 68 -5.637 7.931 -18.244 484 2HD2 LEU 68 2HD2 LEU 68 -3.990 8.422 -17.779 485 3HD2 LEU 68 3HD2 LEU 68 -5.208 8.092 -16.524 486 H ASP 69 H ASP 69 -5.634 11.880 -21.418 487 HA ASP 69 HA ASP 69 -3.663 13.732 -20.898 488 1HB ASP 69 1HB ASP 69 -4.400 12.159 -23.033 489 2HB ASP 69 2HB ASP 69 -4.875 13.735 -23.632 490 HD2 ASP 69 HD ASP 69 -2.847 15.143 -24.281 491 H GLU 70 H GLU 70 -6.940 14.060 -22.458 492 HA GLU 70 HA GLU 70 -6.893 16.682 -23.061 493 1HB GLU 70 1HB GLU 70 -9.161 16.457 -23.403 494 2HB GLU 70 2HB GLU 70 -8.761 14.759 -23.230 495 1HG GLU 70 1HG GLU 70 -9.355 14.843 -20.816 496 2HG GLU 70 2HG GLU 70 -9.696 16.557 -20.943 497 HE2 GLU 70 HE GLU 70 -12.088 16.916 -21.722 498 H ILE 71 H ILE 71 -7.756 15.185 -19.877 499 HA ILE 71 HA ILE 71 -8.275 17.689 -18.650 500 HB ILE 71 HB ILE 71 -7.838 14.894 -17.613 501 1HG1 ILE 71 1HG1 ILE 71 -10.335 16.609 -17.753 502 2HG1 ILE 71 2HG1 ILE 71 -9.903 15.384 -18.929 503 1HG2 ILE 71 3HG2 ILE 71 -7.371 17.179 -16.124 504 2HG2 ILE 71 1HG2 ILE 71 -9.060 16.769 -15.738 505 3HG2 ILE 71 2HG2 ILE 71 -7.773 15.566 -15.489 506 1HD1 ILE 71 2HD1 ILE 71 -9.782 14.431 -16.120 507 2HD1 ILE 71 3HD1 ILE 71 -11.406 14.919 -16.662 508 3HD1 ILE 71 1HD1 ILE 71 -10.511 13.664 -17.551 509 H SER 72 H SER 72 -5.441 15.485 -18.899 510 HA SER 72 HA SER 72 -3.880 16.840 -17.058 511 1HB SER 72 1HB SER 72 -2.125 15.464 -17.793 512 2HB SER 72 2HB SER 72 -3.541 14.524 -18.220 513 HG SER 72 HG SER 72 -1.792 16.034 -19.925 514 H THR 73 H THR 73 -4.785 17.528 -20.398 515 HA THR 73 HA THR 73 -2.664 19.512 -20.675 516 HB THR 73 HB THR 73 -4.693 18.157 -22.485 517 HG1 THR 73 1HG THR 73 -2.559 17.257 -22.213 518 1HG2 THR 73 1HG2 THR 73 -4.306 20.850 -22.806 519 2HG2 THR 73 2HG2 THR 73 -2.851 20.233 -23.627 520 3HG2 THR 73 3HG2 THR 73 -4.466 19.729 -24.180 521 H ASN 74 H ASN 74 -6.115 19.224 -19.950 522 HA ASN 74 HA ASN 74 -7.001 21.673 -20.636 523 1HB ASN 74 1HB ASN 74 -7.692 19.627 -18.609 524 2HB ASN 74 2HB ASN 74 -8.146 21.239 -18.093 525 1HD2 ASN 74 1HD2 ASN 74 -8.727 18.634 -20.257 526 2HD2 ASN 74 2HD2 ASN 74 -10.118 19.263 -21.075 527 H ILE 75 H ILE 75 -4.818 20.685 -17.997 528 HA ILE 75 HA ILE 75 -5.043 23.102 -16.516 529 HB ILE 75 HB ILE 75 -2.762 21.144 -16.416 530 1HG1 ILE 75 1HG1 ILE 75 -4.738 19.769 -16.426 531 2HG1 ILE 75 2HG1 ILE 75 -4.092 19.830 -14.798 532 1HG2 ILE 75 3HG2 ILE 75 -3.964 23.172 -14.556 533 2HG2 ILE 75 1HG2 ILE 75 -3.096 21.760 -13.906 534 3HG2 ILE 75 2HG2 ILE 75 -2.262 22.894 -14.994 535 1HD1 ILE 75 3HD1 ILE 75 -5.749 21.643 -14.237 536 2HD1 ILE 75 1HD1 ILE 75 -6.444 21.456 -15.866 537 3HD1 ILE 75 2HD1 ILE 75 -6.522 20.109 -14.705 538 H ARG 76 H ARG 76 -2.849 21.815 -19.062 539 HA ARG 76 HA ARG 76 -0.967 23.791 -18.917 540 1HB ARG 76 1HB ARG 76 -1.943 21.905 -21.053 541 2HB ARG 76 2HB ARG 76 -0.916 23.224 -21.580 542 1HG ARG 76 1HG ARG 76 0.659 21.548 -21.081 543 2HG ARG 76 2HG ARG 76 0.665 22.502 -19.611 544 1HD ARG 76 1HD ARG 76 -1.236 20.832 -18.820 545 2HD ARG 76 2HD ARG 76 -0.628 19.801 -20.100 546 HE ARG 76 HE ARG 76 1.358 19.454 -18.877 547 2HH1 ARG 76 1HH ARG 76 2.312 20.616 -15.746 548 1HH2 ARG 76 2HH2 ARG 76 -0.522 22.060 -17.386 549 2HH2 ARG 76 1HH2 ARG 76 0.454 22.115 -15.956 550 H GLN 77 H GLN 77 -4.117 23.649 -20.665 551 HA GLN 77 HA GLN 77 -3.683 26.092 -22.007 552 1HB GLN 77 1HB GLN 77 -6.246 24.520 -21.490 553 2HB GLN 77 2HB GLN 77 -6.120 25.880 -22.588 554 1HG GLN 77 1HG GLN 77 -3.991 23.990 -23.175 555 2HG GLN 77 2HG GLN 77 -5.518 23.132 -23.123 556 1HE2 GLN 77 1HE2 GLN 77 -5.659 22.762 -25.281 557 2HE2 GLN 77 2HE2 GLN 77 -5.943 23.987 -26.472 558 H ALA 78 H ALA 78 -4.722 25.169 -18.801 559 HA ALA 78 HA ALA 78 -6.377 27.344 -18.201 560 1HB ALA 78 3HB ALA 78 -5.535 25.030 -16.957 561 2HB ALA 78 2HB ALA 78 -6.472 26.327 -16.177 562 3HB ALA 78 1HB ALA 78 -4.701 26.285 -16.011 563 H GLY 79 H GLY 79 -2.904 27.023 -18.642 564 1HA GLY 79 2HA GLY 79 -2.584 29.812 -17.706 565 2HA GLY 79 1HA GLY 79 -1.754 29.113 -19.082 566 H VAL 80 H VAL 80 -1.619 26.457 -17.374 567 HA VAL 80 HA VAL 80 0.426 27.312 -15.472 568 HB VAL 80 HB VAL 80 -0.635 24.522 -15.807 569 1HG1 VAL 80 1HG1 VAL 80 0.990 26.003 -13.862 570 2HG1 VAL 80 2HG1 VAL 80 -0.337 25.079 -13.118 571 3HG1 VAL 80 3HG1 VAL 80 0.855 24.252 -14.149 572 1HG2 VAL 80 1HG2 VAL 80 -2.245 26.809 -15.214 573 2HG2 VAL 80 2HG2 VAL 80 -2.704 25.090 -15.205 574 3HG2 VAL 80 3HG2 VAL 80 -2.070 25.849 -13.725 575 H GLN 81 H GLN 81 2.159 27.806 -16.881 576 HA GLN 81 HA GLN 81 3.302 25.415 -18.070 577 1HB GLN 81 1HB GLN 81 3.880 26.552 -20.117 578 2HB GLN 81 2HB GLN 81 2.168 26.813 -19.848 579 1HG GLN 81 1HG GLN 81 2.437 29.068 -19.671 580 2HG GLN 81 2HG GLN 81 3.759 28.898 -18.533 581 1HE2 GLN 81 1HE2 GLN 81 4.467 30.802 -19.810 582 2HE2 GLN 81 2HE2 GLN 81 5.455 30.543 -21.209 583 H TYR 82 H TYR 82 3.553 27.667 -15.736 584 HA TYR 82 HA TYR 82 6.459 27.537 -15.774 585 1HB TYR 82 1HB TYR 82 6.537 30.004 -15.339 586 2HB TYR 82 2HB TYR 82 5.716 29.712 -16.859 587 HD1 TYR 82 1HD TYR 82 3.096 29.559 -16.749 588 HD2 TYR 82 2HD TYR 82 5.523 31.345 -13.713 589 HE1 TYR 82 1HE TYR 82 1.090 30.878 -15.912 590 HE2 TYR 82 2HE TYR 82 3.509 32.658 -12.885 591 HH TYR 82 HH TYR 82 0.984 33.302 -14.523 592 H SER 83 H SER 83 6.596 26.248 -13.950 593 HA SER 83 HA SER 83 5.673 27.532 -11.532 594 1HB SER 83 1HB SER 83 5.143 24.909 -10.906 595 2HB SER 83 2HB SER 83 3.929 26.075 -11.395 596 HG SER 83 HG SER 83 4.232 25.354 -13.622 597 H ARG 84 H ARG 84 7.320 24.598 -12.920 598 HA ARG 84 HA ARG 84 9.108 24.596 -10.683 599 1HB ARG 84 1HB ARG 84 9.932 22.488 -11.594 600 2HB ARG 84 2HB ARG 84 8.183 22.469 -11.708 601 1HG ARG 84 1HG ARG 84 8.642 23.517 -14.127 602 2HG ARG 84 2HG ARG 84 10.225 22.795 -13.914 603 1HD ARG 84 1HD ARG 84 9.398 20.609 -13.958 604 2HD ARG 84 2HD ARG 84 7.848 21.061 -13.278 605 HE ARG 84 HE ARG 84 8.015 22.315 -15.814 606 2HH1 ARG 84 1HH ARG 84 6.648 19.800 -17.780 607 1HH2 ARG 84 2HH2 ARG 84 7.905 19.018 -14.521 608 2HH2 ARG 84 1HH2 ARG 84 7.156 18.356 -15.935 609 H ALA 85 H ALA 85 8.992 26.765 -12.917 610 HA ALA 85 HA ALA 85 11.410 26.452 -14.386 611 1HB ALA 85 2HB ALA 85 9.412 27.764 -15.133 612 2HB ALA 85 1HB ALA 85 10.920 28.710 -15.157 613 3HB ALA 85 3HB ALA 85 9.745 28.942 -13.840 614 H ASP 86 H ASP 86 12.369 25.807 -12.031 615 HA ASP 86 HA ASP 86 13.419 28.277 -10.900 616 1HB ASP 86 1HB ASP 86 13.646 25.538 -9.612 617 2HB ASP 86 2HB ASP 86 13.731 27.108 -8.838 618 HD2 ASP 86 HD ASP 86 11.419 27.064 -7.498 619 H GLU 87 H GLU 87 14.511 27.356 -13.351 620 HA GLU 87 HA GLU 87 16.739 25.665 -12.743 621 1HB GLU 87 1HB GLU 87 15.937 27.121 -15.301 622 2HB GLU 87 2HB GLU 87 17.279 26.001 -15.182 623 1HG GLU 87 1HG GLU 87 14.858 24.811 -14.046 624 2HG GLU 87 2HG GLU 87 14.554 25.367 -15.680 625 HE2 GLU 87 HE GLU 87 16.068 24.639 -17.251 626 H GLU 88 H GLU 88 16.186 28.667 -11.781 627 HA GLU 88 HA GLU 88 18.093 30.287 -12.864 628 1HB GLU 88 1HB GLU 88 16.305 30.344 -10.663 629 2HB GLU 88 2HB GLU 88 17.880 30.696 -9.981 630 1HG GLU 88 1HG GLU 88 17.430 32.839 -10.660 631 2HG GLU 88 2HG GLU 88 17.991 32.269 -12.219 632 HE2 GLU 88 HE GLU 88 15.915 34.157 -11.367 633 H GLN 89 H GLN 89 18.374 27.937 -10.125 634 HA GLN 89 HA GLN 89 21.214 28.477 -10.053 635 1HB GLN 89 1HB GLN 89 21.205 27.151 -7.975 636 2HB GLN 89 2HB GLN 89 19.986 28.409 -7.908 637 1HG GLN 89 1HG GLN 89 18.196 26.880 -8.215 638 2HG GLN 89 2HG GLN 89 19.229 25.655 -8.924 639 1HE2 GLN 89 1HE2 GLN 89 17.483 26.363 -6.305 640 2HE2 GLN 89 2HE2 GLN 89 18.322 25.500 -5.060 641 H GLN 90 H GLN 90 19.739 27.017 -12.298 642 HA GLN 90 HA GLN 90 20.616 24.316 -11.974 643 1HB GLN 90 1HB GLN 90 18.509 24.865 -13.176 644 2HB GLN 90 2HB GLN 90 19.416 25.759 -14.379 645 1HG GLN 90 1HG GLN 90 19.151 23.658 -15.413 646 2HG GLN 90 2HG GLN 90 20.760 23.535 -14.729 647 1HE2 GLN 90 1HE2 GLN 90 19.751 21.236 -15.244 648 2HE2 GLN 90 2HE2 GLN 90 19.133 20.393 -13.863 649 H GLN 91 H GLN 91 21.311 26.987 -14.354 650 HA GLN 91 HA GLN 91 23.395 25.739 -15.592 651 1HB GLN 91 1HB GLN 91 22.124 28.054 -16.000 652 2HB GLN 91 2HB GLN 91 23.500 28.721 -15.144 653 1HG GLN 91 1HG GLN 91 25.011 28.153 -16.823 654 2HG GLN 91 2HG GLN 91 24.106 26.735 -17.315 655 1HE2 GLN 91 1HE2 GLN 91 24.066 30.272 -17.289 656 2HE2 GLN 91 2HE2 GLN 91 23.169 30.503 -18.753 657 H ALA 92 H ALA 92 23.212 27.083 -12.375 658 HA ALA 92 HA ALA 92 25.851 27.825 -11.953 659 1HB ALA 92 1HB ALA 92 23.900 26.544 -9.997 660 2HB ALA 92 2HB ALA 92 25.298 27.567 -9.589 661 3HB ALA 92 3HB ALA 92 23.904 28.265 -10.449 662 H LEU 93 H LEU 93 24.393 24.774 -10.640 663 HA LEU 93 HA LEU 93 26.840 23.520 -10.304 664 1HB LEU 93 1HB LEU 93 25.591 21.553 -9.865 665 2HB LEU 93 2HB LEU 93 24.725 22.922 -9.196 666 HG LEU 93 HG LEU 93 23.407 22.821 -11.484 667 1HD1 LEU 93 2HD1 LEU 93 25.097 20.809 -12.051 668 2HD1 LEU 93 3HD1 LEU 93 23.783 19.884 -11.286 669 3HD1 LEU 93 1HD1 LEU 93 23.441 20.914 -12.698 670 1HD2 LEU 93 2HD2 LEU 93 22.628 22.425 -9.072 671 2HD2 LEU 93 3HD2 LEU 93 21.668 21.707 -10.387 672 3HD2 LEU 93 1HD2 LEU 93 22.784 20.691 -9.443 673 H SER 94 H SER 94 24.642 23.720 -13.120 674 HA SER 94 HA SER 94 25.502 21.711 -14.647 675 1HB SER 94 1HB SER 94 24.562 22.855 -16.433 676 2HB SER 94 2HB SER 94 23.875 23.763 -15.101 677 HG SER 94 HG SER 94 26.100 24.478 -16.791 678 H SER 95 H SER 95 27.102 24.947 -14.270 679 HA SER 95 HA SER 95 29.113 24.562 -16.073 680 1HB SER 95 1HB SER 95 28.409 26.607 -14.508 681 2HB SER 95 2HB SER 95 29.678 25.985 -13.471 682 HG SER 95 HG SER 95 30.138 26.462 -16.279 683 H GLN 96 H GLN 96 28.882 23.603 -12.600 684 HA GLN 96 HA GLN 96 31.505 22.424 -12.765 685 1HB GLN 96 1HB GLN 96 30.450 23.745 -10.741 686 2HB GLN 96 2HB GLN 96 29.661 22.225 -10.370 687 1HG GLN 96 1HG GLN 96 31.947 21.101 -10.429 688 2HG GLN 96 2HG GLN 96 32.670 22.686 -10.623 689 1HE2 GLN 96 1HE2 GLN 96 30.323 20.950 -8.588 690 2HE2 GLN 96 2HE2 GLN 96 30.780 21.654 -7.072 691 H MET 97 H MET 97 28.833 21.487 -14.158 692 HA MET 97 HA MET 97 28.793 18.807 -13.030 693 1HB MET 97 1HB MET 97 26.652 20.249 -13.416 694 2HB MET 97 2HB MET 97 26.917 20.008 -15.132 695 1HG MET 97 1HG MET 97 26.909 17.572 -13.345 696 2HG MET 97 2HG MET 97 25.372 18.333 -13.704 697 1HE MET 97 2HE MET 97 25.091 15.782 -14.532 698 2HE MET 97 3HE MET 97 25.704 15.185 -16.093 699 3HE MET 97 1HE MET 97 26.796 15.296 -14.692 700 H GLY 98 H GLY 98 30.740 17.990 -13.983 701 1HA GLY 98 2HA GLY 98 31.511 18.289 -16.633 702 2HA GLY 98 1HA GLY 98 30.433 16.908 -16.583 703 H PHE 99 H PHE 99 33.624 17.679 -16.560 704 HA PHE 99 HA PHE 99 34.522 15.194 -15.867 705 1HB PHE 99 1HB PHE 99 35.859 16.855 -17.101 706 2HB PHE 99 2HB PHE 99 35.737 18.011 -15.789 707 HD1 PHE 99 1HD PHE 99 36.963 17.531 -13.632 708 HD2 PHE 99 2HD PHE 99 37.618 15.283 -17.171 709 HE1 PHE 99 1HE PHE 99 39.148 16.712 -12.708 710 HE2 PHE 99 2HE PHE 99 39.803 14.464 -16.247 711 HZ PHE 99 HZ PHE 99 40.542 15.189 -14.027 712 H MET 601 H MET 601 8.549 -21.144 -24.281 713 HA MET 601 HA MET 601 9.467 -18.679 -25.166 714 1HB MET 601 1HB MET 601 10.531 -21.200 -24.516 715 2HB MET 601 2HB MET 601 10.874 -21.078 -26.230 716 1HG MET 601 1HG MET 601 12.541 -19.573 -25.865 717 2HG MET 601 2HG MET 601 11.480 -18.535 -24.933 718 1HE MET 601 1HE MET 601 12.977 -17.718 -23.648 719 2HE MET 601 2HE MET 601 12.576 -18.255 -21.999 720 3HE MET 601 3HE MET 601 14.215 -18.512 -22.645 721 H THR 602 H THR 602 8.646 -21.703 -27.013 722 HA THR 602 HA THR 602 9.201 -20.830 -29.541 723 HB THR 602 HB THR 602 8.545 -23.140 -28.951 724 HG1 THR 602 1HG THR 602 6.813 -23.231 -30.703 725 1HG2 THR 602 2HG2 THR 602 6.687 -22.433 -27.298 726 2HG2 THR 602 3HG2 THR 602 5.688 -22.076 -28.727 727 3HG2 THR 602 1HG2 THR 602 6.252 -23.738 -28.428 728 H GLU 603 H GLU 603 6.561 -19.818 -27.415 729 HA GLU 603 HA GLU 603 5.965 -17.776 -29.335 730 1HB GLU 603 1HB GLU 603 3.552 -18.231 -29.414 731 2HB GLU 603 2HB GLU 603 4.443 -19.611 -30.023 732 1HG GLU 603 1HG GLU 603 4.309 -20.563 -27.607 733 2HG GLU 603 2HG GLU 603 3.126 -19.308 -27.293 734 HE2 GLU 603 HE GLU 603 1.151 -20.051 -27.598 735 H GLN 604 H GLN 604 5.886 -15.895 -28.188 736 HA GLN 604 HA GLN 604 5.573 -16.094 -25.348 737 1HB GLN 604 1HB GLN 604 6.197 -13.695 -25.356 738 2HB GLN 604 2HB GLN 604 7.339 -14.655 -26.275 739 1HG GLN 604 1HG GLN 604 5.085 -13.671 -27.923 740 2HG GLN 604 2HG GLN 604 6.010 -12.372 -27.195 741 1HE2 GLN 604 1HE2 GLN 604 6.919 -11.676 -29.074 742 2HE2 GLN 604 2HE2 GLN 604 8.123 -12.550 -29.961 743 H GLN 605 H GLN 605 3.394 -16.170 -27.777 744 HA GLN 605 HA GLN 605 1.660 -14.189 -27.642 745 1HB GLN 605 1HB GLN 605 1.188 -17.184 -27.678 746 2HB GLN 605 2HB GLN 605 -0.167 -16.074 -27.742 747 1HG GLN 605 1HG GLN 605 1.507 -14.963 -29.640 748 2HG GLN 605 2HG GLN 605 1.900 -16.662 -29.808 749 1HE2 GLN 605 1HE2 GLN 605 0.832 -15.621 -31.927 750 2HE2 GLN 605 2HE2 GLN 605 -0.832 -16.045 -32.157 751 H TRP 606 H TRP 606 2.117 -16.715 -25.114 752 HA TRP 606 HA TRP 606 1.267 -14.995 -23.068 753 1HB TRP 606 1HB TRP 606 -0.833 -15.845 -22.444 754 2HB TRP 606 2HB TRP 606 -0.946 -15.429 -24.142 755 HD1 TRP 606 HD TRP 606 -1.529 -17.422 -25.829 756 HE1 TRP 606 1HE TRP 606 -2.196 -19.967 -25.619 757 HE3 TRP 606 3HE TRP 606 -0.285 -17.884 -20.921 758 HZ2 TRP 606 2HZ TRP 606 -2.130 -21.845 -23.471 759 HZ3 TRP 606 3HZ TRP 606 -0.617 -20.107 -19.843 760 HH2 TRP 606 HH TRP 606 -1.504 -22.047 -21.036 761 H ASN 607 H ASN 607 2.939 -15.679 -21.772 762 HA ASN 607 HA ASN 607 3.735 -18.399 -21.816 763 1HB ASN 607 1HB ASN 607 5.324 -16.463 -21.457 764 2HB ASN 607 2HB ASN 607 4.544 -16.128 -19.923 765 1HD2 ASN 607 1HD2 ASN 607 6.622 -16.427 -18.982 766 2HD2 ASN 607 2HD2 ASN 607 7.225 -18.009 -18.615 767 H PHE 608 H PHE 608 3.416 -19.955 -20.105 768 HA PHE 608 HA PHE 608 1.057 -19.854 -18.712 769 1HB PHE 608 1HB PHE 608 2.341 -21.919 -19.135 770 2HB PHE 608 2HB PHE 608 3.741 -21.284 -18.293 771 HD1 PHE 608 1HD PHE 608 0.520 -22.925 -17.931 772 HD2 PHE 608 2HD PHE 608 3.757 -21.160 -15.830 773 HE1 PHE 608 1HE PHE 608 -0.252 -24.029 -15.814 774 HE2 PHE 608 2HE PHE 608 2.985 -22.265 -13.713 775 HZ PHE 608 HZ PHE 608 0.989 -23.686 -13.730 776 H ALA 609 H ALA 609 4.407 -19.069 -17.569 777 HA ALA 609 HA ALA 609 3.554 -18.481 -14.931 778 1HB ALA 609 3HB ALA 609 6.039 -17.223 -15.937 779 2HB ALA 609 1HB ALA 609 5.786 -18.308 -14.548 780 3HB ALA 609 2HB ALA 609 5.945 -18.983 -16.188 781 H GLY 610 H GLY 610 2.982 -16.938 -17.884 782 1HA GLY 610 2HA GLY 610 2.841 -14.676 -18.442 783 2HA GLY 610 1HA GLY 610 3.084 -14.230 -16.765 784 H ILE 611 H ILE 611 0.754 -16.278 -18.678 785 HA ILE 611 HA ILE 611 -1.447 -14.672 -18.163 786 HB ILE 611 HB ILE 611 -1.204 -16.391 -19.939 787 1HG1 ILE 611 1HG1 ILE 611 -3.400 -15.334 -19.083 788 2HG1 ILE 611 2HG1 ILE 611 -3.488 -16.728 -20.141 789 1HG2 ILE 611 2HG2 ILE 611 -1.414 -18.234 -17.578 790 2HG2 ILE 611 3HG2 ILE 611 -2.045 -18.734 -19.165 791 3HG2 ILE 611 1HG2 ILE 611 -0.327 -18.303 -18.986 792 1HD1 ILE 611 3HD1 ILE 611 -3.378 -18.007 -17.731 793 2HD1 ILE 611 1HD1 ILE 611 -4.179 -16.493 -17.245 794 3HD1 ILE 611 2HD1 ILE 611 -4.902 -17.517 -18.509 795 H GLU 612 H GLU 612 0.215 -17.080 -16.185 796 HA GLU 612 HA GLU 612 -1.914 -17.621 -14.471 797 1HB GLU 612 1HB GLU 612 0.023 -19.086 -14.552 798 2HB GLU 612 2HB GLU 612 1.105 -17.783 -14.101 799 1HG GLU 612 1HG GLU 612 0.823 -18.829 -12.033 800 2HG GLU 612 2HG GLU 612 -0.437 -17.613 -11.945 801 HE2 GLU 612 HE GLU 612 -1.017 -21.452 -12.663 802 H ALA 613 H ALA 613 0.933 -15.380 -14.128 803 HA ALA 613 HA ALA 613 -0.213 -14.197 -11.779 804 1HB ALA 613 1HB ALA 613 1.852 -13.206 -11.538 805 2HB ALA 613 3HB ALA 613 2.052 -12.944 -13.288 806 3HB ALA 613 2HB ALA 613 2.315 -14.562 -12.594 807 H ALA 614 H ALA 614 -0.565 -13.860 -15.203 808 HA ALA 614 HA ALA 614 -0.870 -11.180 -15.596 809 1HB ALA 614 2HB ALA 614 -2.536 -13.477 -16.704 810 2HB ALA 614 3HB ALA 614 -2.426 -11.846 -17.409 811 3HB ALA 614 1HB ALA 614 -0.987 -12.892 -17.356 812 H ALA 615 H ALA 615 -3.387 -13.535 -14.444 813 HA ALA 615 HA ALA 615 -5.428 -11.702 -14.136 814 1HB ALA 615 2HB ALA 615 -6.474 -13.598 -13.538 815 2HB ALA 615 3HB ALA 615 -4.904 -14.436 -13.578 816 3HB ALA 615 1HB ALA 615 -5.489 -13.716 -12.060 817 H SER 616 H SER 616 -3.001 -12.859 -11.689 818 HA SER 616 HA SER 616 -3.871 -11.340 -9.614 819 1HB SER 616 1HB SER 616 -1.684 -13.007 -10.160 820 2HB SER 616 2HB SER 616 -0.930 -11.474 -9.768 821 HG SER 616 HG SER 616 -1.267 -12.768 -7.862 822 H ALA 617 H ALA 617 -2.022 -10.411 -12.503 823 HA ALA 617 HA ALA 617 -1.117 -7.922 -11.470 824 1HB ALA 617 1HB ALA 617 -0.511 -9.525 -13.622 825 2HB ALA 617 3HB ALA 617 0.014 -7.835 -13.435 826 3HB ALA 617 2HB ALA 617 -1.435 -8.216 -14.396 827 H ILE 618 H ILE 618 -3.977 -9.091 -13.302 828 HA ILE 618 HA ILE 618 -4.985 -6.579 -13.977 829 HB ILE 618 HB ILE 618 -6.365 -9.223 -13.509 830 1HG1 ILE 618 1HG1 ILE 618 -4.603 -9.242 -15.245 831 2HG1 ILE 618 2HG1 ILE 618 -6.207 -9.532 -15.890 832 1HG2 ILE 618 3HG2 ILE 618 -7.893 -7.248 -13.348 833 2HG2 ILE 618 1HG2 ILE 618 -7.433 -6.824 -15.015 834 3HG2 ILE 618 2HG2 ILE 618 -8.261 -8.364 -14.684 835 1HD1 ILE 618 3HD1 ILE 618 -5.623 -6.665 -15.856 836 2HD1 ILE 618 1HD1 ILE 618 -4.376 -7.567 -16.750 837 3HD1 ILE 618 2HD1 ILE 618 -6.085 -7.705 -17.225 838 H GLN 619 H GLN 619 -5.407 -8.655 -11.058 839 HA GLN 619 HA GLN 619 -7.353 -7.147 -9.856 840 1HB GLN 619 1HB GLN 619 -5.450 -9.237 -9.088 841 2HB GLN 619 2HB GLN 619 -5.712 -8.113 -7.769 842 1HG GLN 619 1HG GLN 619 -7.991 -9.397 -9.342 843 2HG GLN 619 2HG GLN 619 -7.340 -10.084 -7.868 844 1HE2 GLN 619 1HE2 GLN 619 -9.929 -8.690 -8.804 845 2HE2 GLN 619 2HE2 GLN 619 -10.306 -7.577 -7.531 846 H GLY 620 H GLY 620 -3.753 -6.995 -9.329 847 1HA GLY 620 2HA GLY 620 -2.427 -5.327 -8.620 848 2HA GLY 620 1HA GLY 620 -3.760 -4.798 -7.613 849 H ASN 621 H ASN 621 -3.833 -5.030 -11.204 850 HA ASN 621 HA ASN 621 -3.269 -2.302 -11.574 851 1HB ASN 621 1HB ASN 621 -4.392 -4.526 -13.325 852 2HB ASN 621 2HB ASN 621 -4.347 -2.881 -13.927 853 1HD2 ASN 621 1HD2 ASN 621 -2.216 -1.726 -13.598 854 2HD2 ASN 621 2HD2 ASN 621 -0.768 -2.604 -13.962 855 H VAL 622 H VAL 622 -6.171 -4.327 -11.086 856 HA VAL 622 HA VAL 622 -8.079 -2.491 -12.019 857 HB VAL 622 HB VAL 622 -8.125 -4.846 -10.144 858 1HG1 VAL 622 3HG1 VAL 622 -10.346 -2.921 -10.805 859 2HG1 VAL 622 1HG1 VAL 622 -10.700 -4.638 -10.496 860 3HG1 VAL 622 2HG1 VAL 622 -9.909 -3.653 -9.242 861 1HG2 VAL 622 2HG2 VAL 622 -7.984 -4.724 -12.870 862 2HG2 VAL 622 3HG2 VAL 622 -8.679 -6.080 -11.950 863 3HG2 VAL 622 1HG2 VAL 622 -9.743 -4.818 -12.616 864 H THR 623 H THR 623 -6.907 -3.262 -8.665 865 HA THR 623 HA THR 623 -8.393 -1.231 -7.428 866 HB THR 623 HB THR 623 -6.805 -1.716 -5.537 867 HG1 THR 623 1HG THR 623 -4.979 -3.039 -6.093 868 1HG2 THR 623 1HG2 THR 623 -7.937 -3.997 -7.186 869 2HG2 THR 623 2HG2 THR 623 -6.897 -4.367 -5.790 870 3HG2 THR 623 3HG2 THR 623 -8.409 -3.457 -5.557 871 H SER 624 H SER 624 -5.178 -1.238 -9.000 872 HA SER 624 HA SER 624 -4.223 1.103 -8.020 873 1HB SER 624 1HB SER 624 -3.721 -0.629 -10.296 874 2HB SER 624 2HB SER 624 -3.570 1.042 -10.803 875 HG SER 624 HG SER 624 -1.689 -0.306 -9.641 876 H ILE 625 H ILE 625 -6.462 0.555 -10.814 877 HA ILE 625 HA ILE 625 -6.648 3.329 -11.417 878 HB ILE 625 HB ILE 625 -7.893 0.797 -12.357 879 1HG1 ILE 625 1HG1 ILE 625 -7.284 2.427 -14.509 880 2HG1 ILE 625 2HG1 ILE 625 -6.057 2.866 -13.337 881 1HG2 ILE 625 3HG2 ILE 625 -9.150 3.521 -12.631 882 2HG2 ILE 625 1HG2 ILE 625 -9.365 2.267 -13.876 883 3HG2 ILE 625 2HG2 ILE 625 -9.905 1.965 -12.207 884 1HD1 ILE 625 3HD1 ILE 625 -6.718 -0.022 -14.065 885 2HD1 ILE 625 1HD1 ILE 625 -5.418 0.922 -14.832 886 3HD1 ILE 625 2HD1 ILE 625 -5.342 0.552 -13.092 887 H HIS 626 H HIS 626 -8.281 1.055 -9.246 888 HA HIS 626 HA HIS 626 -10.633 2.485 -8.878 889 1HB HIS 626 1HB HIS 626 -10.017 0.109 -8.153 890 2HB HIS 626 2HB HIS 626 -9.236 0.838 -6.764 891 HD1 HIS 626 1HD HIS 626 -11.076 -0.543 -5.357 892 HD2 HIS 626 2HD HIS 626 -12.534 2.618 -7.697 893 HE1 HIS 626 1HE HIS 626 -13.427 -0.044 -4.499 894 H SER 627 H SER 627 -7.434 2.654 -7.200 895 HA SER 627 HA SER 627 -8.383 4.757 -5.529 896 1HB SER 627 1HB SER 627 -5.691 3.412 -5.938 897 2HB SER 627 2HB SER 627 -5.845 4.830 -4.920 898 HG SER 627 HG SER 627 -7.007 2.223 -4.566 899 H LEU 628 H LEU 628 -6.093 4.372 -8.312 900 HA LEU 628 HA LEU 628 -5.062 6.852 -8.507 901 1HB LEU 628 1HB LEU 628 -5.806 4.733 -10.441 902 2HB LEU 628 2HB LEU 628 -5.481 6.319 -11.113 903 HG LEU 628 HG LEU 628 -3.489 5.226 -9.178 904 1HD1 LEU 628 1HD1 LEU 628 -4.228 3.892 -11.708 905 2HD1 LEU 628 2HD1 LEU 628 -2.491 4.208 -11.486 906 3HD1 LEU 628 3HD1 LEU 628 -3.385 3.263 -10.271 907 1HD2 LEU 628 1HD2 LEU 628 -3.361 7.493 -10.296 908 2HD2 LEU 628 2HD2 LEU 628 -1.926 6.454 -10.463 909 3HD2 LEU 628 3HD2 LEU 628 -3.062 6.627 -11.822 910 H LEU 629 H LEU 629 -8.248 5.802 -9.905 911 HA LEU 629 HA LEU 629 -8.986 8.237 -10.934 912 1HB LEU 629 1HB LEU 629 -10.201 5.701 -10.319 913 2HB LEU 629 2HB LEU 629 -11.309 7.000 -9.924 914 HG LEU 629 HG LEU 629 -11.538 6.051 -12.234 915 1HD1 LEU 629 1HD1 LEU 629 -11.206 8.934 -11.583 916 2HD1 LEU 629 2HD1 LEU 629 -11.350 8.497 -13.302 917 3HD1 LEU 629 3HD1 LEU 629 -12.632 8.036 -12.156 918 1HD2 LEU 629 2HD2 LEU 629 -8.991 5.869 -12.518 919 2HD2 LEU 629 3HD2 LEU 629 -9.956 6.395 -13.918 920 3HD2 LEU 629 1HD2 LEU 629 -9.052 7.592 -12.960 921 H ASP 630 H ASP 630 -9.352 6.955 -7.581 922 HA ASP 630 HA ASP 630 -10.821 9.124 -6.664 923 1HB ASP 630 1HB ASP 630 -10.662 6.985 -5.444 924 2HB ASP 630 2HB ASP 630 -8.937 7.203 -5.221 925 HD2 ASP 630 HD ASP 630 -8.303 8.634 -3.624 926 H GLU 631 H GLU 631 -7.381 8.542 -7.284 927 HA GLU 631 HA GLU 631 -6.445 10.606 -5.596 928 1HB GLU 631 1HB GLU 631 -5.324 8.555 -7.330 929 2HB GLU 631 2HB GLU 631 -4.519 10.083 -7.627 930 1HG GLU 631 1HG GLU 631 -4.797 8.622 -4.967 931 2HG GLU 631 2HG GLU 631 -3.317 8.977 -5.837 932 HE2 GLU 631 HE GLU 631 -4.616 10.459 -3.035 933 H GLY 632 H GLY 632 -7.025 10.250 -9.155 934 1HA GLY 632 2HA GLY 632 -7.105 11.781 -10.809 935 2HA GLY 632 1HA GLY 632 -6.191 12.889 -9.804 936 H LYS 633 H LYS 633 -9.322 11.347 -8.916 937 HA LYS 633 HA LYS 633 -11.038 13.325 -9.734 938 1HB LYS 633 1HB LYS 633 -11.546 11.019 -8.778 939 2HB LYS 633 2HB LYS 633 -11.347 11.723 -7.186 940 1HG LYS 633 1HG LYS 633 -13.715 11.794 -7.766 941 2HG LYS 633 2HG LYS 633 -13.103 13.436 -7.746 942 1HD LYS 633 1HD LYS 633 -12.639 12.642 -10.388 943 2HD LYS 633 2HD LYS 633 -14.157 11.852 -10.012 944 1HE LYS 633 1HE LYS 633 -15.298 13.871 -9.681 945 2HE LYS 633 2HE LYS 633 -13.855 14.734 -9.184 946 H GLN 634 H GLN 634 -8.881 13.182 -6.885 947 HA GLN 634 HA GLN 634 -10.034 15.376 -5.596 948 1HB GLN 634 1HB GLN 634 -7.325 14.014 -5.410 949 2HB GLN 634 2HB GLN 634 -7.701 15.419 -4.433 950 1HG GLN 634 1HG GLN 634 -9.755 14.213 -3.568 951 2HG GLN 634 2HG GLN 634 -9.263 12.793 -4.470 952 1HE2 GLN 634 1HE2 GLN 634 -8.223 15.109 -2.008 953 2HE2 GLN 634 2HE2 GLN 634 -7.199 14.042 -1.105 954 H SER 635 H SER 635 -7.492 15.002 -8.090 955 HA SER 635 HA SER 635 -6.662 17.697 -7.894 956 1HB SER 635 1HB SER 635 -5.900 15.297 -9.354 957 2HB SER 635 2HB SER 635 -5.974 16.657 -10.457 958 HG SER 635 HG SER 635 -4.175 17.434 -9.605 959 H LEU 636 H LEU 636 -9.321 16.005 -9.373 960 HA LEU 636 HA LEU 636 -9.735 17.634 -11.613 961 1HB LEU 636 1HB LEU 636 -11.069 15.495 -10.198 962 2HB LEU 636 2HB LEU 636 -12.223 16.713 -10.704 963 HG LEU 636 HG LEU 636 -11.891 14.827 -12.314 964 1HD1 LEU 636 3HD1 LEU 636 -11.716 17.710 -12.958 965 2HD1 LEU 636 1HD1 LEU 636 -11.327 16.589 -14.284 966 3HD1 LEU 636 2HD1 LEU 636 -12.902 16.482 -13.461 967 1HD2 LEU 636 3HD2 LEU 636 -9.483 14.511 -12.007 968 2HD2 LEU 636 1HD2 LEU 636 -9.894 14.780 -13.717 969 3HD2 LEU 636 2HD2 LEU 636 -9.174 16.095 -12.758 970 H THR 637 H THR 637 -11.109 17.754 -8.256 971 HA THR 637 HA THR 637 -12.486 20.196 -8.780 972 HB THR 637 HB THR 637 -13.414 18.738 -7.118 973 HG1 THR 637 1HG THR 637 -11.716 20.628 -5.661 974 1HG2 THR 637 3HG2 THR 637 -10.550 18.601 -6.096 975 2HG2 THR 637 1HG2 THR 637 -11.914 18.291 -4.996 976 3HG2 THR 637 2HG2 THR 637 -11.672 17.260 -6.427 977 H LYS 638 H LYS 638 -9.239 19.314 -7.673 978 HA LYS 638 HA LYS 638 -8.705 21.946 -6.671 979 1HB LYS 638 1HB LYS 638 -6.868 19.596 -7.227 980 2HB LYS 638 2HB LYS 638 -6.405 21.071 -6.401 981 1HG LYS 638 1HG LYS 638 -7.693 20.584 -4.497 982 2HG LYS 638 2HG LYS 638 -8.825 19.583 -5.383 983 1HD LYS 638 1HD LYS 638 -7.580 17.980 -4.190 984 2HD LYS 638 2HD LYS 638 -6.790 17.968 -5.754 985 1HE LYS 638 1HE LYS 638 -5.111 18.059 -3.936 986 2HE LYS 638 2HE LYS 638 -5.035 19.512 -4.912 987 H LEU 639 H LEU 639 -8.651 20.284 -9.759 988 HA LEU 639 HA LEU 639 -6.977 22.393 -10.892 989 1HB LEU 639 1HB LEU 639 -7.916 19.735 -11.972 990 2HB LEU 639 2HB LEU 639 -7.032 20.917 -12.917 991 HG LEU 639 HG LEU 639 -5.895 19.879 -10.328 992 1HD1 LEU 639 3HD1 LEU 639 -6.597 17.957 -11.818 993 2HD1 LEU 639 1HD1 LEU 639 -5.409 18.554 -13.001 994 3HD1 LEU 639 2HD1 LEU 639 -4.871 18.027 -11.389 995 1HD2 LEU 639 2HD2 LEU 639 -4.962 21.889 -11.620 996 2HD2 LEU 639 3HD2 LEU 639 -3.826 20.602 -11.149 997 3HD2 LEU 639 1HD2 LEU 639 -4.416 20.699 -12.825 998 H ALA 640 H ALA 640 -10.245 21.580 -10.292 999 HA ALA 640 HA ALA 640 -11.619 22.243 -12.527 1000 1HB ALA 640 1HB ALA 640 -13.425 22.830 -11.048 1001 2HB ALA 640 2HB ALA 640 -12.491 21.540 -10.253 1002 3HB ALA 640 3HB ALA 640 -12.295 23.230 -9.732 1003 H ALA 641 H ALA 641 -9.912 24.435 -10.246 1004 HA ALA 641 HA ALA 641 -10.903 26.837 -11.205 1005 1HB ALA 641 2HB ALA 641 -9.392 27.720 -9.751 1006 2HB ALA 641 3HB ALA 641 -9.167 26.027 -9.249 1007 3HB ALA 641 1HB ALA 641 -8.044 26.767 -10.415 1008 H ALA 642 H ALA 642 -8.530 24.559 -12.540 1009 HA ALA 642 HA ALA 642 -7.312 26.353 -14.333 1010 1HB ALA 642 1HB ALA 642 -6.767 23.865 -13.479 1011 2HB ALA 642 3HB ALA 642 -6.152 24.491 -15.028 1012 3HB ALA 642 2HB ALA 642 -7.594 23.447 -14.999 1013 H TRP 643 H TRP 643 -10.460 24.866 -14.201 1014 HA TRP 643 HA TRP 643 -10.851 25.193 -17.071 1015 1HB TRP 643 1HB TRP 643 -12.363 23.833 -14.866 1016 2HB TRP 643 2HB TRP 643 -13.183 24.274 -16.351 1017 HD1 TRP 643 HD TRP 643 -12.588 22.818 -18.545 1018 HE1 TRP 643 1HE TRP 643 -11.314 20.555 -19.013 1019 HE3 TRP 643 3HE TRP 643 -10.351 22.526 -13.989 1020 HZ2 TRP 643 2HZ TRP 643 -9.553 18.933 -17.460 1021 HZ3 TRP 643 3HZ TRP 643 -8.870 20.571 -13.545 1022 HH2 TRP 643 HH TRP 643 -8.456 18.812 -15.192 1023 H GLY 644 H GLY 644 -10.563 27.258 -14.611 1024 1HA GLY 644 2HA GLY 644 -12.450 29.140 -15.733 1025 2HA GLY 644 1HA GLY 644 -11.228 29.439 -14.514 1026 H GLY 645 H GLY 645 -11.715 27.876 -12.395 1027 1HA GLY 645 2HA GLY 645 -14.385 28.736 -11.543 1028 2HA GLY 645 1HA GLY 645 -13.039 28.280 -10.518 1029 H SER 646 H SER 646 -14.667 26.892 -9.393 1030 HA SER 646 HA SER 646 -14.728 24.313 -10.705 1031 1HB SER 646 1HB SER 646 -15.515 23.637 -8.280 1032 2HB SER 646 2HB SER 646 -13.828 24.005 -8.576 1033 HG SER 646 HG SER 646 -15.451 25.179 -6.806 1034 H GLY 647 H GLY 647 -16.724 27.040 -9.937 1035 1HA GLY 647 2HA GLY 647 -19.016 27.194 -9.586 1036 2HA GLY 647 1HA GLY 647 -19.202 25.484 -9.916 1037 H SER 648 H SER 648 -17.233 25.963 -12.342 1038 HA SER 648 HA SER 648 -19.111 27.372 -14.045 1039 1HB SER 648 1HB SER 648 -16.180 26.916 -14.046 1040 2HB SER 648 2HB SER 648 -16.916 26.750 -15.627 1041 HG SER 648 HG SER 648 -18.046 28.931 -14.678 1042 H GLU 649 H GLU 649 -19.987 26.377 -15.955 1043 HA GLU 649 HA GLU 649 -20.556 23.690 -15.688 1044 1HB GLU 649 1HB GLU 649 -21.597 23.897 -17.917 1045 2HB GLU 649 2HB GLU 649 -21.988 25.282 -16.917 1046 1HG GLU 649 1HG GLU 649 -20.083 26.549 -18.011 1047 2HG GLU 649 2HG GLU 649 -19.827 25.180 -19.074 1048 HE2 GLU 649 HE GLU 649 -21.732 27.245 -21.022 1049 H ALA 650 H ALA 650 -17.845 25.377 -17.174 1050 HA ALA 650 HA ALA 650 -17.034 23.500 -19.040 1051 1HB ALA 650 3HB ALA 650 -15.949 25.821 -17.622 1052 2HB ALA 650 2HB ALA 650 -15.660 25.270 -19.290 1053 3HB ALA 650 1HB ALA 650 -14.702 24.593 -17.951 1054 H TYR 651 H TYR 651 -15.634 23.938 -15.709 1055 HA TYR 651 HA TYR 651 -14.237 21.575 -15.658 1056 1HB TYR 651 1HB TYR 651 -13.888 23.202 -13.918 1057 2HB TYR 651 2HB TYR 651 -15.607 23.454 -13.689 1058 HD1 TYR 651 1HD TYR 651 -13.025 20.762 -13.265 1059 HD2 TYR 651 2HD TYR 651 -16.620 22.559 -11.797 1060 HE1 TYR 651 1HE TYR 651 -12.993 19.202 -11.257 1061 HE2 TYR 651 2HE TYR 651 -16.576 20.993 -9.794 1062 HH TYR 651 HH TYR 651 -15.443 19.496 -8.708 1063 H GLN 652 H GLN 652 -17.709 22.182 -15.087 1064 HA GLN 652 HA GLN 652 -18.295 19.856 -13.748 1065 1HB GLN 652 1HB GLN 652 -19.895 21.656 -15.591 1066 2HB GLN 652 2HB GLN 652 -20.623 20.217 -14.907 1067 1HG GLN 652 1HG GLN 652 -19.341 21.427 -12.708 1068 2HG GLN 652 2HG GLN 652 -19.989 22.783 -13.609 1069 1HE2 GLN 652 1HE2 GLN 652 -20.821 21.890 -11.049 1070 2HE2 GLN 652 2HE2 GLN 652 -22.484 21.410 -11.134 1071 H GLY 653 H GLY 653 -18.514 20.548 -17.315 1072 1HA GLY 653 2HA GLY 653 -18.357 19.189 -19.098 1073 2HA GLY 653 1HA GLY 653 -19.288 18.035 -18.163 1074 H VAL 654 H VAL 654 -16.167 19.155 -16.913 1075 HA VAL 654 HA VAL 654 -14.708 16.974 -18.082 1076 HB VAL 654 HB VAL 654 -14.074 19.174 -16.122 1077 1HG1 VAL 654 3HG1 VAL 654 -12.802 17.161 -15.471 1078 2HG1 VAL 654 1HG1 VAL 654 -12.171 17.032 -17.131 1079 3HG1 VAL 654 2HG1 VAL 654 -11.744 18.436 -16.123 1080 1HG2 VAL 654 2HG2 VAL 654 -14.093 18.992 -18.954 1081 2HG2 VAL 654 3HG2 VAL 654 -13.516 20.336 -17.940 1082 3HG2 VAL 654 1HG2 VAL 654 -12.388 19.056 -18.448 1083 H GLN 655 H GLN 655 -16.211 17.833 -14.933 1084 HA GLN 655 HA GLN 655 -15.104 15.779 -13.471 1085 1HB GLN 655 1HB GLN 655 -17.279 17.718 -13.190 1086 2HB GLN 655 2HB GLN 655 -17.710 16.189 -12.450 1087 1HG GLN 655 1HG GLN 655 -14.925 16.985 -11.857 1088 2HG GLN 655 2HG GLN 655 -16.093 18.170 -11.306 1089 1HE2 GLN 655 1HE2 GLN 655 -14.730 17.031 -9.402 1090 2HE2 GLN 655 2HE2 GLN 655 -15.626 15.841 -8.519 1091 H GLN 656 H GLN 656 -18.310 15.931 -15.184 1092 HA GLN 656 HA GLN 656 -18.983 13.306 -14.590 1093 1HB GLN 656 1HB GLN 656 -20.514 13.671 -16.709 1094 2HB GLN 656 2HB GLN 656 -20.805 14.600 -15.252 1095 1HG GLN 656 1HG GLN 656 -18.803 15.908 -16.959 1096 2HG GLN 656 2HG GLN 656 -20.293 15.625 -17.837 1097 1HE2 GLN 656 1HE2 GLN 656 -21.180 17.574 -17.916 1098 2HE2 GLN 656 2HE2 GLN 656 -21.611 18.560 -16.558 1099 H LYS 657 H LYS 657 -17.149 14.804 -17.283 1100 HA LYS 657 HA LYS 657 -17.092 12.494 -18.897 1101 1HB LYS 657 1HB LYS 657 -15.595 15.096 -18.802 1102 2HB LYS 657 2HB LYS 657 -15.005 13.804 -19.828 1103 1HG LYS 657 1HG LYS 657 -17.296 13.637 -20.879 1104 2HG LYS 657 2HG LYS 657 -17.820 14.990 -19.898 1105 1HD LYS 657 1HD LYS 657 -15.412 15.872 -21.105 1106 2HD LYS 657 2HD LYS 657 -16.249 14.999 -22.373 1107 1HE LYS 657 1HE LYS 657 -18.347 16.429 -21.349 1108 2HE LYS 657 2HE LYS 657 -17.036 17.527 -20.968 1109 H TRP 658 H TRP 658 -15.318 13.557 -16.037 1110 HA TRP 658 HA TRP 658 -13.119 11.783 -16.446 1111 1HB TRP 658 1HB TRP 658 -12.687 13.716 -15.182 1112 2HB TRP 658 2HB TRP 658 -14.085 13.475 -14.154 1113 HD1 TRP 658 HD TRP 658 -13.748 11.892 -12.015 1114 HE1 TRP 658 1HE TRP 658 -11.711 10.706 -10.829 1115 HE3 TRP 658 3HE TRP 658 -10.456 12.571 -15.830 1116 HZ2 TRP 658 2HZ TRP 658 -9.012 10.197 -11.603 1117 HZ3 TRP 658 3HZ TRP 658 -8.140 11.700 -15.534 1118 HH2 TRP 658 HH TRP 658 -7.399 10.547 -13.510 1119 H ASP 659 H ASP 659 -16.004 11.877 -14.227 1120 HA ASP 659 HA ASP 659 -15.548 9.358 -13.182 1121 1HB ASP 659 1HB ASP 659 -17.173 11.309 -12.463 1122 2HB ASP 659 2HB ASP 659 -18.321 10.544 -13.544 1123 HD2 ASP 659 HD ASP 659 -19.675 9.682 -12.250 1124 H ALA 660 H ALA 660 -17.074 10.553 -16.161 1125 HA ALA 660 HA ALA 660 -18.741 8.465 -16.815 1126 1HB ALA 660 1HB ALA 660 -18.968 10.169 -18.314 1127 2HB ALA 660 2HB ALA 660 -17.246 10.612 -18.231 1128 3HB ALA 660 3HB ALA 660 -17.765 9.240 -19.239 1129 H THR 661 H THR 661 -15.755 8.801 -18.758 1130 HA THR 661 HA THR 661 -15.515 6.111 -19.294 1131 HB THR 661 HB THR 661 -13.287 6.757 -20.118 1132 HG1 THR 661 1HG THR 661 -12.550 8.936 -19.343 1133 1HG2 THR 661 1HG2 THR 661 -15.474 7.955 -21.089 1134 2HG2 THR 661 2HG2 THR 661 -14.780 9.388 -20.292 1135 3HG2 THR 661 3HG2 THR 661 -13.859 8.538 -21.556 1136 H ALA 662 H ALA 662 -14.665 7.868 -16.368 1137 HA ALA 662 HA ALA 662 -12.711 6.222 -15.342 1138 1HB ALA 662 3HB ALA 662 -13.087 8.149 -14.111 1139 2HB ALA 662 2HB ALA 662 -13.942 6.956 -13.104 1140 3HB ALA 662 1HB ALA 662 -14.858 8.000 -14.217 1141 H THR 663 H THR 663 -16.032 6.088 -13.953 1142 HA THR 663 HA THR 663 -15.867 3.546 -12.989 1143 HB THR 663 HB THR 663 -17.708 4.899 -12.314 1144 HG1 THR 663 1HG THR 663 -19.551 3.616 -13.337 1145 1HG2 THR 663 3HG2 THR 663 -17.711 5.728 -15.111 1146 2HG2 THR 663 1HG2 THR 663 -19.336 5.163 -14.651 1147 3HG2 THR 663 2HG2 THR 663 -18.557 6.474 -13.734 1148 H GLU 664 H GLU 664 -16.337 4.558 -16.348 1149 HA GLU 664 HA GLU 664 -17.394 2.176 -17.278 1150 1HB GLU 664 1HB GLU 664 -17.404 4.245 -18.600 1151 2HB GLU 664 2HB GLU 664 -15.653 4.256 -18.670 1152 1HG GLU 664 1HG GLU 664 -16.444 3.349 -20.771 1153 2HG GLU 664 2HG GLU 664 -15.738 2.022 -19.870 1154 HE2 GLU 664 HE GLU 664 -18.975 3.489 -20.176 1155 H LEU 665 H LEU 665 -13.976 3.322 -16.951 1156 HA LEU 665 HA LEU 665 -12.969 0.822 -17.949 1157 1HB LEU 665 1HB LEU 665 -11.939 3.080 -18.335 1158 2HB LEU 665 2HB LEU 665 -11.482 3.102 -16.644 1159 HG LEU 665 HG LEU 665 -9.592 2.446 -17.983 1160 1HD1 LEU 665 3HD1 LEU 665 -10.380 1.171 -15.745 1161 2HD1 LEU 665 1HD1 LEU 665 -10.265 -0.213 -16.858 1162 3HD1 LEU 665 2HD1 LEU 665 -8.850 0.833 -16.589 1163 1HD2 LEU 665 3HD2 LEU 665 -10.800 1.605 -19.942 1164 2HD2 LEU 665 1HD2 LEU 665 -9.569 0.447 -19.382 1165 3HD2 LEU 665 2HD2 LEU 665 -11.289 0.161 -19.024 1166 H ASN 666 H ASN 666 -13.786 2.316 -14.847 1167 HA ASN 666 HA ASN 666 -12.207 0.666 -13.263 1168 1HB ASN 666 1HB ASN 666 -13.994 2.798 -12.863 1169 2HB ASN 666 2HB ASN 666 -14.813 1.460 -12.082 1170 1HD2 ASN 666 1HD2 ASN 666 -11.999 3.502 -12.138 1171 2HD2 ASN 666 2HD2 ASN 666 -11.354 3.092 -10.584 1172 H ASN 667 H ASN 667 -15.648 0.523 -14.411 1173 HA ASN 667 HA ASN 667 -16.297 -1.790 -13.018 1174 1HB ASN 667 1HB ASN 667 -17.444 -0.651 -15.622 1175 2HB ASN 667 2HB ASN 667 -18.210 -1.920 -14.686 1176 1HD2 ASN 667 1HD2 ASN 667 -18.856 0.958 -15.403 1177 2HD2 ASN 667 2HD2 ASN 667 -19.320 1.709 -13.912 1178 H ALA 668 H ALA 668 -15.246 -1.132 -16.436 1179 HA ALA 668 HA ALA 668 -15.383 -3.713 -17.403 1180 1HB ALA 668 3HB ALA 668 -14.869 -1.374 -18.512 1181 2HB ALA 668 1HB ALA 668 -13.174 -1.833 -18.220 1182 3HB ALA 668 2HB ALA 668 -14.214 -2.866 -19.230 1183 H LEU 669 H LEU 669 -12.947 -2.099 -15.347 1184 HA LEU 669 HA LEU 669 -10.995 -4.129 -15.651 1185 1HB LEU 669 1HB LEU 669 -11.351 -1.633 -14.189 1186 2HB LEU 669 2HB LEU 669 -10.518 -2.847 -13.239 1187 HG LEU 669 HG LEU 669 -9.649 -2.143 -16.045 1188 1HD1 LEU 669 1HD1 LEU 669 -9.739 -0.143 -14.439 1189 2HD1 LEU 669 2HD1 LEU 669 -8.407 -0.945 -13.573 1190 3HD1 LEU 669 3HD1 LEU 669 -8.204 -0.473 -15.277 1191 1HD2 LEU 669 3HD2 LEU 669 -8.924 -4.258 -14.566 1192 2HD2 LEU 669 1HD2 LEU 669 -7.818 -3.428 -15.687 1193 3HD2 LEU 669 2HD2 LEU 669 -7.758 -3.064 -13.946 1194 H GLN 670 H GLN 670 -13.646 -3.458 -13.305 1195 HA GLN 670 HA GLN 670 -12.942 -5.526 -11.577 1196 1HB GLN 670 1HB GLN 670 -15.420 -3.870 -12.053 1197 2HB GLN 670 2HB GLN 670 -15.535 -5.269 -11.004 1198 1HG GLN 670 1HG GLN 670 -14.251 -4.310 -9.347 1199 2HG GLN 670 2HG GLN 670 -13.168 -3.534 -10.485 1200 1HE2 GLN 670 1HE2 GLN 670 -13.375 -1.450 -10.899 1201 2HE2 GLN 670 2HE2 GLN 670 -14.680 -0.425 -10.402 1202 H ASN 671 H ASN 671 -15.345 -5.314 -14.286 1203 HA ASN 671 HA ASN 671 -16.271 -7.907 -13.979 1204 1HB ASN 671 1HB ASN 671 -17.200 -5.898 -15.404 1205 2HB ASN 671 2HB ASN 671 -16.107 -6.454 -16.656 1206 1HD2 ASN 671 1HD2 ASN 671 -17.018 -7.677 -18.103 1207 2HD2 ASN 671 2HD2 ASN 671 -18.295 -8.823 -17.867 1208 H LEU 672 H LEU 672 -13.409 -6.466 -15.503 1209 HA LEU 672 HA LEU 672 -12.820 -8.708 -17.168 1210 1HB LEU 672 1HB LEU 672 -12.049 -6.659 -17.948 1211 2HB LEU 672 2HB LEU 672 -11.423 -6.175 -16.384 1212 HG LEU 672 HG LEU 672 -10.023 -8.535 -17.189 1213 1HD1 LEU 672 2HD1 LEU 672 -10.723 -6.763 -19.416 1214 2HD1 LEU 672 3HD1 LEU 672 -8.972 -7.020 -19.228 1215 3HD1 LEU 672 1HD1 LEU 672 -10.061 -8.415 -19.419 1216 1HD2 LEU 672 2HD2 LEU 672 -9.306 -6.636 -15.679 1217 2HD2 LEU 672 3HD2 LEU 672 -8.092 -7.208 -16.848 1218 3HD2 LEU 672 1HD2 LEU 672 -8.981 -5.697 -17.156 1219 H ALA 673 H ALA 673 -11.594 -7.420 -14.012 1220 HA ALA 673 HA ALA 673 -9.804 -9.593 -13.656 1221 1HB ALA 673 3HB ALA 673 -10.330 -7.073 -12.489 1222 2HB ALA 673 1HB ALA 673 -10.601 -8.269 -11.198 1223 3HB ALA 673 2HB ALA 673 -9.040 -8.218 -12.050 1224 H ARG 674 H ARG 674 -13.232 -9.193 -13.364 1225 HA ARG 674 HA ARG 674 -13.599 -10.994 -11.242 1226 1HB ARG 674 1HB ARG 674 -15.370 -9.740 -13.355 1227 2HB ARG 674 2HB ARG 674 -16.010 -11.072 -12.414 1228 1HG ARG 674 1HG ARG 674 -14.625 -8.983 -10.802 1229 2HG ARG 674 2HG ARG 674 -16.067 -8.423 -11.626 1230 1HD ARG 674 1HD ARG 674 -17.380 -9.457 -10.091 1231 2HD ARG 674 2HD ARG 674 -16.667 -11.007 -10.490 1232 HE ARG 674 HE ARG 674 -14.814 -9.587 -8.845 1233 2HH1 ARG 674 1HH ARG 674 -15.818 -10.842 -5.766 1234 1HH2 ARG 674 2HH2 ARG 674 -17.999 -11.119 -8.591 1235 2HH2 ARG 674 1HH2 ARG 674 -17.830 -11.476 -6.904 1236 H THR 675 H THR 675 -13.240 -11.243 -14.776 1237 HA THR 675 HA THR 675 -13.806 -14.126 -14.610 1238 HB THR 675 HB THR 675 -13.708 -12.271 -17.045 1239 HG1 THR 675 1HG THR 675 -15.390 -11.915 -15.280 1240 1HG2 THR 675 3HG2 THR 675 -13.569 -14.959 -17.158 1241 2HG2 THR 675 1HG2 THR 675 -15.311 -14.823 -16.819 1242 3HG2 THR 675 2HG2 THR 675 -14.624 -14.053 -18.269 1243 H ILE 676 H ILE 676 -11.285 -11.843 -14.635 1244 HA ILE 676 HA ILE 676 -9.489 -13.627 -16.072 1245 HB ILE 676 HB ILE 676 -9.372 -10.787 -15.130 1246 1HG1 ILE 676 1HG1 ILE 676 -9.092 -12.222 -17.773 1247 2HG1 ILE 676 2HG1 ILE 676 -10.291 -11.035 -17.298 1248 1HG2 ILE 676 2HG2 ILE 676 -7.137 -12.641 -15.165 1249 2HG2 ILE 676 3HG2 ILE 676 -6.899 -11.299 -16.311 1250 3HG2 ILE 676 1HG2 ILE 676 -7.222 -10.957 -14.594 1251 1HD1 ILE 676 3HD1 ILE 676 -8.111 -9.506 -16.908 1252 2HD1 ILE 676 1HD1 ILE 676 -7.427 -10.626 -18.110 1253 3HD1 ILE 676 2HD1 ILE 676 -8.868 -9.662 -18.511 1254 H SER 677 H SER 677 -9.738 -11.955 -12.855 1255 HA SER 677 HA SER 677 -7.630 -13.023 -11.631 1256 1HB SER 677 1HB SER 677 -9.148 -11.431 -10.550 1257 2HB SER 677 2HB SER 677 -10.433 -12.621 -10.502 1258 HG SER 677 HG SER 677 -9.280 -12.391 -8.451 1259 H GLU 678 H GLU 678 -10.733 -14.641 -12.403 1260 HA GLU 678 HA GLU 678 -10.438 -16.854 -10.806 1261 1HB GLU 678 1HB GLU 678 -11.860 -17.957 -12.724 1262 2HB GLU 678 2HB GLU 678 -12.548 -16.645 -11.788 1263 1HG GLU 678 1HG GLU 678 -12.587 -15.221 -13.581 1264 2HG GLU 678 2HG GLU 678 -10.983 -15.687 -14.109 1265 HE2 GLU 678 HE GLU 678 -14.376 -16.441 -14.860 1266 H ALA 679 H ALA 679 -8.645 -15.852 -13.622 1267 HA ALA 679 HA ALA 679 -7.921 -18.102 -14.900 1268 1HB ALA 679 3HB ALA 679 -5.569 -16.913 -14.938 1269 2HB ALA 679 2HB ALA 679 -6.430 -15.614 -14.077 1270 3HB ALA 679 1HB ALA 679 -6.975 -16.124 -15.693 1271 H GLY 680 H GLY 680 -6.148 -16.822 -11.988 1272 1HA GLY 680 2HA GLY 680 -4.506 -18.002 -10.832 1273 2HA GLY 680 1HA GLY 680 -5.040 -19.501 -11.565 1274 H GLN 681 H GLN 681 -7.905 -18.022 -10.822 1275 HA GLN 681 HA GLN 681 -7.851 -18.917 -8.056 1276 1HB GLN 681 1HB GLN 681 -8.911 -16.600 -9.279 1277 2HB GLN 681 2HB GLN 681 -10.315 -17.576 -8.896 1278 1HG GLN 681 1HG GLN 681 -9.917 -16.266 -6.934 1279 2HG GLN 681 2HG GLN 681 -9.330 -17.869 -6.536 1280 1HE2 GLN 681 1HE2 GLN 681 -7.550 -17.811 -5.417 1281 2HE2 GLN 681 2HE2 GLN 681 -6.209 -16.734 -5.619 1282 H ALA 682 H ALA 682 -10.292 -18.793 -10.759 1283 HA ALA 682 HA ALA 682 -11.267 -21.390 -9.834 1284 1HB ALA 682 1HB ALA 682 -12.666 -19.858 -11.977 1285 2HB ALA 682 3HB ALA 682 -12.621 -19.103 -10.366 1286 3HB ALA 682 2HB ALA 682 -13.329 -20.723 -10.570 1287 H MET 683 H MET 683 -10.725 -19.668 -12.997 1288 HA MET 683 HA MET 683 -10.840 -21.648 -14.699 1289 1HB MET 683 1HB MET 683 -9.792 -19.110 -14.739 1290 2HB MET 683 2HB MET 683 -8.305 -20.024 -14.899 1291 1HG MET 683 1HG MET 683 -9.200 -19.510 -17.135 1292 2HG MET 683 2HG MET 683 -9.257 -21.240 -16.867 1293 1HE MET 683 3HE MET 683 -11.233 -22.635 -16.575 1294 2HE MET 683 1HE MET 683 -12.758 -22.181 -17.373 1295 3HE MET 683 2HE MET 683 -11.230 -22.143 -18.285 1296 H ALA 684 H ALA 684 -8.075 -21.097 -12.454 1297 HA ALA 684 HA ALA 684 -6.529 -23.228 -13.535 1298 1HB ALA 684 1HB ALA 684 -5.150 -22.812 -11.481 1299 2HB ALA 684 2HB ALA 684 -5.470 -21.339 -12.428 1300 3HB ALA 684 3HB ALA 684 -6.385 -21.653 -10.934 1301 H SER 685 H SER 685 -8.584 -22.781 -10.578 1302 HA SER 685 HA SER 685 -8.225 -25.068 -9.318 1303 1HB SER 685 1HB SER 685 -10.799 -23.572 -9.911 1304 2HB SER 685 2HB SER 685 -10.809 -24.993 -8.885 1305 HG SER 685 HG SER 685 -9.045 -22.749 -8.421 1306 H THR 686 H THR 686 -11.116 -24.872 -11.503 1307 HA THR 686 HA THR 686 -10.365 -27.011 -13.160 1308 HB THR 686 HB THR 686 -10.631 -28.233 -10.934 1309 HG1 THR 686 1HG THR 686 -12.717 -28.729 -12.933 1310 1HG2 THR 686 1HG2 THR 686 -13.564 -27.475 -11.400 1311 2HG2 THR 686 2HG2 THR 686 -12.985 -28.669 -10.214 1312 3HG2 THR 686 3HG2 THR 686 -12.574 -26.948 -10.018 1313 H GLU 687 H GLU 687 -12.174 -27.709 -14.591 1314 HA GLU 687 HA GLU 687 -13.595 -25.425 -15.350 1315 1HB GLU 687 1HB GLU 687 -13.722 -28.336 -16.225 1316 2HB GLU 687 2HB GLU 687 -14.727 -27.101 -16.958 1317 1HG GLU 687 1HG GLU 687 -12.996 -26.290 -18.193 1318 2HG GLU 687 2HG GLU 687 -11.944 -26.198 -16.794 1319 HE2 GLU 687 HE GLU 687 -11.990 -27.424 -19.598 1320 H GLY 688 H GLY 688 -15.883 -24.994 -15.314 1321 1HA GLY 688 2HA GLY 688 -17.654 -26.803 -13.927 1322 2HA GLY 688 1HA GLY 688 -18.043 -25.248 -14.636 1323 H ASN 689 H ASN 689 -15.209 -24.969 -12.736 1324 HA ASN 689 HA ASN 689 -16.768 -24.357 -10.364 1325 1HB ASN 689 1HB ASN 689 -13.974 -25.271 -10.899 1326 2HB ASN 689 2HB ASN 689 -14.097 -24.051 -9.647 1327 1HD2 ASN 689 1HD2 ASN 689 -14.042 -24.967 -7.748 1328 2HD2 ASN 689 2HD2 ASN 689 -14.907 -26.376 -7.234 1329 H VAL 690 H VAL 690 -15.962 -22.828 -13.113 1330 HA VAL 690 HA VAL 690 -14.535 -20.554 -12.122 1331 HB VAL 690 HB VAL 690 -16.080 -20.703 -14.696 1332 1HG1 VAL 690 2HG1 VAL 690 -13.716 -19.187 -13.640 1333 2HG1 VAL 690 3HG1 VAL 690 -13.825 -19.518 -15.385 1334 3HG1 VAL 690 1HG1 VAL 690 -15.120 -18.610 -14.569 1335 1HG2 VAL 690 1HG2 VAL 690 -13.828 -22.414 -13.847 1336 2HG2 VAL 690 2HG2 VAL 690 -15.012 -22.635 -15.158 1337 3HG2 VAL 690 3HG2 VAL 690 -13.593 -21.590 -15.407 1338 H THR 691 H THR 691 -15.393 -18.368 -11.979 1339 HA THR 691 HA THR 691 -17.550 -18.032 -10.420 1340 HB THR 691 HB THR 691 -15.967 -16.236 -10.928 1341 HG1 THR 691 1HG THR 691 -18.344 -15.802 -10.507 1342 1HG2 THR 691 3HG2 THR 691 -16.020 -16.992 -13.543 1343 2HG2 THR 691 1HG2 THR 691 -17.241 -15.698 -13.602 1344 3HG2 THR 691 2HG2 THR 691 -15.588 -15.338 -13.048 1345 H GLY 692 H GLY 692 -17.600 -18.389 -13.987 1346 1HA GLY 692 2HA GLY 692 -19.321 -19.121 -15.277 1347 2HA GLY 692 1HA GLY 692 -20.053 -17.630 -14.719 1348 H MET 693 H MET 693 -19.279 -20.598 -12.799 1349 HA MET 693 HA MET 693 -22.148 -21.013 -12.532 1350 1HB MET 693 1HB MET 693 -19.837 -22.747 -12.898 1351 2HB MET 693 2HB MET 693 -20.585 -23.151 -11.366 1352 1HG MET 693 1HG MET 693 -22.772 -23.482 -12.462 1353 2HG MET 693 2HG MET 693 -22.129 -22.926 -13.994 1354 1HE MET 693 1HE MET 693 -21.433 -24.277 -15.674 1355 2HE MET 693 2HE MET 693 -21.249 -26.047 -15.631 1356 3HE MET 693 3HE MET 693 -22.829 -25.307 -15.278 1357 H PHE 694 H PHE 694 -19.063 -21.116 -10.609 1358 HA PHE 694 HA PHE 694 -20.435 -21.170 -8.136 1359 1HB PHE 694 1HB PHE 694 -18.250 -21.581 -7.465 1360 2HB PHE 694 2HB PHE 694 -17.842 -21.551 -9.169 1361 HD1 PHE 694 1HD PHE 694 -18.351 -19.176 -6.331 1362 HD2 PHE 694 2HD PHE 694 -16.189 -20.100 -9.864 1363 HE1 PHE 694 1HE PHE 694 -16.863 -17.192 -5.940 1364 HE2 PHE 694 2HE PHE 694 -14.702 -18.116 -9.473 1365 HZ PHE 694 HZ PHE 694 -15.057 -16.686 -7.516 1366 H ALA 695 H ALA 695 -21.167 -19.523 -6.844 1367 HA ALA 695 HA ALA 695 -21.350 -16.931 -7.931 1368 1HB ALA 695 1HB ALA 695 -22.114 -18.349 -5.410 1369 2HB ALA 695 2HB ALA 695 -22.036 -16.571 -5.354 1370 3HB ALA 695 3HB ALA 695 -23.109 -17.379 -6.522 No H/Q in entry = 1370 Start of MODEL 2 1 H ALA 1 H ALA 1 -0.912 32.228 0.695 2 HA ALA 1 HA ALA 1 -1.664 31.061 -1.211 3 1HB ALA 1 3HB ALA 1 -4.310 30.831 -1.286 4 2HB ALA 1 1HB ALA 1 -3.311 29.620 -0.446 5 3HB ALA 1 2HB ALA 1 -4.141 30.890 0.485 6 H GLU 2 H GLU 2 -2.654 32.086 -3.124 7 HA GLU 2 HA GLU 2 -3.299 34.876 -2.560 8 1HB GLU 2 1HB GLU 2 -1.623 33.664 -4.788 9 2HB GLU 2 2HB GLU 2 -2.294 35.277 -4.917 10 1HG GLU 2 1HG GLU 2 -0.650 34.437 -2.496 11 2HG GLU 2 2HG GLU 2 0.117 35.034 -3.955 12 HE2 GLU 2 HE GLU 2 0.522 36.584 -1.940 13 H MET 3 H MET 3 -3.415 32.649 -5.438 14 HA MET 3 HA MET 3 -6.219 33.425 -5.684 15 1HB MET 3 1HB MET 3 -4.155 32.616 -7.808 16 2HB MET 3 2HB MET 3 -5.849 32.896 -8.163 17 1HG MET 3 1HG MET 3 -5.078 35.196 -6.720 18 2HG MET 3 2HG MET 3 -3.689 34.853 -7.731 19 1HE MET 3 2HE MET 3 -7.058 36.003 -7.256 20 2HE MET 3 3HE MET 3 -6.303 37.401 -8.059 21 3HE MET 3 1HE MET 3 -7.663 36.556 -8.836 22 H LYS 4 H LYS 4 -7.603 31.718 -6.865 23 HA LYS 4 HA LYS 4 -6.918 29.125 -5.718 24 1HB LYS 4 1HB LYS 4 -9.243 28.617 -5.840 25 2HB LYS 4 2HB LYS 4 -9.093 30.225 -5.161 26 1HG LYS 4 1HG LYS 4 -9.294 30.953 -7.747 27 2HG LYS 4 2HG LYS 4 -10.088 29.397 -7.885 28 1HD LYS 4 1HD LYS 4 -11.975 30.487 -7.215 29 2HD LYS 4 2HD LYS 4 -11.288 30.422 -5.604 30 1HE LYS 4 1HE LYS 4 -11.112 32.682 -5.557 31 2HE LYS 4 2HE LYS 4 -10.077 32.654 -6.972 32 H THR 5 H THR 5 -6.710 30.867 -8.647 33 HA THR 5 HA THR 5 -6.651 28.335 -10.156 34 HB THR 5 HB THR 5 -7.512 29.572 -12.056 35 HG1 THR 5 1HG THR 5 -6.801 31.666 -12.074 36 1HG2 THR 5 3HG2 THR 5 -8.950 29.639 -9.546 37 2HG2 THR 5 1HG2 THR 5 -9.212 31.191 -10.378 38 3HG2 THR 5 2HG2 THR 5 -9.624 29.664 -11.193 39 H ASP 6 H ASP 6 -4.773 30.688 -8.698 40 HA ASP 6 HA ASP 6 -2.990 31.611 -10.379 41 1HB ASP 6 1HB ASP 6 -2.978 30.747 -7.619 42 2HB ASP 6 2HB ASP 6 -1.443 30.292 -8.331 43 HD2 ASP 6 HD ASP 6 -1.675 33.767 -9.539 44 H ALA 7 H ALA 7 -1.201 30.828 -11.641 45 HA ALA 7 HA ALA 7 -1.366 28.216 -12.596 46 1HB ALA 7 3HB ALA 7 0.591 30.497 -12.798 47 2HB ALA 7 1HB ALA 7 1.042 28.901 -13.444 48 3HB ALA 7 2HB ALA 7 -0.400 29.738 -14.067 49 H ALA 8 H ALA 8 0.077 29.554 -9.715 50 HA ALA 8 HA ALA 8 2.104 27.599 -9.392 51 1HB ALA 8 3HB ALA 8 1.953 29.914 -8.332 52 2HB ALA 8 2HB ALA 8 2.379 28.586 -7.227 53 3HB ALA 8 1HB ALA 8 0.723 29.237 -7.238 54 H THR 9 H THR 9 -1.267 28.010 -8.128 55 HA THR 9 HA THR 9 -1.207 25.583 -6.659 56 HB THR 9 HB THR 9 -2.742 27.827 -6.633 57 HG1 THR 9 1HG THR 9 -3.626 25.074 -6.120 58 1HG2 THR 9 3HG2 THR 9 -4.376 25.691 -8.104 59 2HG2 THR 9 1HG2 THR 9 -5.040 27.171 -7.371 60 3HG2 THR 9 2HG2 THR 9 -3.938 27.285 -8.764 61 H LEU 10 H LEU 10 -2.387 26.490 -9.941 62 HA LEU 10 HA LEU 10 -3.558 24.026 -10.503 63 1HB LEU 10 1HB LEU 10 -2.507 26.312 -12.124 64 2HB LEU 10 2HB LEU 10 -2.973 24.829 -12.932 65 HG LEU 10 HG LEU 10 -4.761 26.547 -11.189 66 1HD1 LEU 10 1HD1 LEU 10 -4.139 27.475 -13.438 67 2HD1 LEU 10 2HD1 LEU 10 -4.936 26.063 -14.171 68 3HD1 LEU 10 3HD1 LEU 10 -5.880 27.207 -13.187 69 1HD2 LEU 10 1HD2 LEU 10 -5.179 23.862 -12.469 70 2HD2 LEU 10 2HD2 LEU 10 -5.629 24.433 -10.844 71 3HD2 LEU 10 3HD2 LEU 10 -6.545 24.985 -12.267 72 H ALA 11 H ALA 11 -0.230 25.286 -11.210 73 HA ALA 11 HA ALA 11 0.693 22.976 -12.446 74 1HB ALA 11 1HB ALA 11 1.994 25.264 -10.949 75 2HB ALA 11 2HB ALA 11 2.962 23.935 -11.629 76 3HB ALA 11 3HB ALA 11 1.965 24.948 -12.700 77 H GLN 12 H GLN 12 0.794 24.022 -8.977 78 HA GLN 12 HA GLN 12 2.223 21.880 -8.047 79 1HB GLN 12 1HB GLN 12 2.006 23.237 -6.252 80 2HB GLN 12 2HB GLN 12 0.610 24.036 -6.948 81 1HG GLN 12 1HG GLN 12 -0.877 22.232 -6.127 82 2HG GLN 12 2HG GLN 12 0.502 21.340 -5.514 83 1HE2 GLN 12 1HE2 GLN 12 -1.648 24.009 -5.073 84 2HE2 GLN 12 2HE2 GLN 12 -1.148 24.493 -3.486 85 H GLU 13 H GLU 13 -1.327 22.259 -8.580 86 HA GLU 13 HA GLU 13 -1.885 19.702 -7.505 87 1HB GLU 13 1HB GLU 13 -3.547 21.641 -9.167 88 2HB GLU 13 2HB GLU 13 -4.184 20.145 -8.514 89 1HG GLU 13 1HG GLU 13 -2.950 22.399 -6.860 90 2HG GLU 13 2HG GLU 13 -4.668 22.099 -7.032 91 HE2 GLU 13 HE GLU 13 -3.252 22.018 -4.663 92 H ALA 14 H ALA 14 -1.332 21.097 -10.764 93 HA ALA 14 HA ALA 14 -2.181 18.860 -12.225 94 1HB ALA 14 3HB ALA 14 -1.714 21.286 -12.976 95 2HB ALA 14 1HB ALA 14 -0.004 20.799 -13.058 96 3HB ALA 14 2HB ALA 14 -1.213 19.979 -14.076 97 H GLY 15 H GLY 15 1.106 19.924 -11.104 98 1HA GLY 15 2HA GLY 15 2.940 18.715 -10.609 99 2HA GLY 15 1HA GLY 15 2.634 17.904 -12.133 100 H ASN 16 H ASN 16 0.358 17.809 -9.369 101 HA ASN 16 HA ASN 16 1.354 15.293 -8.493 102 1HB ASN 16 1HB ASN 16 0.404 16.464 -6.696 103 2HB ASN 16 2HB ASN 16 -0.837 17.199 -7.692 104 1HD2 ASN 16 1HD2 ASN 16 -2.717 16.641 -6.896 105 2HD2 ASN 16 2HD2 ASN 16 -3.246 15.045 -6.483 106 H PHE 17 H PHE 17 -1.230 16.623 -10.569 107 HA PHE 17 HA PHE 17 -2.737 14.212 -10.694 108 1HB PHE 17 1HB PHE 17 -3.658 16.514 -11.084 109 2HB PHE 17 2HB PHE 17 -2.534 16.761 -12.406 110 HD1 PHE 17 1HD PHE 17 -3.129 16.175 -14.591 111 HD2 PHE 17 2HD PHE 17 -5.403 14.651 -11.348 112 HE1 PHE 17 1HE PHE 17 -4.828 15.275 -16.205 113 HE2 PHE 17 2HE PHE 17 -7.101 13.751 -12.962 114 HZ PHE 17 HZ PHE 17 -6.794 14.074 -15.371 115 H GLU 18 H GLU 18 -0.606 15.974 -13.062 116 HA GLU 18 HA GLU 18 -0.706 14.363 -15.142 117 1HB GLU 18 1HB GLU 18 1.546 15.890 -13.874 118 2HB GLU 18 2HB GLU 18 1.965 14.798 -15.179 119 1HG GLU 18 1HG GLU 18 1.125 16.218 -16.737 120 2HG GLU 18 2HG GLU 18 -0.418 16.301 -15.910 121 HE2 GLU 18 HE GLU 18 0.726 19.599 -15.909 122 H ARG 19 H ARG 19 0.782 13.590 -12.004 123 HA ARG 19 HA ARG 19 2.173 11.343 -12.947 124 1HB ARG 19 1HB ARG 19 2.151 12.812 -10.600 125 2HB ARG 19 2HB ARG 19 1.309 11.364 -10.087 126 1HG ARG 19 1HG ARG 19 3.172 10.012 -10.336 127 2HG ARG 19 2HG ARG 19 3.770 10.900 -11.724 128 1HD ARG 19 1HD ARG 19 4.963 12.407 -10.428 129 2HD ARG 19 2HD ARG 19 3.769 12.419 -9.145 130 HE ARG 19 HE ARG 19 4.887 10.637 -8.101 131 2HH1 ARG 19 1HH ARG 19 7.654 8.777 -9.074 132 1HH2 ARG 19 2HH2 ARG 19 6.074 10.966 -11.423 133 2HH2 ARG 19 1HH2 ARG 19 7.368 9.835 -11.205 134 H ILE 20 H ILE 20 -0.985 11.870 -11.245 135 HA ILE 20 HA ILE 20 -1.667 9.203 -10.928 136 HB ILE 20 HB ILE 20 -3.449 11.606 -11.345 137 1HG1 ILE 20 1HG1 ILE 20 -2.649 10.430 -8.688 138 2HG1 ILE 20 2HG1 ILE 20 -1.636 11.620 -9.481 139 1HG2 ILE 20 2HG2 ILE 20 -4.329 9.099 -11.479 140 2HG2 ILE 20 3HG2 ILE 20 -4.273 9.255 -9.707 141 3HG2 ILE 20 1HG2 ILE 20 -5.250 10.390 -10.670 142 1HD1 ILE 20 2HD1 ILE 20 -3.971 12.926 -9.743 143 2HD1 ILE 20 3HD1 ILE 20 -4.396 11.933 -8.328 144 3HD1 ILE 20 1HD1 ILE 20 -3.003 13.039 -8.253 145 H SER 21 H SER 21 -2.187 11.473 -13.686 146 HA SER 21 HA SER 21 -3.739 9.735 -15.172 147 1HB SER 21 1HB SER 21 -3.556 12.133 -15.677 148 2HB SER 21 2HB SER 21 -1.852 11.963 -16.051 149 HG SER 21 HG SER 21 -2.432 10.576 -17.848 150 H GLY 22 H GLY 22 -0.165 10.385 -15.209 151 1HA GLY 22 2HA GLY 22 1.568 9.131 -15.896 152 2HA GLY 22 1HA GLY 22 0.562 8.666 -17.253 153 H ASP 23 H ASP 23 0.275 8.016 -13.687 154 HA ASP 23 HA ASP 23 1.118 5.389 -13.872 155 1HB ASP 23 1HB ASP 23 -0.545 6.968 -11.891 156 2HB ASP 23 2HB ASP 23 -0.376 5.237 -11.671 157 HD2 ASP 23 HD ASP 23 2.815 7.600 -11.125 158 H LEU 24 H LEU 24 -2.143 6.968 -13.936 159 HA LEU 24 HA LEU 24 -3.744 4.748 -13.849 160 1HB LEU 24 1HB LEU 24 -3.945 7.523 -14.742 161 2HB LEU 24 2HB LEU 24 -5.012 6.446 -15.622 162 HG LEU 24 HG LEU 24 -4.911 6.659 -12.600 163 1HD1 LEU 24 3HD1 LEU 24 -6.150 8.381 -14.571 164 2HD1 LEU 24 1HD1 LEU 24 -7.370 7.626 -13.518 165 3HD1 LEU 24 2HD1 LEU 24 -6.036 8.563 -12.804 166 1HD2 LEU 24 2HD2 LEU 24 -6.174 4.784 -14.416 167 2HD2 LEU 24 3HD2 LEU 24 -6.041 4.746 -12.641 168 3HD2 LEU 24 1HD2 LEU 24 -7.377 5.632 -13.415 169 H LYS 25 H LYS 25 -1.867 6.110 -16.585 170 HA LYS 25 HA LYS 25 -3.022 4.335 -18.487 171 1HB LYS 25 1HB LYS 25 -0.399 5.798 -18.787 172 2HB LYS 25 2HB LYS 25 -1.528 5.312 -20.035 173 1HG LYS 25 1HG LYS 25 -2.883 6.995 -18.069 174 2HG LYS 25 2HG LYS 25 -1.444 7.804 -18.658 175 1HD LYS 25 1HD LYS 25 -3.240 6.463 -20.679 176 2HD LYS 25 2HD LYS 25 -3.786 7.968 -19.967 177 1HE LYS 25 1HE LYS 25 -1.094 7.568 -21.361 178 2HE LYS 25 2HE LYS 25 -2.497 8.329 -22.087 179 H THR 26 H THR 26 -0.147 4.345 -16.347 180 HA THR 26 HA THR 26 1.179 2.177 -17.490 181 HB THR 26 HB THR 26 1.055 3.485 -14.747 182 HG1 THR 26 1HG THR 26 2.200 4.431 -16.610 183 1HG2 THR 26 3HG2 THR 26 2.013 0.789 -15.297 184 2HG2 THR 26 1HG2 THR 26 3.402 1.860 -14.993 185 3HG2 THR 26 2HG2 THR 26 2.112 1.708 -13.776 186 H GLN 27 H GLN 27 -1.438 2.289 -15.015 187 HA GLN 27 HA GLN 27 -1.350 -0.478 -14.582 188 1HB GLN 27 1HB GLN 27 -3.495 1.617 -14.044 189 2HB GLN 27 2HB GLN 27 -3.647 -0.052 -13.534 190 1HG GLN 27 1HG GLN 27 -2.445 1.953 -12.048 191 2HG GLN 27 2HG GLN 27 -2.210 0.236 -11.787 192 1HE2 GLN 27 1HE2 GLN 27 -0.412 -0.822 -12.700 193 2HE2 GLN 27 2HE2 GLN 27 1.035 0.029 -13.129 194 H ILE 28 H ILE 28 -3.508 1.664 -16.563 195 HA ILE 28 HA ILE 28 -5.209 -0.269 -17.513 196 HB ILE 28 HB ILE 28 -4.183 2.304 -18.684 197 1HG1 ILE 28 1HG1 ILE 28 -6.847 1.526 -17.461 198 2HG1 ILE 28 2HG1 ILE 28 -5.577 2.418 -16.648 199 1HG2 ILE 28 2HG2 ILE 28 -5.495 0.187 -20.107 200 2HG2 ILE 28 3HG2 ILE 28 -6.598 1.576 -19.966 201 3HG2 ILE 28 1HG2 ILE 28 -4.984 1.791 -20.686 202 1HD1 ILE 28 3HD1 ILE 28 -5.726 4.090 -18.649 203 2HD1 ILE 28 1HD1 ILE 28 -7.277 3.294 -19.005 204 3HD1 ILE 28 2HD1 ILE 28 -7.035 4.112 -17.443 205 H ASP 29 H ASP 29 -2.158 0.937 -19.084 206 HA ASP 29 HA ASP 29 -2.187 -0.776 -21.183 207 1HB ASP 29 1HB ASP 29 -0.237 0.891 -19.780 208 2HB ASP 29 2HB ASP 29 0.534 -0.573 -20.359 209 HD2 ASP 29 HD ASP 29 0.918 -0.276 -23.075 210 H GLN 30 H GLN 30 -0.944 -1.210 -17.816 211 HA GLN 30 HA GLN 30 0.384 -3.568 -18.147 212 1HB GLN 30 1HB GLN 30 -0.845 -2.077 -15.905 213 2HB GLN 30 2HB GLN 30 -0.746 -3.802 -15.614 214 1HG GLN 30 1HG GLN 30 1.303 -2.533 -14.860 215 2HG GLN 30 2HG GLN 30 1.656 -3.819 -15.997 216 1HE2 GLN 30 1HE2 GLN 30 3.030 -1.274 -15.302 217 2HE2 GLN 30 2HE2 GLN 30 3.290 -0.436 -16.795 218 H VAL 31 H VAL 31 -3.111 -3.029 -17.330 219 HA VAL 31 HA VAL 31 -3.751 -5.757 -17.203 220 HB VAL 31 HB VAL 31 -5.307 -3.211 -17.588 221 1HG1 VAL 31 1HG1 VAL 31 -6.413 -6.037 -17.487 222 2HG1 VAL 31 2HG1 VAL 31 -7.384 -4.562 -17.260 223 3HG1 VAL 31 3HG1 VAL 31 -6.572 -4.862 -18.815 224 1HG2 VAL 31 3HG2 VAL 31 -4.211 -4.421 -15.353 225 2HG2 VAL 31 1HG2 VAL 31 -5.519 -3.214 -15.354 226 3HG2 VAL 31 2HG2 VAL 31 -5.910 -4.950 -15.305 227 H GLU 32 H GLU 32 -4.252 -3.296 -19.833 228 HA GLU 32 HA GLU 32 -5.362 -4.909 -21.672 229 1HB GLU 32 1HB GLU 32 -3.597 -2.491 -21.795 230 2HB GLU 32 2HB GLU 32 -3.822 -3.366 -23.296 231 1HG GLU 32 1HG GLU 32 -6.375 -3.297 -22.734 232 2HG GLU 32 2HG GLU 32 -5.952 -2.080 -21.546 233 HE2 GLU 32 HE GLU 32 -6.303 0.261 -23.297 234 H SER 33 H SER 33 -1.877 -4.614 -20.824 235 HA SER 33 HA SER 33 -1.076 -6.332 -22.923 236 1HB SER 33 1HB SER 33 0.179 -4.587 -21.071 237 2HB SER 33 2HB SER 33 0.821 -6.176 -20.704 238 HG SER 33 HG SER 33 1.304 -4.539 -22.892 239 H THR 34 H THR 34 -1.256 -6.644 -19.298 240 HA THR 34 HA THR 34 -0.537 -9.310 -19.139 241 HB THR 34 HB THR 34 -2.050 -7.302 -17.479 242 HG1 THR 34 1HG THR 34 0.142 -9.238 -17.204 243 1HG2 THR 34 3HG2 THR 34 -3.267 -9.582 -17.232 244 2HG2 THR 34 1HG2 THR 34 -1.723 -10.211 -16.610 245 3HG2 THR 34 2HG2 THR 34 -2.563 -8.903 -15.745 246 H ALA 35 H ALA 35 -3.821 -7.868 -19.588 247 HA ALA 35 HA ALA 35 -5.266 -10.198 -19.462 248 1HB ALA 35 1HB ALA 35 -6.996 -8.927 -20.346 249 2HB ALA 35 2HB ALA 35 -5.899 -7.643 -19.783 250 3HB ALA 35 3HB ALA 35 -5.934 -8.092 -21.505 251 H GLY 36 H GLY 36 -2.990 -9.072 -21.903 252 1HA GLY 36 2HA GLY 36 -2.117 -10.147 -23.682 253 2HA GLY 36 1HA GLY 36 -3.783 -10.296 -24.203 254 H SER 37 H SER 37 -1.906 -11.813 -21.479 255 HA SER 37 HA SER 37 -1.760 -14.296 -22.708 256 1HB SER 37 1HB SER 37 -1.402 -13.262 -19.898 257 2HB SER 37 2HB SER 37 -1.477 -14.996 -20.138 258 HG SER 37 HG SER 37 0.411 -14.986 -21.263 259 H LEU 38 H LEU 38 -4.146 -12.782 -20.485 260 HA LEU 38 HA LEU 38 -5.592 -15.086 -19.884 261 1HB LEU 38 1HB LEU 38 -6.161 -12.147 -19.875 262 2HB LEU 38 2HB LEU 38 -7.468 -13.281 -19.602 263 HG LEU 38 HG LEU 38 -6.880 -12.965 -17.444 264 1HD1 LEU 38 2HD1 LEU 38 -6.372 -15.359 -18.034 265 2HD1 LEU 38 3HD1 LEU 38 -4.651 -14.909 -18.081 266 3HD1 LEU 38 1HD1 LEU 38 -5.572 -14.747 -16.567 267 1HD2 LEU 38 1HD2 LEU 38 -4.095 -12.322 -18.428 268 2HD2 LEU 38 2HD2 LEU 38 -5.307 -11.222 -17.728 269 3HD2 LEU 38 3HD2 LEU 38 -4.515 -12.443 -16.702 270 H GLN 39 H GLN 39 -6.583 -12.457 -22.192 271 HA GLN 39 HA GLN 39 -8.562 -13.902 -23.374 272 1HB GLN 39 1HB GLN 39 -8.116 -12.323 -25.379 273 2HB GLN 39 2HB GLN 39 -8.501 -11.585 -23.837 274 1HG GLN 39 1HG GLN 39 -5.672 -11.954 -23.830 275 2HG GLN 39 2HG GLN 39 -6.066 -11.345 -25.425 276 1HE2 GLN 39 1HE2 GLN 39 -7.640 -10.806 -22.287 277 2HE2 GLN 39 2HE2 GLN 39 -7.443 -9.086 -22.229 278 H GLY 40 H GLY 40 -5.126 -14.351 -23.583 279 1HA GLY 40 2HA GLY 40 -3.805 -15.444 -25.104 280 2HA GLY 40 1HA GLY 40 -5.176 -15.656 -26.174 281 H GLN 41 H GLN 41 -6.313 -16.511 -23.140 282 HA GLN 41 HA GLN 41 -6.169 -19.269 -23.830 283 1HB GLN 41 1HB GLN 41 -4.067 -19.218 -22.677 284 2HB GLN 41 2HB GLN 41 -4.693 -18.190 -21.404 285 1HG GLN 41 1HG GLN 41 -6.358 -20.156 -20.913 286 2HG GLN 41 2HG GLN 41 -5.285 -21.130 -21.898 287 1HE2 GLN 41 1HE2 GLN 41 -5.928 -19.917 -18.848 288 2HE2 GLN 41 2HE2 GLN 41 -4.434 -20.274 -18.048 289 H TRP 42 H TRP 42 -8.221 -19.988 -23.480 290 HA TRP 42 HA TRP 42 -9.513 -19.524 -20.988 291 1HB TRP 42 1HB TRP 42 -10.484 -18.022 -23.417 292 2HB TRP 42 2HB TRP 42 -11.524 -18.406 -22.060 293 HD1 TRP 42 HD TRP 42 -9.421 -15.652 -23.211 294 HE1 TRP 42 1HE TRP 42 -8.752 -13.933 -21.325 295 HE3 TRP 42 3HE TRP 42 -10.719 -18.635 -19.303 296 HZ2 TRP 42 2HZ TRP 42 -8.839 -14.011 -18.473 297 HZ3 TRP 42 3HZ TRP 42 -10.395 -17.737 -17.000 298 HH2 TRP 42 HH TRP 42 -9.491 -15.511 -16.553 299 H ARG 43 H ARG 43 -11.111 -21.124 -20.688 300 HA ARG 43 HA ARG 43 -11.094 -23.130 -22.722 301 1HB ARG 43 1HB ARG 43 -12.127 -22.955 -19.871 302 2HB ARG 43 2HB ARG 43 -12.645 -24.278 -20.896 303 1HG ARG 43 1HG ARG 43 -9.694 -23.611 -20.618 304 2HG ARG 43 2HG ARG 43 -10.501 -24.589 -19.408 305 1HD ARG 43 1HD ARG 43 -11.349 -26.024 -21.446 306 2HD ARG 43 2HD ARG 43 -10.089 -25.212 -22.355 307 HE ARG 43 HE ARG 43 -9.212 -26.401 -19.799 308 2HH1 ARG 43 1HH ARG 43 -7.250 -28.803 -21.363 309 1HH2 ARG 43 2HH2 ARG 43 -9.536 -26.844 -23.299 310 2HH2 ARG 43 1HH2 ARG 43 -8.348 -28.103 -23.375 311 H GLY 44 H GLY 44 -13.926 -22.437 -20.628 312 1HA GLY 44 2HA GLY 44 -16.034 -22.932 -21.947 313 2HA GLY 44 1HA GLY 44 -15.480 -21.657 -23.014 314 H ALA 45 H ALA 45 -16.692 -19.845 -22.667 315 HA ALA 45 HA ALA 45 -17.960 -18.354 -21.590 316 1HB ALA 45 2HB ALA 45 -18.319 -20.521 -19.987 317 2HB ALA 45 3HB ALA 45 -17.516 -19.417 -18.845 318 3HB ALA 45 1HB ALA 45 -19.024 -18.921 -19.651 319 H ALA 46 H ALA 46 -15.208 -19.418 -19.459 320 HA ALA 46 HA ALA 46 -14.590 -16.966 -18.414 321 1HB ALA 46 2HB ALA 46 -12.631 -19.147 -19.233 322 2HB ALA 46 1HB ALA 46 -13.648 -19.204 -17.774 323 3HB ALA 46 3HB ALA 46 -12.411 -17.935 -17.948 324 H GLY 47 H GLY 47 -14.040 -18.251 -21.675 325 1HA GLY 47 2HA GLY 47 -13.005 -17.387 -23.487 326 2HA GLY 47 1HA GLY 47 -12.072 -16.333 -22.443 327 H THR 48 H THR 48 -15.452 -16.770 -23.701 328 HA THR 48 HA THR 48 -15.625 -14.245 -24.824 329 HB THR 48 HB THR 48 -18.107 -14.782 -24.783 330 HG1 THR 48 1HG THR 48 -18.586 -16.068 -23.046 331 1HG2 THR 48 1HG2 THR 48 -15.997 -16.436 -25.914 332 2HG2 THR 48 2HG2 THR 48 -17.336 -17.479 -25.379 333 3HG2 THR 48 3HG2 THR 48 -17.641 -16.165 -26.540 334 H ALA 49 H ALA 49 -15.940 -15.255 -21.459 335 HA ALA 49 HA ALA 49 -17.371 -12.963 -20.612 336 1HB ALA 49 1HB ALA 49 -15.650 -15.032 -19.198 337 2HB ALA 49 2HB ALA 49 -16.534 -13.745 -18.344 338 3HB ALA 49 3HB ALA 49 -17.426 -14.966 -19.284 339 H ALA 50 H ALA 50 -13.868 -13.910 -20.584 340 HA ALA 50 HA ALA 50 -13.107 -11.327 -19.603 341 1HB ALA 50 2HB ALA 50 -11.105 -12.339 -19.229 342 2HB ALA 50 3HB ALA 50 -12.015 -13.839 -19.526 343 3HB ALA 50 1HB ALA 50 -11.072 -13.095 -20.840 344 H GLN 51 H GLN 51 -12.460 -13.161 -22.682 345 HA GLN 51 HA GLN 51 -11.252 -11.287 -24.099 346 1HB GLN 51 1HB GLN 51 -11.616 -12.729 -25.809 347 2HB GLN 51 2HB GLN 51 -12.533 -13.689 -24.665 348 1HG GLN 51 1HG GLN 51 -14.010 -13.362 -26.516 349 2HG GLN 51 2HG GLN 51 -14.583 -12.257 -25.283 350 1HE2 GLN 51 1HE2 GLN 51 -15.363 -10.575 -26.323 351 2HE2 GLN 51 2HE2 GLN 51 -14.548 -9.624 -27.519 352 H ALA 52 H ALA 52 -14.762 -11.399 -23.343 353 HA ALA 52 HA ALA 52 -15.372 -9.167 -25.020 354 1HB ALA 52 2HB ALA 52 -16.993 -10.963 -24.496 355 2HB ALA 52 1HB ALA 52 -17.595 -9.369 -23.980 356 3HB ALA 52 3HB ALA 52 -16.939 -10.505 -22.777 357 H ALA 53 H ALA 53 -15.072 -9.724 -21.443 358 HA ALA 53 HA ALA 53 -15.570 -7.128 -20.657 359 1HB ALA 53 2HB ALA 53 -13.597 -9.047 -19.365 360 2HB ALA 53 1HB ALA 53 -15.363 -9.232 -19.246 361 3HB ALA 53 3HB ALA 53 -14.573 -7.786 -18.573 362 H VAL 54 H VAL 54 -12.709 -8.601 -22.153 363 HA VAL 54 HA VAL 54 -10.933 -6.502 -21.440 364 HB VAL 54 HB VAL 54 -10.708 -8.442 -23.741 365 1HG1 VAL 54 2HG1 VAL 54 -9.070 -6.475 -23.412 366 2HG1 VAL 54 3HG1 VAL 54 -8.481 -7.381 -21.998 367 3HG1 VAL 54 1HG1 VAL 54 -8.388 -8.105 -23.621 368 1HG2 VAL 54 2HG2 VAL 54 -11.030 -9.089 -20.994 369 2HG2 VAL 54 3HG2 VAL 54 -10.586 -10.169 -22.338 370 3HG2 VAL 54 1HG2 VAL 54 -9.316 -9.351 -21.397 371 H VAL 55 H VAL 55 -12.663 -7.397 -24.510 372 HA VAL 55 HA VAL 55 -11.848 -5.287 -26.036 373 HB VAL 55 HB VAL 55 -14.458 -6.797 -25.920 374 1HG1 VAL 55 2HG1 VAL 55 -14.058 -4.345 -27.226 375 2HG1 VAL 55 3HG1 VAL 55 -13.900 -5.581 -28.497 376 3HG1 VAL 55 1HG1 VAL 55 -15.374 -5.512 -27.501 377 1HG2 VAL 55 1HG2 VAL 55 -11.811 -7.311 -27.014 378 2HG2 VAL 55 2HG2 VAL 55 -13.199 -8.408 -26.823 379 3HG2 VAL 55 3HG2 VAL 55 -13.066 -7.386 -28.274 380 H ARG 56 H ARG 56 -14.780 -5.439 -23.894 381 HA ARG 56 HA ARG 56 -15.614 -2.891 -24.367 382 1HB ARG 56 1HB ARG 56 -15.878 -4.787 -22.017 383 2HB ARG 56 2HB ARG 56 -16.499 -3.157 -21.856 384 1HG ARG 56 1HG ARG 56 -18.322 -3.649 -23.115 385 2HG ARG 56 2HG ARG 56 -17.325 -4.254 -24.424 386 1HD ARG 56 1HD ARG 56 -17.045 -6.383 -22.842 387 2HD ARG 56 2HD ARG 56 -18.503 -5.775 -22.084 388 HE ARG 56 HE ARG 56 -18.291 -6.968 -24.743 389 2HH1 ARG 56 1HH ARG 56 -21.631 -6.460 -25.551 390 1HH2 ARG 56 2HH2 ARG 56 -20.215 -4.780 -22.726 391 2HH2 ARG 56 1HH2 ARG 56 -21.662 -4.999 -23.651 392 H PHE 57 H PHE 57 -13.432 -4.140 -21.741 393 HA PHE 57 HA PHE 57 -13.012 -1.715 -20.475 394 1HB PHE 57 1HB PHE 57 -12.202 -3.611 -19.318 395 2HB PHE 57 2HB PHE 57 -11.693 -4.408 -20.794 396 HD1 PHE 57 1HD PHE 57 -10.767 -1.657 -18.475 397 HD2 PHE 57 2HD PHE 57 -9.440 -4.406 -21.423 398 HE1 PHE 57 1HE PHE 57 -8.387 -1.018 -18.000 399 HE2 PHE 57 2HE PHE 57 -7.060 -3.766 -20.948 400 HZ PHE 57 HZ PHE 57 -6.562 -2.080 -19.243 401 H GLN 58 H GLN 58 -11.224 -3.295 -23.196 402 HA GLN 58 HA GLN 58 -9.162 -1.494 -23.319 403 1HB GLN 58 1HB GLN 58 -10.505 -3.069 -25.558 404 2HB GLN 58 2HB GLN 58 -8.964 -2.252 -25.724 405 1HG GLN 58 1HG GLN 58 -8.646 -3.742 -23.365 406 2HG GLN 58 2HG GLN 58 -9.594 -4.807 -24.385 407 1HE2 GLN 58 1HE2 GLN 58 -7.151 -2.350 -25.182 408 2HE2 GLN 58 2HE2 GLN 58 -6.041 -3.397 -26.002 409 H GLU 59 H GLU 59 -12.253 -1.521 -25.241 410 HA GLU 59 HA GLU 59 -11.802 0.792 -26.605 411 1HB GLU 59 1HB GLU 59 -14.337 -0.575 -25.655 412 2HB GLU 59 2HB GLU 59 -14.425 0.923 -26.560 413 1HG GLU 59 1HG GLU 59 -12.676 -1.285 -27.645 414 2HG GLU 59 2HG GLU 59 -14.412 -1.466 -27.792 415 HE2 GLU 59 HE GLU 59 -13.644 -1.140 -30.197 416 H ALA 60 H ALA 60 -12.752 0.296 -23.225 417 HA ALA 60 HA ALA 60 -13.590 3.017 -22.856 418 1HB ALA 60 2HB ALA 60 -13.109 0.639 -21.030 419 2HB ALA 60 1HB ALA 60 -14.663 1.358 -21.516 420 3HB ALA 60 3HB ALA 60 -13.579 2.243 -20.416 421 H ALA 61 H ALA 61 -10.614 1.107 -22.677 422 HA ALA 61 HA ALA 61 -9.140 2.692 -20.952 423 1HB ALA 61 3HB ALA 61 -8.612 0.404 -22.011 424 2HB ALA 61 2HB ALA 61 -7.258 1.546 -21.839 425 3HB ALA 61 1HB ALA 61 -8.038 1.322 -23.424 426 H ASN 62 H ASN 62 -9.805 3.002 -24.483 427 HA ASN 62 HA ASN 62 -8.051 5.151 -24.823 428 1HB ASN 62 1HB ASN 62 -10.541 4.769 -26.522 429 2HB ASN 62 2HB ASN 62 -8.942 5.273 -27.034 430 1HD2 ASN 62 1HD2 ASN 62 -10.921 2.590 -25.949 431 2HD2 ASN 62 2HD2 ASN 62 -9.944 1.300 -26.567 432 H LYS 63 H LYS 63 -11.622 4.806 -24.279 433 HA LYS 63 HA LYS 63 -12.345 7.451 -24.533 434 1HB LYS 63 1HB LYS 63 -13.674 5.171 -24.093 435 2HB LYS 63 2HB LYS 63 -13.672 5.774 -22.448 436 1HG LYS 63 1HG LYS 63 -15.590 6.829 -23.221 437 2HG LYS 63 2HG LYS 63 -14.414 8.064 -23.625 438 1HD LYS 63 1HD LYS 63 -15.873 7.656 -25.560 439 2HD LYS 63 2HD LYS 63 -14.239 7.153 -25.943 440 1HE LYS 63 1HE LYS 63 -14.825 4.943 -26.134 441 2HE LYS 63 2HE LYS 63 -15.861 4.992 -24.721 442 H GLN 64 H GLN 64 -11.045 5.665 -21.678 443 HA GLN 64 HA GLN 64 -11.279 7.906 -19.995 444 1HB GLN 64 1HB GLN 64 -10.606 5.149 -19.744 445 2HB GLN 64 2HB GLN 64 -9.227 6.036 -19.125 446 1HG GLN 64 1HG GLN 64 -11.892 7.073 -18.257 447 2HG GLN 64 2HG GLN 64 -11.485 5.477 -17.658 448 1HE2 GLN 64 1HE2 GLN 64 -11.130 8.779 -17.248 449 2HE2 GLN 64 2HE2 GLN 64 -9.848 8.813 -16.083 450 H LYS 65 H LYS 65 -8.771 6.618 -22.183 451 HA LYS 65 HA LYS 65 -6.672 8.222 -21.178 452 1HB LYS 65 1HB LYS 65 -7.113 6.300 -23.341 453 2HB LYS 65 2HB LYS 65 -6.059 7.615 -23.821 454 1HG LYS 65 1HG LYS 65 -4.618 5.957 -22.856 455 2HG LYS 65 2HG LYS 65 -4.744 7.226 -21.653 456 1HD LYS 65 1HD LYS 65 -5.268 5.514 -20.226 457 2HD LYS 65 2HD LYS 65 -6.873 5.657 -20.914 458 1HE LYS 65 1HE LYS 65 -6.202 3.311 -21.007 459 2HE LYS 65 2HE LYS 65 -6.262 3.932 -22.645 460 H GLN 66 H GLN 66 -9.338 8.706 -23.477 461 HA GLN 66 HA GLN 66 -8.220 10.981 -24.676 462 1HB GLN 66 1HB GLN 66 -9.997 9.658 -25.754 463 2HB GLN 66 2HB GLN 66 -11.112 10.038 -24.457 464 1HG GLN 66 1HG GLN 66 -11.711 11.621 -26.090 465 2HG GLN 66 2HG GLN 66 -10.634 12.549 -25.067 466 1HE2 GLN 66 1HE2 GLN 66 -10.135 13.948 -26.738 467 2HE2 GLN 66 2HE2 GLN 66 -9.073 13.530 -28.042 468 H GLU 67 H GLU 67 -10.766 10.534 -22.119 469 HA GLU 67 HA GLU 67 -10.952 13.299 -21.654 470 1HB GLU 67 1HB GLU 67 -12.003 10.799 -20.351 471 2HB GLU 67 2HB GLU 67 -12.056 12.283 -19.421 472 1HG GLU 67 1HG GLU 67 -14.154 11.908 -20.739 473 2HG GLU 67 2HG GLU 67 -13.358 13.411 -21.165 474 HE2 GLU 67 HE GLU 67 -14.262 12.201 -24.182 475 H LEU 68 H LEU 68 -8.835 10.721 -20.526 476 HA LEU 68 HA LEU 68 -8.018 12.051 -18.144 477 1HB LEU 68 1HB LEU 68 -7.911 9.671 -18.272 478 2HB LEU 68 2HB LEU 68 -6.925 9.724 -19.719 479 HG LEU 68 HG LEU 68 -5.178 10.946 -18.241 480 1HD1 LEU 68 3HD1 LEU 68 -7.241 10.239 -16.265 481 2HD1 LEU 68 1HD1 LEU 68 -5.589 9.751 -15.818 482 3HD1 LEU 68 2HD1 LEU 68 -5.941 11.454 -16.197 483 1HD2 LEU 68 3HD2 LEU 68 -5.515 8.336 -19.013 484 2HD2 LEU 68 1HD2 LEU 68 -4.065 9.006 -18.227 485 3HD2 LEU 68 2HD2 LEU 68 -5.306 8.185 -17.252 486 H ASP 69 H ASP 69 -6.777 11.756 -21.519 487 HA ASP 69 HA ASP 69 -4.453 13.220 -20.964 488 1HB ASP 69 1HB ASP 69 -4.825 11.650 -22.924 489 2HB ASP 69 2HB ASP 69 -5.901 12.841 -23.627 490 HD2 ASP 69 HD ASP 69 -3.987 14.029 -25.455 491 H GLU 70 H GLU 70 -7.637 13.958 -22.567 492 HA GLU 70 HA GLU 70 -7.175 16.528 -23.274 493 1HB GLU 70 1HB GLU 70 -9.486 16.700 -23.579 494 2HB GLU 70 2HB GLU 70 -9.264 14.961 -23.582 495 1HG GLU 70 1HG GLU 70 -9.863 14.871 -21.160 496 2HG GLU 70 2HG GLU 70 -10.060 16.612 -21.136 497 HE2 GLU 70 HE GLU 70 -12.690 15.277 -23.743 498 H ILE 71 H ILE 71 -8.316 15.263 -20.080 499 HA ILE 71 HA ILE 71 -8.658 17.777 -18.898 500 HB ILE 71 HB ILE 71 -8.235 14.995 -17.841 501 1HG1 ILE 71 1HG1 ILE 71 -10.644 16.836 -17.797 502 2HG1 ILE 71 2HG1 ILE 71 -10.373 15.572 -18.980 503 1HG2 ILE 71 1HG2 ILE 71 -7.875 17.488 -16.402 504 2HG2 ILE 71 2HG2 ILE 71 -9.222 16.536 -15.734 505 3HG2 ILE 71 3HG2 ILE 71 -7.603 15.810 -15.873 506 1HD1 ILE 71 1HD1 ILE 71 -10.211 14.844 -16.056 507 2HD1 ILE 71 2HD1 ILE 71 -11.812 15.094 -16.792 508 3HD1 ILE 71 3HD1 ILE 71 -10.719 13.848 -17.441 509 H SER 72 H SER 72 -5.883 15.439 -18.824 510 HA SER 72 HA SER 72 -4.263 16.953 -17.227 511 1HB SER 72 1HB SER 72 -3.233 15.284 -19.550 512 2HB SER 72 2HB SER 72 -2.458 15.565 -18.004 513 HG SER 72 HG SER 72 -4.665 13.856 -18.641 514 H THR 73 H THR 73 -5.212 17.381 -20.591 515 HA THR 73 HA THR 73 -3.036 19.260 -21.087 516 HB THR 73 HB THR 73 -5.184 17.868 -22.732 517 HG1 THR 73 1HG THR 73 -2.286 18.319 -22.880 518 1HG2 THR 73 2HG2 THR 73 -4.764 20.438 -23.347 519 2HG2 THR 73 3HG2 THR 73 -3.210 19.817 -23.952 520 3HG2 THR 73 1HG2 THR 73 -4.738 19.201 -24.627 521 H ASN 74 H ASN 74 -6.441 19.165 -20.179 522 HA ASN 74 HA ASN 74 -7.184 21.650 -21.056 523 1HB ASN 74 1HB ASN 74 -8.077 19.713 -18.976 524 2HB ASN 74 2HB ASN 74 -8.520 21.370 -18.618 525 1HD2 ASN 74 1HD2 ASN 74 -9.069 18.607 -20.556 526 2HD2 ASN 74 2HD2 ASN 74 -10.357 19.210 -21.546 527 H ILE 75 H ILE 75 -5.013 20.616 -18.487 528 HA ILE 75 HA ILE 75 -5.235 22.934 -16.866 529 HB ILE 75 HB ILE 75 -2.925 21.005 -17.024 530 1HG1 ILE 75 1HG1 ILE 75 -5.058 19.758 -16.902 531 2HG1 ILE 75 2HG1 ILE 75 -4.066 19.563 -15.470 532 1HG2 ILE 75 3HG2 ILE 75 -2.697 23.122 -15.681 533 2HG2 ILE 75 1HG2 ILE 75 -4.017 22.524 -14.646 534 3HG2 ILE 75 2HG2 ILE 75 -2.494 21.609 -14.765 535 1HD1 ILE 75 2HD1 ILE 75 -5.970 21.851 -15.351 536 2HD1 ILE 75 3HD1 ILE 75 -6.722 20.239 -15.410 537 3HD1 ILE 75 1HD1 ILE 75 -5.570 20.637 -14.112 538 H ARG 76 H ARG 76 -2.814 21.806 -19.326 539 HA ARG 76 HA ARG 76 -1.178 23.956 -19.196 540 1HB ARG 76 1HB ARG 76 -1.895 22.674 -21.862 541 2HB ARG 76 2HB ARG 76 -0.329 23.255 -21.331 542 1HG ARG 76 1HG ARG 76 -0.774 21.388 -19.393 543 2HG ARG 76 2HG ARG 76 -1.720 20.676 -20.686 544 1HD ARG 76 1HD ARG 76 0.830 21.603 -21.752 545 2HD ARG 76 2HD ARG 76 1.119 20.587 -20.354 546 HE ARG 76 HE ARG 76 -0.087 19.755 -22.912 547 2HH1 ARG 76 1HH ARG 76 -0.298 16.419 -21.969 548 1HH2 ARG 76 2HH2 ARG 76 0.472 18.909 -19.517 549 2HH2 ARG 76 1HH2 ARG 76 0.223 17.214 -19.769 550 H GLN 77 H GLN 77 -4.439 23.711 -20.494 551 HA GLN 77 HA GLN 77 -4.194 26.000 -22.162 552 1HB GLN 77 1HB GLN 77 -6.485 24.225 -21.277 553 2HB GLN 77 2HB GLN 77 -6.811 25.723 -22.127 554 1HG GLN 77 1HG GLN 77 -4.674 24.303 -23.495 555 2HG GLN 77 2HG GLN 77 -6.020 23.209 -23.247 556 1HE2 GLN 77 1HE2 GLN 77 -7.082 23.093 -25.077 557 2HE2 GLN 77 2HE2 GLN 77 -7.652 24.416 -26.039 558 H ALA 78 H ALA 78 -4.920 25.318 -18.789 559 HA ALA 78 HA ALA 78 -6.422 27.632 -18.232 560 1HB ALA 78 3HB ALA 78 -4.681 26.494 -16.109 561 2HB ALA 78 1HB ALA 78 -6.437 26.785 -16.116 562 3HB ALA 78 2HB ALA 78 -5.772 25.336 -16.908 563 H GLY 79 H GLY 79 -3.050 27.062 -18.938 564 1HA GLY 79 2HA GLY 79 -2.473 29.862 -18.203 565 2HA GLY 79 1HA GLY 79 -1.721 28.962 -19.505 566 H VAL 80 H VAL 80 -1.767 26.500 -17.517 567 HA VAL 80 HA VAL 80 0.234 27.353 -15.609 568 HB VAL 80 HB VAL 80 -0.799 24.565 -16.103 569 1HG1 VAL 80 1HG1 VAL 80 1.018 25.758 -14.228 570 2HG1 VAL 80 2HG1 VAL 80 -0.415 25.168 -13.352 571 3HG1 VAL 80 3HG1 VAL 80 0.520 24.056 -14.380 572 1HG2 VAL 80 2HG2 VAL 80 -2.579 26.491 -15.751 573 2HG2 VAL 80 3HG2 VAL 80 -2.732 24.931 -14.909 574 3HG2 VAL 80 1HG2 VAL 80 -2.071 26.343 -14.052 575 H GLN 81 H GLN 81 2.044 27.930 -16.870 576 HA GLN 81 HA GLN 81 3.382 25.615 -17.975 577 1HB GLN 81 1HB GLN 81 2.166 27.005 -19.804 578 2HB GLN 81 2HB GLN 81 3.366 28.245 -19.497 579 1HG GLN 81 1HG GLN 81 5.030 26.103 -19.749 580 2HG GLN 81 2HG GLN 81 3.706 25.537 -20.749 581 1HE2 GLN 81 1HE2 GLN 81 6.452 26.401 -21.396 582 2HE2 GLN 81 2HE2 GLN 81 6.317 27.642 -22.597 583 H TYR 82 H TYR 82 3.396 27.783 -15.640 584 HA TYR 82 HA TYR 82 6.276 27.907 -15.543 585 1HB TYR 82 1HB TYR 82 6.266 30.378 -15.354 586 2HB TYR 82 2HB TYR 82 5.429 29.962 -16.836 587 HD1 TYR 82 1HD TYR 82 2.805 29.718 -16.636 588 HD2 TYR 82 2HD TYR 82 5.254 31.840 -13.842 589 HE1 TYR 82 1HE TYR 82 0.780 31.044 -15.857 590 HE2 TYR 82 2HE TYR 82 3.222 33.158 -13.073 591 HH TYR 82 HH TYR 82 0.740 32.775 -13.031 592 H SER 83 H SER 83 6.655 27.078 -13.549 593 HA SER 83 HA SER 83 5.007 28.154 -11.401 594 1HB SER 83 1HB SER 83 5.290 25.840 -10.299 595 2HB SER 83 2HB SER 83 4.155 25.951 -11.630 596 HG SER 83 HG SER 83 6.768 25.365 -12.455 597 H ARG 84 H ARG 84 7.912 28.363 -12.747 598 HA ARG 84 HA ARG 84 9.710 27.476 -10.861 599 1HB ARG 84 1HB ARG 84 11.318 28.946 -11.975 600 2HB ARG 84 2HB ARG 84 10.257 28.273 -13.197 601 1HG ARG 84 1HG ARG 84 9.818 30.397 -13.865 602 2HG ARG 84 2HG ARG 84 8.917 30.609 -12.377 603 1HD ARG 84 1HD ARG 84 10.493 32.017 -11.528 604 2HD ARG 84 2HD ARG 84 11.783 30.876 -11.856 605 HE ARG 84 HE ARG 84 10.842 32.184 -14.286 606 2HH1 ARG 84 1HH ARG 84 13.552 34.341 -14.545 607 1HH2 ARG 84 2HH2 ARG 84 12.978 32.575 -11.486 608 2HH2 ARG 84 1HH2 ARG 84 14.019 33.707 -12.282 609 H ALA 85 H ALA 85 7.371 30.016 -10.722 610 HA ALA 85 HA ALA 85 8.878 31.462 -8.673 611 1HB ALA 85 2HB ALA 85 8.031 33.152 -9.928 612 2HB ALA 85 1HB ALA 85 6.516 32.822 -9.054 613 3HB ALA 85 3HB ALA 85 6.788 32.111 -10.663 614 H ASP 86 H ASP 86 8.302 28.975 -7.769 615 HA ASP 86 HA ASP 86 5.918 29.432 -6.152 616 1HB ASP 86 1HB ASP 86 6.139 27.401 -7.890 617 2HB ASP 86 2HB ASP 86 7.072 26.673 -6.598 618 HD2 ASP 86 HD ASP 86 3.622 25.899 -6.933 619 H GLU 87 H GLU 87 8.421 30.521 -5.402 620 HA GLU 87 HA GLU 87 10.219 29.025 -4.119 621 1HB GLU 87 1HB GLU 87 10.574 31.002 -2.610 622 2HB GLU 87 2HB GLU 87 10.453 31.435 -4.304 623 1HG GLU 87 1HG GLU 87 8.057 32.048 -3.991 624 2HG GLU 87 2HG GLU 87 8.145 31.578 -2.305 625 HE2 GLU 87 HE GLU 87 8.478 33.460 -1.048 626 H GLU 88 H GLU 88 6.857 29.529 -3.211 627 HA GLU 88 HA GLU 88 6.923 29.118 -0.534 628 1HB GLU 88 1HB GLU 88 4.956 29.414 -2.372 629 2HB GLU 88 2HB GLU 88 4.786 27.693 -2.086 630 1HG GLU 88 1HG GLU 88 3.447 28.391 -0.352 631 2HG GLU 88 2HG GLU 88 4.973 28.527 0.497 632 HE2 GLU 88 HE GLU 88 2.483 30.064 0.581 633 H GLN 89 H GLN 89 7.597 26.844 -3.149 634 HA GLN 89 HA GLN 89 7.417 24.616 -1.320 635 1HB GLN 89 1HB GLN 89 7.700 23.208 -3.279 636 2HB GLN 89 2HB GLN 89 6.511 24.439 -3.656 637 1HG GLN 89 1HG GLN 89 7.855 25.456 -5.223 638 2HG GLN 89 2HG GLN 89 9.310 25.237 -4.271 639 1HE2 GLN 89 1HE2 GLN 89 10.338 24.647 -6.237 640 2HE2 GLN 89 2HE2 GLN 89 10.209 23.044 -6.880 641 H GLN 90 H GLN 90 9.464 26.843 -1.082 642 HA GLN 90 HA GLN 90 11.911 25.997 -2.013 643 1HB GLN 90 1HB GLN 90 12.834 27.453 -0.158 644 2HB GLN 90 2HB GLN 90 11.645 28.241 -1.177 645 1HG GLN 90 1HG GLN 90 10.557 28.775 0.750 646 2HG GLN 90 2HG GLN 90 10.045 27.099 0.796 647 1HE2 GLN 90 1HE2 GLN 90 10.228 26.351 2.760 648 2HE2 GLN 90 2HE2 GLN 90 11.564 26.552 3.843 649 H GLN 91 H GLN 91 9.850 24.601 0.374 650 HA GLN 91 HA GLN 91 11.986 23.466 1.897 651 1HB GLN 91 1HB GLN 91 9.548 24.127 2.664 652 2HB GLN 91 2HB GLN 91 9.101 22.554 2.032 653 1HG GLN 91 1HG GLN 91 11.467 22.133 3.577 654 2HG GLN 91 2HG GLN 91 10.457 23.203 4.529 655 1HE2 GLN 91 1HE2 GLN 91 10.931 20.790 5.518 656 2HE2 GLN 91 2HE2 GLN 91 9.549 19.750 5.433 657 H ALA 92 H ALA 92 11.211 22.951 -1.176 658 HA ALA 92 HA ALA 92 11.015 20.044 -1.032 659 1HB ALA 92 1HB ALA 92 9.467 21.157 -2.536 660 2HB ALA 92 2HB ALA 92 10.799 22.045 -3.315 661 3HB ALA 92 3HB ALA 92 10.673 20.281 -3.510 662 H LEU 93 H LEU 93 13.425 21.323 -0.038 663 HA LEU 93 HA LEU 93 15.396 21.295 -2.078 664 1HB LEU 93 1HB LEU 93 16.960 21.592 -0.289 665 2HB LEU 93 2HB LEU 93 15.578 22.644 -0.058 666 HG LEU 93 HG LEU 93 15.695 19.990 1.353 667 1HD1 LEU 93 1HD1 LEU 93 17.833 21.525 1.623 668 2HD1 LEU 93 2HD1 LEU 93 16.764 22.411 2.738 669 3HD1 LEU 93 3HD1 LEU 93 17.102 20.686 3.012 670 1HD2 LEU 93 3HD2 LEU 93 14.074 22.445 1.473 671 2HD2 LEU 93 1HD2 LEU 93 13.675 20.772 1.932 672 3HD2 LEU 93 2HD2 LEU 93 14.584 21.811 3.057 673 H SER 94 H SER 94 14.230 19.081 -2.795 674 HA SER 94 HA SER 94 14.546 16.764 -1.527 675 1HB SER 94 1HB SER 94 15.242 17.135 -4.471 676 2HB SER 94 2HB SER 94 14.613 15.683 -3.716 677 HG SER 94 HG SER 94 12.915 16.827 -4.782 678 H SER 95 H SER 95 17.089 18.690 -3.172 679 HA SER 95 HA SER 95 19.081 16.924 -3.400 680 1HB SER 95 1HB SER 95 18.821 19.742 -3.348 681 2HB SER 95 2HB SER 95 20.091 19.393 -2.192 682 HG SER 95 HG SER 95 21.412 18.988 -3.818 683 H GLN 96 H GLN 96 18.626 19.035 -0.460 684 HA GLN 96 HA GLN 96 20.463 17.602 1.052 685 1HB GLN 96 1HB GLN 96 19.829 19.907 1.595 686 2HB GLN 96 2HB GLN 96 18.169 19.429 1.885 687 1HG GLN 96 1HG GLN 96 20.433 18.151 3.457 688 2HG GLN 96 2HG GLN 96 19.790 19.709 3.937 689 1HE2 GLN 96 1HE2 GLN 96 19.716 16.851 5.006 690 2HE2 GLN 96 2HE2 GLN 96 18.058 16.567 5.416 691 H MET 97 H MET 97 16.864 17.433 0.780 692 HA MET 97 HA MET 97 16.339 15.740 2.820 693 1HB MET 97 1HB MET 97 14.910 16.857 0.777 694 2HB MET 97 2HB MET 97 14.999 15.219 0.160 695 1HG MET 97 1HG MET 97 14.292 14.694 2.757 696 2HG MET 97 2HG MET 97 13.545 16.267 2.560 697 1HE MET 97 1HE MET 97 13.002 12.693 2.379 698 2HE MET 97 2HE MET 97 12.228 12.311 0.822 699 3HE MET 97 3HE MET 97 13.960 12.716 0.879 700 H GLY 98 H GLY 98 15.709 13.342 2.709 701 1HA GLY 98 2HA GLY 98 16.495 11.230 2.573 702 2HA GLY 98 1HA GLY 98 17.967 11.837 1.840 703 H PHE 99 H PHE 99 17.342 12.954 -0.525 704 HA PHE 99 HA PHE 99 15.657 10.985 -1.896 705 1HB PHE 99 1HB PHE 99 14.851 13.206 -2.326 706 2HB PHE 99 2HB PHE 99 16.460 13.898 -2.262 707 HD1 PHE 99 1HD PHE 99 14.110 11.990 -4.363 708 HD2 PHE 99 2HD PHE 99 17.814 14.056 -4.223 709 HE1 PHE 99 1HE PHE 99 14.226 11.953 -6.870 710 HE2 PHE 99 2HE PHE 99 17.930 14.019 -6.730 711 HZ PHE 99 HZ PHE 99 16.134 12.968 -8.024 712 H MET 601 H MET 601 7.983 -18.261 -19.475 713 HA MET 601 HA MET 601 9.652 -19.533 -20.341 714 1HB MET 601 1HB MET 601 9.138 -19.811 -17.425 715 2HB MET 601 2HB MET 601 10.181 -21.077 -18.042 716 1HG MET 601 1HG MET 601 10.767 -18.237 -18.884 717 2HG MET 601 2HG MET 601 11.168 -18.703 -17.243 718 1HE MET 601 3HE MET 601 12.369 -17.881 -20.076 719 2HE MET 601 1HE MET 601 13.992 -18.176 -19.408 720 3HE MET 601 2HE MET 601 13.444 -19.075 -20.843 721 H THR 602 H THR 602 7.753 -21.833 -18.244 722 HA THR 602 HA THR 602 8.573 -24.175 -19.346 723 HB THR 602 HB THR 602 5.901 -23.234 -18.210 724 HG1 THR 602 1HG THR 602 6.917 -24.106 -16.375 725 1HG2 THR 602 3HG2 THR 602 6.819 -26.101 -18.787 726 2HG2 THR 602 1HG2 THR 602 5.362 -25.639 -17.874 727 3HG2 THR 602 2HG2 THR 602 5.475 -25.277 -19.613 728 H GLU 603 H GLU 603 5.899 -22.071 -20.576 729 HA GLU 603 HA GLU 603 6.326 -23.383 -23.132 730 1HB GLU 603 1HB GLU 603 3.731 -23.138 -21.608 731 2HB GLU 603 2HB GLU 603 3.689 -23.080 -23.359 732 1HG GLU 603 1HG GLU 603 4.355 -25.294 -23.599 733 2HG GLU 603 2HG GLU 603 5.341 -25.273 -22.150 734 HE2 GLU 603 HE GLU 603 2.644 -27.388 -21.522 735 H GLN 604 H GLN 604 6.968 -21.801 -24.524 736 HA GLN 604 HA GLN 604 6.688 -19.116 -23.939 737 1HB GLN 604 1HB GLN 604 7.497 -20.720 -26.351 738 2HB GLN 604 2HB GLN 604 7.165 -19.016 -26.589 739 1HG GLN 604 1HG GLN 604 8.842 -18.371 -24.947 740 2HG GLN 604 2HG GLN 604 9.037 -20.025 -24.403 741 1HE2 GLN 604 1HE2 GLN 604 10.443 -17.678 -26.120 742 2HE2 GLN 604 2HE2 GLN 604 11.381 -18.577 -27.266 743 H GLN 605 H GLN 605 4.790 -21.307 -26.098 744 HA GLN 605 HA GLN 605 3.249 -19.636 -27.433 745 1HB GLN 605 1HB GLN 605 1.352 -21.355 -27.056 746 2HB GLN 605 2HB GLN 605 2.855 -21.951 -27.731 747 1HG GLN 605 1HG GLN 605 3.587 -22.782 -25.543 748 2HG GLN 605 2HG GLN 605 2.224 -22.023 -24.746 749 1HE2 GLN 605 1HE2 GLN 605 3.368 -24.692 -26.579 750 2HE2 GLN 605 2HE2 GLN 605 1.926 -25.652 -26.595 751 H TRP 606 H TRP 606 3.000 -20.339 -23.923 752 HA TRP 606 HA TRP 606 1.689 -17.863 -23.470 753 1HB TRP 606 1HB TRP 606 -0.421 -18.621 -22.664 754 2HB TRP 606 2HB TRP 606 -0.226 -19.152 -24.323 755 HD1 TRP 606 HD TRP 606 0.028 -21.846 -24.717 756 HE1 TRP 606 1HE TRP 606 -0.564 -23.984 -23.288 757 HE3 TRP 606 3HE TRP 606 -0.454 -19.397 -20.287 758 HZ2 TRP 606 2HZ TRP 606 -1.155 -24.401 -20.527 759 HZ3 TRP 606 3HZ TRP 606 -1.040 -20.743 -18.273 760 HH2 TRP 606 HH TRP 606 -1.388 -23.162 -18.343 761 H ASN 607 H ASN 607 3.544 -17.629 -22.098 762 HA ASN 607 HA ASN 607 4.584 -19.424 -20.419 763 1HB ASN 607 1HB ASN 607 4.099 -16.442 -19.914 764 2HB ASN 607 2HB ASN 607 5.177 -17.418 -18.937 765 1HD2 ASN 607 1HD2 ASN 607 5.531 -15.105 -20.832 766 2HD2 ASN 607 2HD2 ASN 607 6.796 -15.576 -21.918 767 H PHE 608 H PHE 608 3.547 -20.718 -18.892 768 HA PHE 608 HA PHE 608 0.999 -20.245 -17.936 769 1HB PHE 608 1HB PHE 608 2.650 -22.337 -17.968 770 2HB PHE 608 2HB PHE 608 3.232 -21.713 -16.437 771 HD1 PHE 608 1HD PHE 608 0.956 -20.914 -14.951 772 HD2 PHE 608 2HD PHE 608 1.297 -24.167 -17.654 773 HE1 PHE 608 1HE PHE 608 -0.907 -22.100 -13.758 774 HE2 PHE 608 2HE PHE 608 -0.566 -25.353 -16.461 775 HZ PHE 608 HZ PHE 608 -1.646 -24.306 -14.528 776 H ALA 609 H ALA 609 4.223 -19.557 -16.435 777 HA ALA 609 HA ALA 609 3.131 -18.591 -14.021 778 1HB ALA 609 1HB ALA 609 5.809 -18.432 -15.419 779 2HB ALA 609 3HB ALA 609 5.366 -19.320 -13.941 780 3HB ALA 609 2HB ALA 609 5.514 -17.547 -13.903 781 H GLY 610 H GLY 610 3.018 -17.383 -17.200 782 1HA GLY 610 2HA GLY 610 2.988 -15.219 -18.031 783 2HA GLY 610 1HA GLY 610 3.113 -14.571 -16.407 784 H ILE 611 H ILE 611 0.844 -16.781 -18.210 785 HA ILE 611 HA ILE 611 -1.309 -14.988 -18.011 786 HB ILE 611 HB ILE 611 -0.934 -16.833 -19.690 787 1HG1 ILE 611 1HG1 ILE 611 -3.127 -15.497 -19.097 788 2HG1 ILE 611 2HG1 ILE 611 -3.148 -16.815 -20.252 789 1HG2 ILE 611 3HG2 ILE 611 -1.882 -18.513 -17.362 790 2HG2 ILE 611 1HG2 ILE 611 -1.984 -19.040 -19.059 791 3HG2 ILE 611 2HG2 ILE 611 -0.398 -18.698 -18.327 792 1HD1 ILE 611 3HD1 ILE 611 -3.764 -18.376 -18.318 793 2HD1 ILE 611 1HD1 ILE 611 -3.980 -16.916 -17.322 794 3HD1 ILE 611 2HD1 ILE 611 -5.004 -17.176 -18.755 795 H GLU 612 H GLU 612 0.062 -17.414 -15.842 796 HA GLU 612 HA GLU 612 -2.260 -17.733 -14.296 797 1HB GLU 612 1HB GLU 612 -0.521 -19.427 -14.246 798 2HB GLU 612 2HB GLU 612 0.686 -18.264 -13.736 799 1HG GLU 612 1HG GLU 612 -0.733 -17.875 -11.628 800 2HG GLU 612 2HG GLU 612 -1.713 -19.240 -12.124 801 HE2 GLU 612 HE GLU 612 -0.614 -20.494 -10.084 802 H ALA 613 H ALA 613 0.755 -15.749 -13.913 803 HA ALA 613 HA ALA 613 -0.295 -14.476 -11.563 804 1HB ALA 613 3HB ALA 613 1.821 -13.293 -11.572 805 2HB ALA 613 2HB ALA 613 2.136 -13.777 -13.256 806 3HB ALA 613 1HB ALA 613 2.134 -15.001 -11.963 807 H ALA 614 H ALA 614 -0.506 -14.082 -15.021 808 HA ALA 614 HA ALA 614 -0.670 -11.384 -15.361 809 1HB ALA 614 1HB ALA 614 -2.211 -13.691 -16.595 810 2HB ALA 614 2HB ALA 614 -2.356 -12.017 -17.183 811 3HB ALA 614 3HB ALA 614 -0.783 -12.848 -17.242 812 H ALA 615 H ALA 615 -3.329 -13.643 -14.350 813 HA ALA 615 HA ALA 615 -5.318 -11.754 -14.112 814 1HB ALA 615 2HB ALA 615 -6.159 -13.867 -13.886 815 2HB ALA 615 3HB ALA 615 -4.719 -14.464 -13.026 816 3HB ALA 615 1HB ALA 615 -5.952 -13.523 -12.152 817 H SER 616 H SER 616 -3.018 -12.956 -11.565 818 HA SER 616 HA SER 616 -3.917 -11.384 -9.542 819 1HB SER 616 1HB SER 616 -1.765 -13.128 -9.986 820 2HB SER 616 2HB SER 616 -0.980 -11.616 -9.575 821 HG SER 616 HG SER 616 -2.225 -13.380 -7.920 822 H ALA 617 H ALA 617 -1.983 -10.541 -12.390 823 HA ALA 617 HA ALA 617 -1.009 -8.076 -11.347 824 1HB ALA 617 3HB ALA 617 -0.416 -9.728 -13.480 825 2HB ALA 617 2HB ALA 617 0.197 -8.071 -13.264 826 3HB ALA 617 1HB ALA 617 -1.238 -8.364 -14.275 827 H ILE 618 H ILE 618 -3.840 -9.163 -13.280 828 HA ILE 618 HA ILE 618 -4.744 -6.628 -13.999 829 HB ILE 618 HB ILE 618 -6.240 -9.210 -13.544 830 1HG1 ILE 618 1HG1 ILE 618 -4.417 -9.351 -15.202 831 2HG1 ILE 618 2HG1 ILE 618 -6.002 -9.568 -15.917 832 1HG2 ILE 618 2HG2 ILE 618 -7.571 -6.985 -13.553 833 2HG2 ILE 618 3HG2 ILE 618 -7.199 -6.960 -15.294 834 3HG2 ILE 618 1HG2 ILE 618 -8.107 -8.324 -14.597 835 1HD1 ILE 618 1HD1 ILE 618 -5.368 -6.742 -15.933 836 2HD1 ILE 618 2HD1 ILE 618 -4.011 -7.653 -16.639 837 3HD1 ILE 618 3HD1 ILE 618 -5.649 -7.827 -17.316 838 H GLN 619 H GLN 619 -5.310 -8.652 -11.070 839 HA GLN 619 HA GLN 619 -7.253 -7.091 -9.942 840 1HB GLN 619 1HB GLN 619 -5.447 -9.221 -9.115 841 2HB GLN 619 2HB GLN 619 -5.621 -8.055 -7.818 842 1HG GLN 619 1HG GLN 619 -7.985 -9.279 -9.315 843 2HG GLN 619 2HG GLN 619 -7.355 -9.919 -7.811 844 1HE2 GLN 619 1HE2 GLN 619 -9.670 -8.038 -9.112 845 2HE2 GLN 619 2HE2 GLN 619 -10.058 -6.989 -7.789 846 H GLY 620 H GLY 620 -3.703 -7.040 -9.115 847 1HA GLY 620 2HA GLY 620 -2.360 -5.358 -8.469 848 2HA GLY 620 1HA GLY 620 -3.719 -4.798 -7.514 849 H ASN 621 H ASN 621 -3.778 -5.073 -11.089 850 HA ASN 621 HA ASN 621 -3.115 -2.361 -11.485 851 1HB ASN 621 1HB ASN 621 -4.138 -4.640 -13.196 852 2HB ASN 621 2HB ASN 621 -4.268 -3.016 -13.840 853 1HD2 ASN 621 1HD2 ASN 621 -2.177 -1.663 -13.310 854 2HD2 ASN 621 2HD2 ASN 621 -0.685 -2.401 -13.788 855 H VAL 622 H VAL 622 -6.063 -4.311 -11.001 856 HA VAL 622 HA VAL 622 -7.899 -2.401 -11.985 857 HB VAL 622 HB VAL 622 -8.091 -4.806 -10.178 858 1HG1 VAL 622 2HG1 VAL 622 -10.246 -2.850 -10.983 859 2HG1 VAL 622 3HG1 VAL 622 -10.623 -4.555 -10.637 860 3HG1 VAL 622 1HG1 VAL 622 -9.889 -3.532 -9.378 861 1HG2 VAL 622 2HG2 VAL 622 -7.778 -4.640 -12.889 862 2HG2 VAL 622 3HG2 VAL 622 -8.553 -5.997 -12.037 863 3HG2 VAL 622 1HG2 VAL 622 -9.551 -4.703 -12.743 864 H THR 623 H THR 623 -6.874 -3.336 -8.624 865 HA THR 623 HA THR 623 -8.350 -1.356 -7.331 866 HB THR 623 HB THR 623 -6.791 -1.897 -5.445 867 HG1 THR 623 1HG THR 623 -4.880 -1.967 -6.883 868 1HG2 THR 623 1HG2 THR 623 -8.539 -3.660 -6.353 869 2HG2 THR 623 2HG2 THR 623 -7.107 -4.479 -7.022 870 3HG2 THR 623 3HG2 THR 623 -7.249 -4.227 -5.266 871 H SER 624 H SER 624 -5.117 -1.258 -8.868 872 HA SER 624 HA SER 624 -4.214 1.065 -7.802 873 1HB SER 624 1HB SER 624 -3.665 -0.575 -10.139 874 2HB SER 624 2HB SER 624 -3.519 1.117 -10.570 875 HG SER 624 HG SER 624 -1.707 1.258 -9.437 876 H ILE 625 H ILE 625 -6.197 0.644 -10.827 877 HA ILE 625 HA ILE 625 -6.485 3.402 -11.273 878 HB ILE 625 HB ILE 625 -7.606 0.882 -12.339 879 1HG1 ILE 625 1HG1 ILE 625 -7.084 3.007 -14.230 880 2HG1 ILE 625 2HG1 ILE 625 -5.738 2.850 -13.118 881 1HG2 ILE 625 2HG2 ILE 625 -9.053 3.526 -12.562 882 2HG2 ILE 625 3HG2 ILE 625 -9.254 2.199 -13.731 883 3HG2 ILE 625 1HG2 ILE 625 -9.693 1.955 -12.024 884 1HD1 ILE 625 1HD1 ILE 625 -5.795 0.328 -13.549 885 2HD1 ILE 625 2HD1 ILE 625 -6.964 0.662 -14.849 886 3HD1 ILE 625 3HD1 ILE 625 -5.315 1.327 -14.941 887 H HIS 626 H HIS 626 -8.134 1.064 -9.190 888 HA HIS 626 HA HIS 626 -10.523 2.412 -8.840 889 1HB HIS 626 1HB HIS 626 -9.764 0.067 -8.072 890 2HB HIS 626 2HB HIS 626 -9.114 0.874 -6.658 891 HD1 HIS 626 1HD HIS 626 -10.971 -0.701 -5.417 892 HD2 HIS 626 2HD HIS 626 -12.431 2.490 -7.716 893 HE1 HIS 626 1HE HIS 626 -13.384 -0.331 -4.675 894 H SER 627 H SER 627 -7.427 2.632 -6.956 895 HA SER 627 HA SER 627 -8.480 4.778 -5.422 896 1HB SER 627 1HB SER 627 -5.941 3.204 -5.537 897 2HB SER 627 2HB SER 627 -5.795 4.833 -4.908 898 HG SER 627 HG SER 627 -6.438 3.928 -3.069 899 H LEU 628 H LEU 628 -6.066 4.347 -8.084 900 HA LEU 628 HA LEU 628 -4.997 6.807 -8.272 901 1HB LEU 628 1HB LEU 628 -5.650 4.642 -10.155 902 2HB LEU 628 2HB LEU 628 -5.424 6.211 -10.901 903 HG LEU 628 HG LEU 628 -3.376 5.180 -8.957 904 1HD1 LEU 628 2HD1 LEU 628 -3.898 4.168 -11.722 905 2HD1 LEU 628 3HD1 LEU 628 -2.213 4.369 -11.184 906 3HD1 LEU 628 1HD1 LEU 628 -3.318 3.310 -10.275 907 1HD2 LEU 628 3HD2 LEU 628 -3.253 7.515 -9.722 908 2HD2 LEU 628 1HD2 LEU 628 -1.855 6.554 -10.263 909 3HD2 LEU 628 2HD2 LEU 628 -3.160 6.951 -11.407 910 H LEU 629 H LEU 629 -8.147 5.801 -9.780 911 HA LEU 629 HA LEU 629 -8.810 8.244 -10.839 912 1HB LEU 629 1HB LEU 629 -10.075 5.727 -10.285 913 2HB LEU 629 2HB LEU 629 -11.181 7.029 -9.894 914 HG LEU 629 HG LEU 629 -11.379 6.129 -12.219 915 1HD1 LEU 629 3HD1 LEU 629 -10.999 8.992 -11.520 916 2HD1 LEU 629 1HD1 LEU 629 -11.097 8.587 -13.250 917 3HD1 LEU 629 2HD1 LEU 629 -12.425 8.137 -12.154 918 1HD2 LEU 629 1HD2 LEU 629 -8.536 6.701 -12.234 919 2HD2 LEU 629 2HD2 LEU 629 -9.518 5.746 -13.371 920 3HD2 LEU 629 3HD2 LEU 629 -9.370 7.507 -13.584 921 H ASP 630 H ASP 630 -9.319 6.978 -7.498 922 HA ASP 630 HA ASP 630 -10.789 9.166 -6.638 923 1HB ASP 630 1HB ASP 630 -10.635 6.982 -5.438 924 2HB ASP 630 2HB ASP 630 -8.948 7.293 -5.077 925 HD2 ASP 630 HD ASP 630 -9.579 8.099 -2.224 926 H GLU 631 H GLU 631 -7.336 8.545 -7.140 927 HA GLU 631 HA GLU 631 -6.426 10.594 -5.425 928 1HB GLU 631 1HB GLU 631 -5.279 8.562 -7.182 929 2HB GLU 631 2HB GLU 631 -4.441 10.087 -7.385 930 1HG GLU 631 1HG GLU 631 -3.940 10.231 -5.010 931 2HG GLU 631 2HG GLU 631 -5.021 8.904 -4.635 932 HE2 GLU 631 HE GLU 631 -2.705 6.528 -5.122 933 H GLY 632 H GLY 632 -6.802 10.266 -9.023 934 1HA GLY 632 2HA GLY 632 -6.872 11.811 -10.657 935 2HA GLY 632 1HA GLY 632 -5.965 12.896 -9.623 936 H LYS 633 H LYS 633 -9.130 11.411 -8.780 937 HA LYS 633 HA LYS 633 -10.777 13.459 -9.634 938 1HB LYS 633 1HB LYS 633 -11.356 11.115 -8.776 939 2HB LYS 633 2HB LYS 633 -11.251 11.785 -7.161 940 1HG LYS 633 1HG LYS 633 -13.578 11.893 -7.907 941 2HG LYS 633 2HG LYS 633 -12.951 13.524 -7.780 942 1HD LYS 633 1HD LYS 633 -12.321 12.743 -10.423 943 2HD LYS 633 2HD LYS 633 -13.922 12.086 -10.151 944 1HE LYS 633 1HE LYS 633 -14.836 14.254 -9.606 945 2HE LYS 633 2HE LYS 633 -13.245 14.968 -9.435 946 H GLN 634 H GLN 634 -8.649 13.191 -6.795 947 HA GLN 634 HA GLN 634 -9.827 15.332 -5.414 948 1HB GLN 634 1HB GLN 634 -7.157 13.900 -5.221 949 2HB GLN 634 2HB GLN 634 -7.508 15.286 -4.208 950 1HG GLN 634 1HG GLN 634 -9.814 13.607 -4.062 951 2HG GLN 634 2HG GLN 634 -8.432 12.538 -3.928 952 1HE2 GLN 634 1HE2 GLN 634 -10.536 14.422 -2.260 953 2HE2 GLN 634 2HE2 GLN 634 -9.644 14.728 -0.807 954 H SER 635 H SER 635 -7.540 15.062 -8.079 955 HA SER 635 HA SER 635 -6.576 17.733 -7.686 956 1HB SER 635 1HB SER 635 -5.659 15.398 -9.034 957 2HB SER 635 2HB SER 635 -5.932 16.592 -10.287 958 HG SER 635 HG SER 635 -4.514 17.315 -7.891 959 H LEU 636 H LEU 636 -9.200 16.080 -9.265 960 HA LEU 636 HA LEU 636 -9.574 17.769 -11.466 961 1HB LEU 636 1HB LEU 636 -10.922 15.584 -10.148 962 2HB LEU 636 2HB LEU 636 -12.077 16.816 -10.618 963 HG LEU 636 HG LEU 636 -11.676 14.961 -12.283 964 1HD1 LEU 636 2HD1 LEU 636 -11.296 17.850 -13.095 965 2HD1 LEU 636 3HD1 LEU 636 -11.587 16.529 -14.252 966 3HD1 LEU 636 1HD1 LEU 636 -12.810 16.917 -13.017 967 1HD2 LEU 636 3HD2 LEU 636 -9.205 14.866 -11.948 968 2HD2 LEU 636 1HD2 LEU 636 -9.709 14.966 -13.652 969 3HD2 LEU 636 2HD2 LEU 636 -9.073 16.409 -12.827 970 H THR 637 H THR 637 -10.984 17.803 -8.125 971 HA THR 637 HA THR 637 -12.415 20.213 -8.585 972 HB THR 637 HB THR 637 -13.260 18.765 -6.887 973 HG1 THR 637 1HG THR 637 -11.479 20.626 -5.491 974 1HG2 THR 637 3HG2 THR 637 -10.343 18.531 -6.099 975 2HG2 THR 637 1HG2 THR 637 -11.587 18.345 -4.840 976 3HG2 THR 637 2HG2 THR 637 -11.571 17.250 -6.243 977 H LYS 638 H LYS 638 -9.142 19.427 -7.395 978 HA LYS 638 HA LYS 638 -8.666 22.098 -6.508 979 1HB LYS 638 1HB LYS 638 -6.867 19.699 -6.940 980 2HB LYS 638 2HB LYS 638 -6.289 21.242 -6.343 981 1HG LYS 638 1HG LYS 638 -8.270 20.998 -4.589 982 2HG LYS 638 2HG LYS 638 -8.202 19.300 -5.020 983 1HD LYS 638 1HD LYS 638 -5.811 20.939 -4.052 984 2HD LYS 638 2HD LYS 638 -6.762 19.875 -3.036 985 1HE LYS 638 1HE LYS 638 -5.553 18.780 -5.589 986 2HE LYS 638 2HE LYS 638 -4.528 18.994 -4.184 987 H LEU 639 H LEU 639 -8.581 20.367 -9.554 988 HA LEU 639 HA LEU 639 -7.005 22.532 -10.738 989 1HB LEU 639 1HB LEU 639 -7.727 19.791 -11.785 990 2HB LEU 639 2HB LEU 639 -6.829 21.002 -12.679 991 HG LEU 639 HG LEU 639 -5.808 20.121 -9.999 992 1HD1 LEU 639 3HD1 LEU 639 -6.453 18.106 -11.493 993 2HD1 LEU 639 1HD1 LEU 639 -5.054 18.595 -12.479 994 3HD1 LEU 639 2HD1 LEU 639 -4.828 18.162 -10.767 995 1HD2 LEU 639 3HD2 LEU 639 -4.784 22.024 -11.241 996 2HD2 LEU 639 1HD2 LEU 639 -3.662 20.681 -10.914 997 3HD2 LEU 639 2HD2 LEU 639 -4.352 20.887 -12.541 998 H ALA 640 H ALA 640 -10.173 21.734 -10.015 999 HA ALA 640 HA ALA 640 -11.632 22.036 -12.285 1000 1HB ALA 640 3HB ALA 640 -13.366 23.017 -10.773 1001 2HB ALA 640 2HB ALA 640 -12.127 23.172 -9.504 1002 3HB ALA 640 1HB ALA 640 -12.598 21.561 -10.097 1003 H ALA 641 H ALA 641 -9.956 24.565 -10.349 1004 HA ALA 641 HA ALA 641 -11.042 26.776 -11.636 1005 1HB ALA 641 2HB ALA 641 -9.637 27.884 -10.249 1006 2HB ALA 641 3HB ALA 641 -9.249 26.277 -9.590 1007 3HB ALA 641 1HB ALA 641 -8.210 27.000 -10.842 1008 H ALA 642 H ALA 642 -8.522 24.451 -12.588 1009 HA ALA 642 HA ALA 642 -7.182 25.882 -14.499 1010 1HB ALA 642 2HB ALA 642 -8.025 22.981 -14.797 1011 2HB ALA 642 3HB ALA 642 -6.527 23.757 -15.364 1012 3HB ALA 642 1HB ALA 642 -6.796 23.507 -13.622 1013 H TRP 643 H TRP 643 -10.535 24.921 -14.412 1014 HA TRP 643 HA TRP 643 -10.782 25.375 -17.295 1015 1HB TRP 643 1HB TRP 643 -12.566 24.058 -15.254 1016 2HB TRP 643 2HB TRP 643 -13.153 24.537 -16.834 1017 HD1 TRP 643 HD TRP 643 -12.627 22.876 -18.832 1018 HE1 TRP 643 1HE TRP 643 -11.359 20.585 -19.161 1019 HE3 TRP 643 3HE TRP 643 -10.422 22.837 -14.251 1020 HZ2 TRP 643 2HZ TRP 643 -9.615 19.049 -17.505 1021 HZ3 TRP 643 3HZ TRP 643 -8.951 20.906 -13.686 1022 HH2 TRP 643 HH TRP 643 -8.533 19.054 -15.227 1023 H GLY 644 H GLY 644 -11.404 26.657 -14.058 1024 1HA GLY 644 2HA GLY 644 -13.478 28.440 -14.577 1025 2HA GLY 644 1HA GLY 644 -11.990 29.243 -15.039 1026 H GLY 645 H GLY 645 -13.492 27.359 -12.330 1027 1HA GLY 645 2HA GLY 645 -12.802 29.279 -10.383 1028 2HA GLY 645 1HA GLY 645 -11.618 27.987 -10.359 1029 H SER 646 H SER 646 -13.438 25.839 -11.235 1030 HA SER 646 HA SER 646 -14.795 24.361 -10.410 1031 1HB SER 646 1HB SER 646 -14.770 23.910 -8.038 1032 2HB SER 646 2HB SER 646 -13.178 24.497 -8.473 1033 HG SER 646 HG SER 646 -13.844 25.572 -6.575 1034 H GLY 647 H GLY 647 -17.041 24.000 -9.706 1035 1HA GLY 647 2HA GLY 647 -18.575 26.265 -8.765 1036 2HA GLY 647 1HA GLY 647 -19.143 24.638 -9.084 1037 H SER 648 H SER 648 -17.196 25.911 -11.655 1038 HA SER 648 HA SER 648 -19.431 27.139 -12.971 1039 1HB SER 648 1HB SER 648 -16.503 27.123 -13.252 1040 2HB SER 648 2HB SER 648 -17.304 26.963 -14.802 1041 HG SER 648 HG SER 648 -18.058 28.984 -14.675 1042 H GLU 649 H GLU 649 -20.421 26.340 -14.911 1043 HA GLU 649 HA GLU 649 -20.819 23.666 -15.046 1044 1HB GLU 649 1HB GLU 649 -22.282 25.320 -16.126 1045 2HB GLU 649 2HB GLU 649 -21.023 25.742 -17.270 1046 1HG GLU 649 1HG GLU 649 -21.711 24.080 -18.646 1047 2HG GLU 649 2HG GLU 649 -21.329 22.895 -17.413 1048 HE2 GLU 649 HE GLU 649 -24.113 23.797 -19.137 1049 H ALA 650 H ALA 650 -18.304 25.653 -16.651 1050 HA ALA 650 HA ALA 650 -17.383 23.925 -18.544 1051 1HB ALA 650 2HB ALA 650 -16.295 26.133 -16.892 1052 2HB ALA 650 3HB ALA 650 -15.070 25.031 -17.567 1053 3HB ALA 650 1HB ALA 650 -16.208 25.868 -18.650 1054 H TYR 651 H TYR 651 -15.682 24.251 -15.358 1055 HA TYR 651 HA TYR 651 -14.313 21.893 -15.501 1056 1HB TYR 651 1HB TYR 651 -13.774 23.405 -13.729 1057 2HB TYR 651 2HB TYR 651 -15.459 23.737 -13.379 1058 HD1 TYR 651 1HD TYR 651 -13.197 20.729 -13.320 1059 HD2 TYR 651 2HD TYR 651 -16.184 23.032 -11.301 1060 HE1 TYR 651 1HE TYR 651 -13.110 19.127 -11.348 1061 HE2 TYR 651 2HE TYR 651 -16.087 21.422 -9.336 1062 HH TYR 651 HH TYR 651 -15.470 19.168 -8.887 1063 H GLN 652 H GLN 652 -17.697 22.465 -14.458 1064 HA GLN 652 HA GLN 652 -18.110 20.046 -13.224 1065 1HB GLN 652 1HB GLN 652 -19.996 21.878 -14.759 1066 2HB GLN 652 2HB GLN 652 -20.561 20.468 -13.886 1067 1HG GLN 652 1HG GLN 652 -18.794 21.941 -12.139 1068 2HG GLN 652 2HG GLN 652 -19.927 23.079 -12.840 1069 1HE2 GLN 652 1HE2 GLN 652 -19.443 21.326 -10.231 1070 2HE2 GLN 652 2HE2 GLN 652 -21.050 20.889 -9.754 1071 H GLY 653 H GLY 653 -18.702 21.003 -16.680 1072 1HA GLY 653 2HA GLY 653 -18.835 19.776 -18.557 1073 2HA GLY 653 1HA GLY 653 -19.652 18.560 -17.597 1074 H VAL 654 H VAL 654 -16.389 19.564 -16.663 1075 HA VAL 654 HA VAL 654 -15.108 17.489 -18.179 1076 HB VAL 654 HB VAL 654 -14.219 19.503 -16.119 1077 1HG1 VAL 654 2HG1 VAL 654 -12.886 17.478 -15.776 1078 2HG1 VAL 654 3HG1 VAL 654 -12.506 17.417 -17.515 1079 3HG1 VAL 654 1HG1 VAL 654 -11.903 18.764 -16.518 1080 1HG2 VAL 654 2HG2 VAL 654 -14.689 19.745 -18.826 1081 2HG2 VAL 654 3HG2 VAL 654 -13.639 20.805 -17.855 1082 3HG2 VAL 654 1HG2 VAL 654 -12.936 19.444 -18.761 1083 H GLN 655 H GLN 655 -16.026 18.120 -14.740 1084 HA GLN 655 HA GLN 655 -14.841 15.982 -13.590 1085 1HB GLN 655 1HB GLN 655 -17.102 17.758 -12.991 1086 2HB GLN 655 2HB GLN 655 -17.341 16.163 -12.307 1087 1HG GLN 655 1HG GLN 655 -14.575 17.057 -11.918 1088 2HG GLN 655 2HG GLN 655 -15.704 18.230 -11.271 1089 1HE2 GLN 655 1HE2 GLN 655 -14.426 17.358 -9.345 1090 2HE2 GLN 655 2HE2 GLN 655 -15.152 16.070 -8.443 1091 H GLN 656 H GLN 656 -18.087 16.104 -15.201 1092 HA GLN 656 HA GLN 656 -18.722 13.459 -14.674 1093 1HB GLN 656 1HB GLN 656 -19.672 15.565 -16.599 1094 2HB GLN 656 2HB GLN 656 -20.166 13.912 -16.905 1095 1HG GLN 656 1HG GLN 656 -21.879 14.484 -15.468 1096 2HG GLN 656 2HG GLN 656 -20.715 13.984 -14.257 1097 1HE2 GLN 656 1HE2 GLN 656 -21.021 16.871 -16.323 1098 2HE2 GLN 656 2HE2 GLN 656 -21.006 18.052 -15.055 1099 H LYS 657 H LYS 657 -16.816 15.026 -17.261 1100 HA LYS 657 HA LYS 657 -16.738 12.775 -18.960 1101 1HB LYS 657 1HB LYS 657 -15.169 15.336 -18.730 1102 2HB LYS 657 2HB LYS 657 -14.661 14.080 -19.841 1103 1HG LYS 657 1HG LYS 657 -17.124 14.080 -20.697 1104 2HG LYS 657 2HG LYS 657 -17.308 15.582 -19.814 1105 1HD LYS 657 1HD LYS 657 -15.083 15.145 -21.854 1106 2HD LYS 657 2HD LYS 657 -16.651 15.793 -22.295 1107 1HE LYS 657 1HE LYS 657 -16.194 17.505 -20.310 1108 2HE LYS 657 2HE LYS 657 -14.521 17.032 -20.531 1109 H TRP 658 H TRP 658 -14.897 13.834 -16.104 1110 HA TRP 658 HA TRP 658 -12.770 11.987 -16.503 1111 1HB TRP 658 1HB TRP 658 -12.295 13.917 -15.244 1112 2HB TRP 658 2HB TRP 658 -13.686 13.697 -14.202 1113 HD1 TRP 658 HD TRP 658 -13.386 12.004 -12.118 1114 HE1 TRP 658 1HE TRP 658 -11.345 10.816 -10.939 1115 HE3 TRP 658 3HE TRP 658 -10.048 12.871 -15.854 1116 HZ2 TRP 658 2HZ TRP 658 -8.625 10.382 -11.685 1117 HZ3 TRP 658 3HZ TRP 658 -7.720 12.032 -15.549 1118 HH2 TRP 658 HH TRP 658 -6.990 10.826 -13.553 1119 H ASP 659 H ASP 659 -15.633 12.152 -14.258 1120 HA ASP 659 HA ASP 659 -15.232 9.619 -13.224 1121 1HB ASP 659 1HB ASP 659 -16.948 11.727 -12.742 1122 2HB ASP 659 2HB ASP 659 -18.050 10.577 -13.473 1123 HD2 ASP 659 HD ASP 659 -18.466 8.571 -11.158 1124 H ALA 660 H ALA 660 -16.763 10.861 -16.182 1125 HA ALA 660 HA ALA 660 -18.473 8.789 -16.812 1126 1HB ALA 660 1HB ALA 660 -18.635 10.701 -18.145 1127 2HB ALA 660 3HB ALA 660 -17.810 9.561 -19.236 1128 3HB ALA 660 2HB ALA 660 -16.875 10.811 -18.381 1129 H THR 661 H THR 661 -15.535 9.156 -18.824 1130 HA THR 661 HA THR 661 -15.310 6.486 -19.429 1131 HB THR 661 HB THR 661 -13.065 7.143 -20.233 1132 HG1 THR 661 1HG THR 661 -13.677 9.433 -18.499 1133 1HG2 THR 661 2HG2 THR 661 -15.416 8.566 -20.901 1134 2HG2 THR 661 3HG2 THR 661 -14.215 9.833 -20.552 1135 3HG2 THR 661 1HG2 THR 661 -13.879 8.605 -21.797 1136 H ALA 662 H ALA 662 -14.473 8.127 -16.447 1137 HA ALA 662 HA ALA 662 -12.509 6.408 -15.506 1138 1HB ALA 662 3HB ALA 662 -12.775 8.322 -14.232 1139 2HB ALA 662 2HB ALA 662 -13.669 7.154 -13.230 1140 3HB ALA 662 1HB ALA 662 -14.553 8.259 -14.310 1141 H THR 663 H THR 663 -15.796 6.384 -14.034 1142 HA THR 663 HA THR 663 -15.722 3.832 -13.108 1143 HB THR 663 HB THR 663 -17.503 5.252 -12.404 1144 HG1 THR 663 1HG THR 663 -19.395 4.021 -13.342 1145 1HG2 THR 663 3HG2 THR 663 -17.509 6.095 -15.192 1146 2HG2 THR 663 1HG2 THR 663 -19.145 5.567 -14.732 1147 3HG2 THR 663 2HG2 THR 663 -18.333 6.853 -13.807 1148 H GLU 664 H GLU 664 -16.034 4.864 -16.451 1149 HA GLU 664 HA GLU 664 -17.241 2.535 -17.393 1150 1HB GLU 664 1HB GLU 664 -17.161 4.641 -18.683 1151 2HB GLU 664 2HB GLU 664 -15.416 4.534 -18.800 1152 1HG GLU 664 1HG GLU 664 -16.871 3.678 -20.811 1153 2HG GLU 664 2HG GLU 664 -15.482 2.733 -20.314 1154 HE2 GLU 664 HE GLU 664 -16.547 0.836 -21.073 1155 H LEU 665 H LEU 665 -13.775 3.579 -17.162 1156 HA LEU 665 HA LEU 665 -12.873 1.034 -18.133 1157 1HB LEU 665 1HB LEU 665 -11.791 3.279 -18.548 1158 2HB LEU 665 2HB LEU 665 -11.262 3.253 -16.877 1159 HG LEU 665 HG LEU 665 -9.487 2.548 -18.397 1160 1HD1 LEU 665 1HD1 LEU 665 -10.230 1.312 -16.043 1161 2HD1 LEU 665 2HD1 LEU 665 -9.948 -0.055 -17.147 1162 3HD1 LEU 665 3HD1 LEU 665 -8.663 1.146 -16.870 1163 1HD2 LEU 665 3HD2 LEU 665 -10.997 1.594 -20.145 1164 2HD2 LEU 665 1HD2 LEU 665 -9.596 0.572 -19.744 1165 3HD2 LEU 665 2HD2 LEU 665 -11.208 0.161 -19.111 1166 H ASN 666 H ASN 666 -13.725 2.505 -15.065 1167 HA ASN 666 HA ASN 666 -12.117 0.833 -13.484 1168 1HB ASN 666 1HB ASN 666 -13.621 3.086 -13.014 1169 2HB ASN 666 2HB ASN 666 -14.713 1.870 -12.379 1170 1HD2 ASN 666 1HD2 ASN 666 -12.459 3.976 -11.504 1171 2HD2 ASN 666 2HD2 ASN 666 -11.734 3.203 -10.134 1172 H ASN 667 H ASN 667 -15.657 0.920 -14.349 1173 HA ASN 667 HA ASN 667 -16.346 -1.372 -12.991 1174 1HB ASN 667 1HB ASN 667 -18.433 -1.159 -14.081 1175 2HB ASN 667 2HB ASN 667 -17.805 0.472 -14.216 1176 1HD2 ASN 667 1HD2 ASN 667 -17.953 1.359 -16.118 1177 2HD2 ASN 667 2HD2 ASN 667 -17.962 0.565 -17.657 1178 H ALA 668 H ALA 668 -15.154 -0.761 -16.345 1179 HA ALA 668 HA ALA 668 -15.569 -3.323 -17.366 1180 1HB ALA 668 3HB ALA 668 -14.982 -1.101 -18.546 1181 2HB ALA 668 2HB ALA 668 -14.225 -2.585 -19.172 1182 3HB ALA 668 1HB ALA 668 -13.291 -1.478 -18.138 1183 H LEU 669 H LEU 669 -12.736 -1.819 -15.685 1184 HA LEU 669 HA LEU 669 -11.043 -4.006 -15.916 1185 1HB LEU 669 1HB LEU 669 -11.165 -1.490 -14.484 1186 2HB LEU 669 2HB LEU 669 -10.457 -2.747 -13.489 1187 HG LEU 669 HG LEU 669 -9.469 -2.405 -16.300 1188 1HD1 LEU 669 1HD1 LEU 669 -9.631 -0.158 -14.880 1189 2HD1 LEU 669 2HD1 LEU 669 -8.129 -0.802 -14.175 1190 3HD1 LEU 669 3HD1 LEU 669 -8.241 -0.526 -15.930 1191 1HD2 LEU 669 2HD2 LEU 669 -8.813 -4.237 -14.537 1192 2HD2 LEU 669 3HD2 LEU 669 -7.577 -3.488 -15.576 1193 3HD2 LEU 669 1HD2 LEU 669 -7.771 -2.946 -13.892 1194 H GLN 670 H GLN 670 -13.632 -3.225 -13.552 1195 HA GLN 670 HA GLN 670 -13.014 -5.236 -11.759 1196 1HB GLN 670 1HB GLN 670 -15.277 -3.421 -12.307 1197 2HB GLN 670 2HB GLN 670 -15.790 -4.947 -11.614 1198 1HG GLN 670 1HG GLN 670 -13.653 -3.096 -10.454 1199 2HG GLN 670 2HG GLN 670 -15.286 -3.277 -9.843 1200 1HE2 GLN 670 1HE2 GLN 670 -12.290 -4.001 -9.121 1201 2HE2 GLN 670 2HE2 GLN 670 -12.430 -5.554 -8.367 1202 H ASN 671 H ASN 671 -15.386 -5.178 -14.512 1203 HA ASN 671 HA ASN 671 -16.123 -7.846 -14.146 1204 1HB ASN 671 1HB ASN 671 -17.283 -5.889 -15.496 1205 2HB ASN 671 2HB ASN 671 -16.247 -6.387 -16.818 1206 1HD2 ASN 671 1HD2 ASN 671 -17.246 -7.619 -18.200 1207 2HD2 ASN 671 2HD2 ASN 671 -18.403 -8.863 -17.864 1208 H LEU 672 H LEU 672 -13.438 -6.179 -15.713 1209 HA LEU 672 HA LEU 672 -12.779 -8.294 -17.514 1210 1HB LEU 672 1HB LEU 672 -12.209 -6.084 -18.131 1211 2HB LEU 672 2HB LEU 672 -11.400 -5.776 -16.607 1212 HG LEU 672 HG LEU 672 -9.927 -6.125 -18.643 1213 1HD1 LEU 672 2HD1 LEU 672 -9.270 -6.329 -16.172 1214 2HD1 LEU 672 3HD1 LEU 672 -9.289 -8.088 -16.444 1215 3HD1 LEU 672 1HD1 LEU 672 -8.187 -7.054 -17.385 1216 1HD2 LEU 672 3HD2 LEU 672 -11.369 -8.158 -19.369 1217 2HD2 LEU 672 1HD2 LEU 672 -9.606 -8.209 -19.605 1218 3HD2 LEU 672 2HD2 LEU 672 -10.346 -9.075 -18.238 1219 H ALA 673 H ALA 673 -11.705 -7.184 -14.256 1220 HA ALA 673 HA ALA 673 -9.755 -9.293 -14.103 1221 1HB ALA 673 1HB ALA 673 -10.174 -6.794 -12.893 1222 2HB ALA 673 2HB ALA 673 -10.450 -7.976 -11.592 1223 3HB ALA 673 3HB ALA 673 -8.909 -7.977 -12.484 1224 H ARG 674 H ARG 674 -13.162 -8.838 -13.479 1225 HA ARG 674 HA ARG 674 -13.404 -10.677 -11.405 1226 1HB ARG 674 1HB ARG 674 -15.291 -9.454 -13.435 1227 2HB ARG 674 2HB ARG 674 -15.869 -10.786 -12.454 1228 1HG ARG 674 1HG ARG 674 -14.433 -8.766 -10.850 1229 2HG ARG 674 2HG ARG 674 -15.803 -8.080 -11.701 1230 1HD ARG 674 1HD ARG 674 -17.357 -9.578 -10.658 1231 2HD ARG 674 2HD ARG 674 -16.093 -10.681 -10.151 1232 HE ARG 674 HE ARG 674 -16.880 -8.182 -8.815 1233 2HH1 ARG 674 1HH ARG 674 -14.598 -8.579 -6.226 1234 1HH2 ARG 674 2HH2 ARG 674 -14.364 -10.656 -9.132 1235 2HH2 ARG 674 1HH2 ARG 674 -13.653 -10.308 -7.591 1236 H THR 675 H THR 675 -13.060 -10.958 -14.911 1237 HA THR 675 HA THR 675 -13.728 -13.819 -14.758 1238 HB THR 675 HB THR 675 -13.474 -11.970 -17.187 1239 HG1 THR 675 1HG THR 675 -15.725 -13.023 -15.621 1240 1HG2 THR 675 2HG2 THR 675 -13.448 -14.681 -17.263 1241 2HG2 THR 675 3HG2 THR 675 -15.199 -14.440 -17.055 1242 3HG2 THR 675 1HG2 THR 675 -14.362 -13.724 -18.454 1243 H ILE 676 H ILE 676 -11.120 -11.652 -14.663 1244 HA ILE 676 HA ILE 676 -9.349 -13.553 -15.999 1245 HB ILE 676 HB ILE 676 -9.153 -10.663 -15.233 1246 1HG1 ILE 676 1HG1 ILE 676 -8.832 -12.251 -17.787 1247 2HG1 ILE 676 2HG1 ILE 676 -10.062 -11.063 -17.402 1248 1HG2 ILE 676 1HG2 ILE 676 -6.994 -12.587 -15.090 1249 2HG2 ILE 676 2HG2 ILE 676 -6.683 -11.362 -16.344 1250 3HG2 ILE 676 3HG2 ILE 676 -7.014 -10.857 -14.669 1251 1HD1 ILE 676 2HD1 ILE 676 -7.960 -9.453 -17.051 1252 2HD1 ILE 676 3HD1 ILE 676 -7.164 -10.637 -18.115 1253 3HD1 ILE 676 1HD1 ILE 676 -8.608 -9.763 -18.679 1254 H SER 677 H SER 677 -9.700 -11.710 -12.892 1255 HA SER 677 HA SER 677 -7.640 -12.717 -11.533 1256 1HB SER 677 1HB SER 677 -9.052 -11.088 -10.493 1257 2HB SER 677 2HB SER 677 -10.476 -12.100 -10.640 1258 HG SER 677 HG SER 677 -9.786 -12.226 -8.487 1259 H GLU 678 H GLU 678 -10.585 -14.411 -12.550 1260 HA GLU 678 HA GLU 678 -10.459 -16.521 -10.760 1261 1HB GLU 678 1HB GLU 678 -11.876 -17.716 -12.449 1262 2HB GLU 678 2HB GLU 678 -12.456 -16.104 -12.083 1263 1HG GLU 678 1HG GLU 678 -10.980 -15.367 -14.148 1264 2HG GLU 678 2HG GLU 678 -11.014 -17.067 -14.573 1265 HE2 GLU 678 HE GLU 678 -14.038 -16.598 -13.184 1266 H ALA 679 H ALA 679 -8.602 -15.741 -13.663 1267 HA ALA 679 HA ALA 679 -7.745 -18.115 -14.594 1268 1HB ALA 679 2HB ALA 679 -5.816 -15.853 -14.004 1269 2HB ALA 679 3HB ALA 679 -5.854 -16.947 -15.407 1270 3HB ALA 679 1HB ALA 679 -7.102 -15.691 -15.224 1271 H GLY 680 H GLY 680 -7.139 -16.710 -11.407 1272 1HA GLY 680 2HA GLY 680 -6.327 -17.707 -9.545 1273 2HA GLY 680 1HA GLY 680 -4.871 -17.855 -10.510 1274 H GLN 681 H GLN 681 -7.898 -19.508 -9.515 1275 HA GLN 681 HA GLN 681 -6.613 -22.006 -10.307 1276 1HB GLN 681 1HB GLN 681 -8.061 -21.237 -7.769 1277 2HB GLN 681 2HB GLN 681 -8.110 -22.906 -8.300 1278 1HG GLN 681 1HG GLN 681 -5.739 -23.157 -8.146 1279 2HG GLN 681 2HG GLN 681 -5.462 -21.427 -8.144 1280 1HE2 GLN 681 1HE2 GLN 681 -4.303 -21.411 -6.270 1281 2HE2 GLN 681 2HE2 GLN 681 -4.982 -21.685 -4.700 1282 H ALA 682 H ALA 682 -9.609 -20.082 -9.985 1283 HA ALA 682 HA ALA 682 -11.593 -21.769 -10.518 1284 1HB ALA 682 2HB ALA 682 -10.953 -18.973 -11.180 1285 2HB ALA 682 3HB ALA 682 -12.131 -19.707 -12.294 1286 3HB ALA 682 1HB ALA 682 -12.457 -19.680 -10.544 1287 H MET 683 H MET 683 -9.742 -20.185 -13.224 1288 HA MET 683 HA MET 683 -10.721 -21.514 -15.284 1289 1HB MET 683 1HB MET 683 -8.570 -19.879 -14.876 1290 2HB MET 683 2HB MET 683 -7.703 -21.380 -15.135 1291 1HG MET 683 1HG MET 683 -9.765 -20.189 -17.054 1292 2HG MET 683 2HG MET 683 -8.027 -20.113 -17.266 1293 1HE MET 683 1HE MET 683 -6.575 -21.780 -18.025 1294 2HE MET 683 2HE MET 683 -6.756 -22.936 -16.684 1295 3HE MET 683 3HE MET 683 -6.921 -23.492 -18.367 1296 H ALA 684 H ALA 684 -8.474 -22.847 -12.840 1297 HA ALA 684 HA ALA 684 -7.919 -25.223 -14.298 1298 1HB ALA 684 1HB ALA 684 -6.403 -25.491 -12.650 1299 2HB ALA 684 3HB ALA 684 -7.653 -25.391 -11.387 1300 3HB ALA 684 2HB ALA 684 -6.928 -23.903 -12.041 1301 H SER 685 H SER 685 -10.174 -24.311 -11.615 1302 HA SER 685 HA SER 685 -11.195 -26.637 -10.919 1303 1HB SER 685 1HB SER 685 -12.658 -24.042 -11.532 1304 2HB SER 685 2HB SER 685 -13.473 -25.408 -10.796 1305 HG SER 685 HG SER 685 -11.936 -23.533 -9.592 1306 H THR 686 H THR 686 -13.244 -24.798 -13.251 1307 HA THR 686 HA THR 686 -13.073 -26.624 -15.369 1308 HB THR 686 HB THR 686 -14.272 -27.902 -13.322 1309 HG1 THR 686 1HG THR 686 -15.541 -28.906 -15.179 1310 1HG2 THR 686 2HG2 THR 686 -16.505 -26.343 -14.727 1311 2HG2 THR 686 3HG2 THR 686 -16.767 -27.785 -13.717 1312 3HG2 THR 686 1HG2 THR 686 -16.123 -26.294 -12.989 1313 H GLU 687 H GLU 687 -14.723 -26.188 -17.063 1314 HA GLU 687 HA GLU 687 -15.110 -23.405 -17.182 1315 1HB GLU 687 1HB GLU 687 -16.062 -23.855 -19.401 1316 2HB GLU 687 2HB GLU 687 -14.600 -24.794 -19.173 1317 1HG GLU 687 1HG GLU 687 -16.141 -26.725 -18.380 1318 2HG GLU 687 2HG GLU 687 -17.478 -25.777 -19.000 1319 HE2 GLU 687 HE GLU 687 -17.288 -27.855 -21.085 1320 H GLY 688 H GLY 688 -16.777 -22.238 -16.337 1321 1HA GLY 688 2HA GLY 688 -19.470 -23.320 -16.401 1322 2HA GLY 688 1HA GLY 688 -18.974 -21.698 -15.962 1323 H ASN 689 H ASN 689 -16.791 -22.871 -14.120 1324 HA ASN 689 HA ASN 689 -18.286 -24.279 -12.159 1325 1HB ASN 689 1HB ASN 689 -15.677 -24.314 -12.718 1326 2HB ASN 689 2HB ASN 689 -15.608 -22.937 -11.636 1327 1HD2 ASN 689 1HD2 ASN 689 -14.854 -23.565 -9.767 1328 2HD2 ASN 689 2HD2 ASN 689 -15.337 -24.954 -8.852 1329 H VAL 690 H VAL 690 -16.349 -21.180 -12.090 1330 HA VAL 690 HA VAL 690 -18.032 -20.222 -9.926 1331 HB VAL 690 HB VAL 690 -16.370 -18.493 -9.692 1332 1HG1 VAL 690 3HG1 VAL 690 -15.282 -21.298 -10.029 1333 2HG1 VAL 690 1HG1 VAL 690 -14.306 -19.963 -9.370 1334 3HG1 VAL 690 2HG1 VAL 690 -15.792 -20.476 -8.534 1335 1HG2 VAL 690 3HG2 VAL 690 -15.257 -19.586 -12.288 1336 2HG2 VAL 690 1HG2 VAL 690 -15.793 -17.928 -11.925 1337 3HG2 VAL 690 2HG2 VAL 690 -14.307 -18.566 -11.181 1338 H THR 691 H THR 691 -19.803 -19.004 -10.309 1339 HA THR 691 HA THR 691 -19.742 -17.180 -12.590 1340 HB THR 691 HB THR 691 -21.633 -19.518 -12.149 1341 HG1 THR 691 1HG THR 691 -20.462 -19.951 -13.975 1342 1HG2 THR 691 1HG2 THR 691 -22.991 -17.334 -12.379 1343 2HG2 THR 691 2HG2 THR 691 -22.198 -17.118 -13.958 1344 3HG2 THR 691 3HG2 THR 691 -23.245 -18.529 -13.673 1345 H GLY 692 H GLY 692 -21.470 -18.368 -9.653 1346 1HA GLY 692 2HA GLY 692 -22.723 -17.260 -8.141 1347 2HA GLY 692 1HA GLY 692 -22.991 -15.992 -9.321 1348 H MET 693 H MET 693 -19.982 -17.283 -7.734 1349 HA MET 693 HA MET 693 -19.664 -15.124 -6.041 1350 1HB MET 693 1HB MET 693 -18.486 -17.510 -6.216 1351 2HB MET 693 2HB MET 693 -17.329 -16.679 -7.237 1352 1HG MET 693 1HG MET 693 -18.069 -15.691 -4.444 1353 2HG MET 693 2HG MET 693 -16.737 -16.791 -4.737 1354 1HE MET 693 2HE MET 693 -15.562 -14.910 -3.380 1355 2HE MET 693 3HE MET 693 -14.389 -15.560 -4.551 1356 3HE MET 693 1HE MET 693 -14.503 -13.804 -4.287 1357 H PHE 694 H PHE 694 -17.646 -15.873 -8.982 1358 HA PHE 694 HA PHE 694 -16.592 -13.266 -9.077 1359 1HB PHE 694 1HB PHE 694 -16.710 -15.791 -10.741 1360 2HB PHE 694 2HB PHE 694 -16.258 -14.334 -11.603 1361 HD1 PHE 694 1HD PHE 694 -14.410 -12.880 -10.265 1362 HD2 PHE 694 2HD PHE 694 -14.989 -17.069 -9.911 1363 HE1 PHE 694 1HE PHE 694 -12.045 -13.139 -9.465 1364 HE2 PHE 694 2HE PHE 694 -12.624 -17.328 -9.111 1365 HZ PHE 694 HZ PHE 694 -11.180 -15.360 -8.897 1366 H ALA 695 H ALA 695 -17.907 -11.511 -9.404 1367 HA ALA 695 HA ALA 695 -19.285 -10.120 -10.433 1368 1HB ALA 695 1HB ALA 695 -18.422 -11.945 -12.631 1369 2HB ALA 695 3HB ALA 695 -18.309 -10.173 -12.504 1370 3HB ALA 695 2HB ALA 695 -19.854 -10.937 -12.949 No H/Q in entry = 1370 Start of MODEL 3 1 H ALA 1 H ALA 1 -11.487 34.531 -1.827 2 HA ALA 1 HA ALA 1 -9.402 32.835 -0.673 3 1HB ALA 1 2HB ALA 1 -10.562 31.173 -1.820 4 2HB ALA 1 3HB ALA 1 -11.127 32.293 -3.083 5 3HB ALA 1 1HB ALA 1 -9.435 31.741 -3.076 6 H GLU 2 H GLU 2 -7.357 32.939 -1.994 7 HA GLU 2 HA GLU 2 -7.110 35.645 -2.989 8 1HB GLU 2 1HB GLU 2 -5.494 34.012 -1.345 9 2HB GLU 2 2HB GLU 2 -4.621 34.103 -2.862 10 1HG GLU 2 1HG GLU 2 -4.891 36.627 -2.804 11 2HG GLU 2 2HG GLU 2 -5.628 36.475 -1.221 12 HE2 GLU 2 HE GLU 2 -2.677 36.803 0.209 13 H MET 3 H MET 3 -5.454 32.531 -3.874 14 HA MET 3 HA MET 3 -6.318 32.986 -6.605 15 1HB MET 3 1HB MET 3 -3.430 32.354 -5.778 16 2HB MET 3 2HB MET 3 -3.993 32.589 -7.421 17 1HG MET 3 1HG MET 3 -4.117 34.723 -5.234 18 2HG MET 3 2HG MET 3 -2.864 34.630 -6.455 19 1HE MET 3 2HE MET 3 -4.748 36.859 -5.615 20 2HE MET 3 3HE MET 3 -3.989 37.448 -7.114 21 3HE MET 3 1HE MET 3 -5.759 37.487 -6.939 22 H LYS 4 H LYS 4 -7.621 31.169 -6.772 23 HA LYS 4 HA LYS 4 -6.492 28.640 -5.840 24 1HB LYS 4 1HB LYS 4 -8.745 27.790 -5.913 25 2HB LYS 4 2HB LYS 4 -8.729 29.296 -5.018 26 1HG LYS 4 1HG LYS 4 -9.233 30.312 -7.480 27 2HG LYS 4 2HG LYS 4 -9.891 28.707 -7.731 28 1HD LYS 4 1HD LYS 4 -10.646 30.261 -5.239 29 2HD LYS 4 2HD LYS 4 -11.434 30.630 -6.759 30 1HE LYS 4 1HE LYS 4 -11.258 27.765 -5.752 31 2HE LYS 4 2HE LYS 4 -12.528 28.835 -5.195 32 H THR 5 H THR 5 -6.993 30.574 -8.670 33 HA THR 5 HA THR 5 -6.761 28.198 -10.385 34 HB THR 5 HB THR 5 -7.664 29.660 -12.131 35 HG1 THR 5 1HG THR 5 -7.989 31.961 -11.438 36 1HG2 THR 5 1HG2 THR 5 -9.017 29.881 -9.420 37 2HG2 THR 5 2HG2 THR 5 -9.661 30.796 -10.804 38 3HG2 THR 5 3HG2 THR 5 -9.574 29.020 -10.875 39 H ASP 6 H ASP 6 -4.886 30.568 -8.851 40 HA ASP 6 HA ASP 6 -3.180 31.557 -10.590 41 1HB ASP 6 1HB ASP 6 -3.103 30.782 -7.824 42 2HB ASP 6 2HB ASP 6 -1.582 30.276 -8.533 43 HD2 ASP 6 HD ASP 6 -2.142 33.259 -10.171 44 H ALA 7 H ALA 7 -1.131 30.827 -11.607 45 HA ALA 7 HA ALA 7 -1.303 28.212 -12.663 46 1HB ALA 7 3HB ALA 7 0.471 30.601 -12.888 47 2HB ALA 7 1HB ALA 7 1.186 29.035 -13.338 48 3HB ALA 7 2HB ALA 7 -0.283 29.612 -14.161 49 H ALA 8 H ALA 8 0.346 29.708 -9.895 50 HA ALA 8 HA ALA 8 2.216 27.613 -9.519 51 1HB ALA 8 1HB ALA 8 2.064 28.763 -7.094 52 2HB ALA 8 3HB ALA 8 1.240 30.026 -8.040 53 3HB ALA 8 2HB ALA 8 2.899 29.539 -8.462 54 H THR 9 H THR 9 -1.004 28.441 -8.076 55 HA THR 9 HA THR 9 -1.053 26.184 -6.373 56 HB THR 9 HB THR 9 -2.388 28.481 -6.388 57 HG1 THR 9 1HG THR 9 -3.528 25.814 -5.925 58 1HG2 THR 9 2HG2 THR 9 -4.099 26.607 -8.097 59 2HG2 THR 9 3HG2 THR 9 -4.787 27.955 -7.158 60 3HG2 THR 9 1HG2 THR 9 -3.632 28.283 -8.472 61 H LEU 10 H LEU 10 -1.830 26.687 -9.789 62 HA LEU 10 HA LEU 10 -3.342 24.268 -9.979 63 1HB LEU 10 1HB LEU 10 -2.341 26.361 -11.861 64 2HB LEU 10 2HB LEU 10 -2.837 24.810 -12.509 65 HG LEU 10 HG LEU 10 -4.568 26.667 -10.853 66 1HD1 LEU 10 3HD1 LEU 10 -3.951 27.370 -13.230 67 2HD1 LEU 10 1HD1 LEU 10 -4.930 25.985 -13.770 68 3HD1 LEU 10 2HD1 LEU 10 -5.682 27.291 -12.822 69 1HD2 LEU 10 1HD2 LEU 10 -5.137 23.969 -12.094 70 2HD2 LEU 10 2HD2 LEU 10 -5.283 24.455 -10.388 71 3HD2 LEU 10 3HD2 LEU 10 -6.412 25.109 -11.600 72 H ALA 11 H ALA 11 -0.064 25.340 -11.127 73 HA ALA 11 HA ALA 11 0.750 22.911 -12.123 74 1HB ALA 11 3HB ALA 11 2.543 24.875 -10.658 75 2HB ALA 11 1HB ALA 11 2.947 23.836 -12.046 76 3HB ALA 11 2HB ALA 11 1.850 25.222 -12.261 77 H GLN 12 H GLN 12 0.342 23.999 -8.783 78 HA GLN 12 HA GLN 12 2.026 22.075 -7.641 79 1HB GLN 12 1HB GLN 12 0.678 24.292 -6.728 80 2HB GLN 12 2HB GLN 12 -0.310 23.014 -6.048 81 1HG GLN 12 1HG GLN 12 2.709 22.876 -5.788 82 2HG GLN 12 2HG GLN 12 1.793 23.909 -4.709 83 1HE2 GLN 12 1HE2 GLN 12 2.986 22.204 -3.326 84 2HE2 GLN 12 2HE2 GLN 12 2.058 20.823 -2.848 85 H GLU 13 H GLU 13 -1.381 22.113 -8.701 86 HA GLU 13 HA GLU 13 -1.734 19.476 -7.552 87 1HB GLU 13 1HB GLU 13 -3.790 21.233 -8.959 88 2HB GLU 13 2HB GLU 13 -4.119 19.788 -8.024 89 1HG GLU 13 1HG GLU 13 -3.015 22.434 -6.983 90 2HG GLU 13 2HG GLU 13 -4.577 21.728 -6.619 91 HE2 GLU 13 HE GLU 13 -3.313 22.074 -4.364 92 H ALA 14 H ALA 14 -1.977 21.263 -10.695 93 HA ALA 14 HA ALA 14 -2.697 19.157 -12.305 94 1HB ALA 14 2HB ALA 14 -2.094 21.808 -12.627 95 2HB ALA 14 3HB ALA 14 -0.696 21.042 -13.419 96 3HB ALA 14 1HB ALA 14 -2.346 20.667 -13.970 97 H GLY 15 H GLY 15 0.536 20.111 -11.041 98 1HA GLY 15 2HA GLY 15 2.517 19.049 -11.058 99 2HA GLY 15 1HA GLY 15 2.054 18.306 -12.576 100 H ASN 16 H ASN 16 0.304 18.014 -9.436 101 HA ASN 16 HA ASN 16 1.449 15.520 -8.835 102 1HB ASN 16 1HB ASN 16 0.580 16.653 -6.945 103 2HB ASN 16 2HB ASN 16 -0.864 17.173 -7.791 104 1HD2 ASN 16 1HD2 ASN 16 -2.611 16.280 -7.036 105 2HD2 ASN 16 2HD2 ASN 16 -2.812 14.653 -6.478 106 H PHE 17 H PHE 17 -1.258 16.706 -10.778 107 HA PHE 17 HA PHE 17 -2.744 14.287 -10.781 108 1HB PHE 17 1HB PHE 17 -3.705 16.541 -11.263 109 2HB PHE 17 2HB PHE 17 -2.576 16.774 -12.582 110 HD1 PHE 17 1HD PHE 17 -3.162 16.151 -14.755 111 HD2 PHE 17 2HD PHE 17 -5.400 14.616 -11.493 112 HE1 PHE 17 1HE PHE 17 -4.834 15.184 -16.358 113 HE2 PHE 17 2HE PHE 17 -7.073 13.649 -13.096 114 HZ PHE 17 HZ PHE 17 -6.769 13.945 -15.509 115 H GLU 18 H GLU 18 -0.606 15.928 -13.225 116 HA GLU 18 HA GLU 18 -0.749 14.242 -15.248 117 1HB GLU 18 1HB GLU 18 1.497 15.828 -14.066 118 2HB GLU 18 2HB GLU 18 1.945 14.645 -15.279 119 1HG GLU 18 1HG GLU 18 1.100 15.920 -16.961 120 2HG GLU 18 2HG GLU 18 -0.434 16.112 -16.136 121 HE2 GLU 18 HE GLU 18 0.185 19.308 -15.320 122 H ARG 19 H ARG 19 0.738 13.570 -12.089 123 HA ARG 19 HA ARG 19 2.104 11.276 -12.956 124 1HB ARG 19 1HB ARG 19 2.205 12.824 -10.705 125 2HB ARG 19 2HB ARG 19 1.227 11.507 -10.089 126 1HG ARG 19 1HG ARG 19 2.933 9.912 -10.373 127 2HG ARG 19 2HG ARG 19 3.719 10.819 -11.650 128 1HD ARG 19 1HD ARG 19 3.669 12.349 -9.138 129 2HD ARG 19 2HD ARG 19 4.438 10.790 -8.915 130 HE ARG 19 HE ARG 19 5.374 12.087 -11.341 131 2HH1 ARG 19 1HH ARG 19 8.390 13.173 -10.003 132 1HH2 ARG 19 2HH2 ARG 19 5.782 12.056 -7.821 133 2HH2 ARG 19 1HH2 ARG 19 7.397 12.679 -7.878 134 H ILE 20 H ILE 20 -1.062 11.928 -11.330 135 HA ILE 20 HA ILE 20 -1.758 9.261 -10.899 136 HB ILE 20 HB ILE 20 -3.517 11.678 -11.329 137 1HG1 ILE 20 1HG1 ILE 20 -2.675 10.557 -8.662 138 2HG1 ILE 20 2HG1 ILE 20 -1.661 11.711 -9.506 139 1HG2 ILE 20 1HG2 ILE 20 -4.533 9.302 -11.469 140 2HG2 ILE 20 2HG2 ILE 20 -4.245 9.247 -9.714 141 3HG2 ILE 20 3HG2 ILE 20 -5.296 10.506 -10.404 142 1HD1 ILE 20 1HD1 ILE 20 -4.132 12.922 -9.737 143 2HD1 ILE 20 2HD1 ILE 20 -4.270 12.124 -8.152 144 3HD1 ILE 20 3HD1 ILE 20 -2.950 13.279 -8.455 145 H SER 21 H SER 21 -2.375 11.502 -13.668 146 HA SER 21 HA SER 21 -3.943 9.736 -15.093 147 1HB SER 21 1HB SER 21 -4.050 11.877 -15.963 148 2HB SER 21 2HB SER 21 -2.347 12.193 -15.696 149 HG SER 21 HG SER 21 -2.801 12.004 -17.960 150 H GLY 22 H GLY 22 -0.375 10.399 -15.227 151 1HA GLY 22 2HA GLY 22 1.345 9.154 -15.961 152 2HA GLY 22 1HA GLY 22 0.297 8.652 -17.273 153 H ASP 23 H ASP 23 0.450 8.058 -13.681 154 HA ASP 23 HA ASP 23 1.205 5.450 -13.857 155 1HB ASP 23 1HB ASP 23 0.939 7.015 -11.795 156 2HB ASP 23 2HB ASP 23 -0.738 6.509 -11.763 157 HD2 ASP 23 HD ASP 23 2.276 4.172 -10.696 158 H LEU 24 H LEU 24 -2.112 6.926 -13.637 159 HA LEU 24 HA LEU 24 -3.602 4.626 -13.528 160 1HB LEU 24 1HB LEU 24 -4.371 6.977 -13.240 161 2HB LEU 24 2HB LEU 24 -4.303 7.181 -14.980 162 HG LEU 24 HG LEU 24 -5.923 5.130 -15.041 163 1HD1 LEU 24 3HD1 LEU 24 -5.532 4.945 -12.428 164 2HD1 LEU 24 1HD1 LEU 24 -6.869 6.119 -12.387 165 3HD1 LEU 24 2HD1 LEU 24 -7.097 4.539 -13.174 166 1HD2 LEU 24 2HD2 LEU 24 -6.670 7.948 -14.251 167 2HD2 LEU 24 3HD2 LEU 24 -6.650 7.213 -15.872 168 3HD2 LEU 24 1HD2 LEU 24 -7.878 6.716 -14.683 169 H LYS 25 H LYS 25 -2.096 6.258 -16.353 170 HA LYS 25 HA LYS 25 -3.334 4.554 -18.248 171 1HB LYS 25 1HB LYS 25 -2.690 6.513 -19.227 172 2HB LYS 25 2HB LYS 25 -1.249 6.678 -18.245 173 1HG LYS 25 1HG LYS 25 0.050 5.407 -19.676 174 2HG LYS 25 2HG LYS 25 -1.265 4.325 -20.088 175 1HD LYS 25 1HD LYS 25 -0.796 5.586 -22.082 176 2HD LYS 25 2HD LYS 25 -2.297 6.230 -21.446 177 1HE LYS 25 1HE LYS 25 -1.293 8.273 -21.585 178 2HE LYS 25 2HE LYS 25 -0.418 7.807 -20.140 179 H THR 26 H THR 26 -0.280 4.505 -16.369 180 HA THR 26 HA THR 26 0.928 2.395 -17.770 181 HB THR 26 HB THR 26 1.209 3.810 -15.127 182 HG1 THR 26 1HG THR 26 2.923 2.863 -17.317 183 1HG2 THR 26 3HG2 THR 26 2.142 0.999 -15.699 184 2HG2 THR 26 1HG2 THR 26 3.323 2.121 -14.981 185 3HG2 THR 26 2HG2 THR 26 1.796 1.774 -14.134 186 H GLN 27 H GLN 27 -1.435 2.455 -15.071 187 HA GLN 27 HA GLN 27 -1.223 -0.300 -14.599 188 1HB GLN 27 1HB GLN 27 -3.527 1.597 -13.966 189 2HB GLN 27 2HB GLN 27 -3.281 0.017 -13.249 190 1HG GLN 27 1HG GLN 27 -1.130 2.162 -13.088 191 2HG GLN 27 2HG GLN 27 -2.445 2.114 -11.931 192 1HE2 GLN 27 1HE2 GLN 27 0.545 1.576 -11.873 193 2HE2 GLN 27 2HE2 GLN 27 0.721 0.067 -11.041 194 H ILE 28 H ILE 28 -3.523 1.753 -16.499 195 HA ILE 28 HA ILE 28 -5.229 -0.297 -17.270 196 HB ILE 28 HB ILE 28 -4.617 2.461 -18.105 197 1HG1 ILE 28 1HG1 ILE 28 -7.376 1.408 -18.137 198 2HG1 ILE 28 2HG1 ILE 28 -6.549 1.231 -16.603 199 1HG2 ILE 28 1HG2 ILE 28 -5.895 0.488 -20.011 200 2HG2 ILE 28 2HG2 ILE 28 -6.076 2.254 -20.136 201 3HG2 ILE 28 3HG2 ILE 28 -4.465 1.511 -20.287 202 1HD1 ILE 28 1HD1 ILE 28 -5.966 3.861 -17.675 203 2HD1 ILE 28 2HD1 ILE 28 -7.726 3.594 -17.682 204 3HD1 ILE 28 3HD1 ILE 28 -6.807 3.435 -16.165 205 H ASP 29 H ASP 29 -2.263 1.034 -18.870 206 HA ASP 29 HA ASP 29 -2.390 -0.561 -21.093 207 1HB ASP 29 1HB ASP 29 -0.734 1.396 -20.261 208 2HB ASP 29 2HB ASP 29 0.282 0.037 -19.825 209 HD2 ASP 29 HD ASP 29 1.252 -1.014 -21.382 210 H GLN 30 H GLN 30 -1.063 -1.106 -17.789 211 HA GLN 30 HA GLN 30 0.352 -3.409 -18.317 212 1HB GLN 30 1HB GLN 30 -0.831 -2.100 -15.903 213 2HB GLN 30 2HB GLN 30 -0.443 -3.801 -15.734 214 1HG GLN 30 1HG GLN 30 1.855 -3.460 -16.044 215 2HG GLN 30 2HG GLN 30 1.624 -2.022 -17.019 216 1HE2 GLN 30 1HE2 GLN 30 3.321 -1.210 -15.597 217 2HE2 GLN 30 2HE2 GLN 30 2.898 -0.477 -14.086 218 H VAL 31 H VAL 31 -3.104 -2.915 -17.373 219 HA VAL 31 HA VAL 31 -3.691 -5.669 -17.215 220 HB VAL 31 HB VAL 31 -5.304 -3.141 -17.460 221 1HG1 VAL 31 2HG1 VAL 31 -6.185 -5.810 -18.131 222 2HG1 VAL 31 3HG1 VAL 31 -7.040 -5.226 -16.683 223 3HG1 VAL 31 1HG1 VAL 31 -7.083 -4.274 -18.187 224 1HG2 VAL 31 2HG2 VAL 31 -4.034 -4.119 -15.320 225 2HG2 VAL 31 3HG2 VAL 31 -5.603 -3.286 -15.198 226 3HG2 VAL 31 1HG2 VAL 31 -5.537 -5.064 -15.188 227 H GLU 32 H GLU 32 -4.307 -3.160 -19.770 228 HA GLU 32 HA GLU 32 -5.531 -4.739 -21.576 229 1HB GLU 32 1HB GLU 32 -3.736 -2.337 -21.775 230 2HB GLU 32 2HB GLU 32 -4.127 -3.172 -23.265 231 1HG GLU 32 1HG GLU 32 -6.611 -3.052 -22.470 232 2HG GLU 32 2HG GLU 32 -6.051 -1.886 -21.288 233 HE2 GLU 32 HE GLU 32 -7.537 -1.242 -24.231 234 H SER 33 H SER 33 -2.036 -4.544 -20.808 235 HA SER 33 HA SER 33 -1.335 -6.198 -23.011 236 1HB SER 33 1HB SER 33 0.021 -4.449 -21.281 237 2HB SER 33 2HB SER 33 0.639 -6.027 -20.835 238 HG SER 33 HG SER 33 1.020 -6.375 -23.200 239 H THR 34 H THR 34 -1.378 -6.550 -19.389 240 HA THR 34 HA THR 34 -0.630 -9.208 -19.272 241 HB THR 34 HB THR 34 -2.092 -7.217 -17.559 242 HG1 THR 34 1HG THR 34 -0.252 -7.868 -16.264 243 1HG2 THR 34 3HG2 THR 34 -3.366 -9.461 -17.316 244 2HG2 THR 34 1HG2 THR 34 -1.828 -10.149 -16.741 245 3HG2 THR 34 2HG2 THR 34 -2.609 -8.832 -15.833 246 H ALA 35 H ALA 35 -3.891 -7.775 -19.798 247 HA ALA 35 HA ALA 35 -5.377 -10.072 -19.573 248 1HB ALA 35 1HB ALA 35 -5.968 -8.078 -21.747 249 2HB ALA 35 3HB ALA 35 -5.957 -7.528 -20.054 250 3HB ALA 35 2HB ALA 35 -7.066 -8.825 -20.561 251 H GLY 36 H GLY 36 -2.980 -9.171 -21.969 252 1HA GLY 36 2HA GLY 36 -2.129 -10.299 -23.718 253 2HA GLY 36 1HA GLY 36 -3.791 -10.544 -24.217 254 H SER 37 H SER 37 -1.881 -11.778 -21.378 255 HA SER 37 HA SER 37 -1.635 -14.343 -22.412 256 1HB SER 37 1HB SER 37 -1.686 -13.665 -19.448 257 2HB SER 37 2HB SER 37 -0.790 -14.946 -20.241 258 HG SER 37 HG SER 37 0.316 -12.778 -19.603 259 H LEU 38 H LEU 38 -4.239 -12.651 -20.735 260 HA LEU 38 HA LEU 38 -5.577 -15.000 -19.840 261 1HB LEU 38 1HB LEU 38 -6.199 -12.077 -19.996 262 2HB LEU 38 2HB LEU 38 -7.498 -13.217 -19.707 263 HG LEU 38 HG LEU 38 -6.936 -12.664 -17.560 264 1HD1 LEU 38 1HD1 LEU 38 -6.533 -15.180 -18.132 265 2HD1 LEU 38 2HD1 LEU 38 -4.833 -14.793 -17.771 266 3HD1 LEU 38 3HD1 LEU 38 -6.085 -14.544 -16.531 267 1HD2 LEU 38 1HD2 LEU 38 -4.212 -12.172 -18.669 268 2HD2 LEU 38 2HD2 LEU 38 -5.231 -11.155 -17.622 269 3HD2 LEU 38 3HD2 LEU 38 -4.356 -12.545 -16.935 270 H GLN 39 H GLN 39 -6.589 -12.524 -22.303 271 HA GLN 39 HA GLN 39 -8.512 -14.058 -23.443 272 1HB GLN 39 1HB GLN 39 -7.959 -12.615 -25.557 273 2HB GLN 39 2HB GLN 39 -8.499 -11.807 -24.099 274 1HG GLN 39 1HG GLN 39 -5.639 -12.104 -23.910 275 2HG GLN 39 2HG GLN 39 -5.996 -11.483 -25.509 276 1HE2 GLN 39 1HE2 GLN 39 -7.761 -11.052 -22.462 277 2HE2 GLN 39 2HE2 GLN 39 -7.614 -9.330 -22.357 278 H GLY 40 H GLY 40 -5.000 -14.272 -23.773 279 1HA GLY 40 2HA GLY 40 -3.673 -15.505 -25.144 280 2HA GLY 40 1HA GLY 40 -5.041 -15.839 -26.186 281 H GLN 41 H GLN 41 -6.202 -16.527 -23.144 282 HA GLN 41 HA GLN 41 -5.903 -19.319 -23.615 283 1HB GLN 41 1HB GLN 41 -3.961 -19.391 -22.369 284 2HB GLN 41 2HB GLN 41 -4.340 -17.931 -21.478 285 1HG GLN 41 1HG GLN 41 -5.929 -20.488 -21.040 286 2HG GLN 41 2HG GLN 41 -4.414 -20.213 -20.203 287 1HE2 GLN 41 1HE2 GLN 41 -7.005 -20.489 -19.051 288 2HE2 GLN 41 2HE2 GLN 41 -7.394 -19.030 -18.203 289 H TRP 42 H TRP 42 -7.917 -20.135 -23.249 290 HA TRP 42 HA TRP 42 -9.316 -19.566 -20.849 291 1HB TRP 42 1HB TRP 42 -10.269 -18.237 -23.385 292 2HB TRP 42 2HB TRP 42 -11.335 -18.589 -22.039 293 HD1 TRP 42 HD TRP 42 -9.260 -15.835 -23.276 294 HE1 TRP 42 1HE TRP 42 -8.734 -13.985 -21.470 295 HE3 TRP 42 3HE TRP 42 -10.670 -18.612 -19.257 296 HZ2 TRP 42 2HZ TRP 42 -8.962 -13.892 -18.626 297 HZ3 TRP 42 3HZ TRP 42 -10.487 -17.567 -17.001 298 HH2 TRP 42 HH TRP 42 -9.668 -15.291 -16.650 299 H ARG 43 H ARG 43 -11.027 -21.111 -20.578 300 HA ARG 43 HA ARG 43 -10.809 -23.264 -22.466 301 1HB ARG 43 1HB ARG 43 -12.061 -22.984 -19.700 302 2HB ARG 43 2HB ARG 43 -12.329 -24.416 -20.673 303 1HG ARG 43 1HG ARG 43 -9.516 -23.392 -20.128 304 2HG ARG 43 2HG ARG 43 -10.338 -24.432 -18.982 305 1HD ARG 43 1HD ARG 43 -10.678 -26.137 -20.811 306 2HD ARG 43 2HD ARG 43 -9.788 -25.106 -21.914 307 HE ARG 43 HE ARG 43 -7.798 -25.821 -20.923 308 2HH1 ARG 43 1HH ARG 43 -7.130 -27.589 -18.008 309 1HH2 ARG 43 2HH2 ARG 43 -10.463 -26.470 -18.680 310 2HH2 ARG 43 1HH2 ARG 43 -9.467 -27.322 -17.548 311 H GLY 44 H GLY 44 -13.694 -22.248 -20.528 312 1HA GLY 44 2HA GLY 44 -15.763 -22.966 -21.901 313 2HA GLY 44 1HA GLY 44 -15.180 -21.745 -23.015 314 H ALA 45 H ALA 45 -16.565 -20.021 -22.817 315 HA ALA 45 HA ALA 45 -17.845 -18.462 -21.879 316 1HB ALA 45 3HB ALA 45 -17.507 -19.358 -19.063 317 2HB ALA 45 2HB ALA 45 -18.227 -20.549 -20.172 318 3HB ALA 45 1HB ALA 45 -18.987 -18.953 -19.966 319 H ALA 46 H ALA 46 -15.191 -19.346 -19.551 320 HA ALA 46 HA ALA 46 -14.663 -16.810 -18.652 321 1HB ALA 46 1HB ALA 46 -12.520 -17.718 -17.965 322 2HB ALA 46 2HB ALA 46 -13.754 -18.987 -17.784 323 3HB ALA 46 3HB ALA 46 -12.638 -19.022 -19.170 324 H GLY 47 H GLY 47 -13.967 -18.305 -21.778 325 1HA GLY 47 2HA GLY 47 -12.949 -17.540 -23.632 326 2HA GLY 47 1HA GLY 47 -11.883 -16.596 -22.611 327 H THR 48 H THR 48 -15.301 -16.632 -23.840 328 HA THR 48 HA THR 48 -15.127 -14.052 -24.914 329 HB THR 48 HB THR 48 -17.761 -15.252 -24.052 330 HG1 THR 48 1HG THR 48 -15.890 -16.264 -26.077 331 1HG2 THR 48 1HG2 THR 48 -16.603 -13.739 -26.364 332 2HG2 THR 48 2HG2 THR 48 -17.758 -15.024 -26.792 333 3HG2 THR 48 3HG2 THR 48 -18.257 -13.705 -25.707 334 H ALA 49 H ALA 49 -16.009 -15.230 -21.669 335 HA ALA 49 HA ALA 49 -17.284 -12.954 -20.746 336 1HB ALA 49 3HB ALA 49 -15.524 -15.005 -19.346 337 2HB ALA 49 1HB ALA 49 -16.527 -13.803 -18.498 338 3HB ALA 49 2HB ALA 49 -17.296 -15.043 -19.519 339 H ALA 50 H ALA 50 -13.767 -13.843 -20.711 340 HA ALA 50 HA ALA 50 -13.059 -11.292 -19.615 341 1HB ALA 50 2HB ALA 50 -11.377 -12.650 -18.977 342 2HB ALA 50 3HB ALA 50 -11.813 -13.878 -20.190 343 3HB ALA 50 1HB ALA 50 -10.763 -12.513 -20.642 344 H GLN 51 H GLN 51 -12.344 -12.980 -22.762 345 HA GLN 51 HA GLN 51 -11.167 -11.007 -24.078 346 1HB GLN 51 1HB GLN 51 -11.450 -12.387 -25.854 347 2HB GLN 51 2HB GLN 51 -12.339 -13.430 -24.763 348 1HG GLN 51 1HG GLN 51 -13.814 -13.096 -26.609 349 2HG GLN 51 2HG GLN 51 -14.438 -12.047 -25.351 350 1HE2 GLN 51 1HE2 GLN 51 -15.267 -10.366 -26.353 351 2HE2 GLN 51 2HE2 GLN 51 -14.473 -9.351 -27.511 352 H ALA 52 H ALA 52 -14.672 -11.262 -23.362 353 HA ALA 52 HA ALA 52 -15.351 -9.005 -24.978 354 1HB ALA 52 2HB ALA 52 -16.886 -10.912 -24.468 355 2HB ALA 52 1HB ALA 52 -17.571 -9.330 -24.021 356 3HB ALA 52 3HB ALA 52 -16.906 -10.400 -22.763 357 H ALA 53 H ALA 53 -14.778 -9.666 -21.471 358 HA ALA 53 HA ALA 53 -15.438 -7.077 -20.610 359 1HB ALA 53 3HB ALA 53 -13.530 -9.093 -19.360 360 2HB ALA 53 2HB ALA 53 -15.302 -9.147 -19.200 361 3HB ALA 53 1HB ALA 53 -14.389 -7.773 -18.530 362 H VAL 54 H VAL 54 -12.599 -8.483 -22.172 363 HA VAL 54 HA VAL 54 -10.833 -6.385 -21.365 364 HB VAL 54 HB VAL 54 -10.477 -8.270 -23.686 365 1HG1 VAL 54 3HG1 VAL 54 -8.870 -6.281 -22.844 366 2HG1 VAL 54 1HG1 VAL 54 -8.289 -7.589 -21.785 367 3HG1 VAL 54 2HG1 VAL 54 -8.256 -7.794 -23.553 368 1HG2 VAL 54 1HG2 VAL 54 -10.977 -9.014 -20.961 369 2HG2 VAL 54 2HG2 VAL 54 -10.583 -10.053 -22.353 370 3HG2 VAL 54 3HG2 VAL 54 -9.277 -9.372 -21.353 371 H VAL 55 H VAL 55 -12.889 -7.165 -24.213 372 HA VAL 55 HA VAL 55 -11.932 -5.116 -25.853 373 HB VAL 55 HB VAL 55 -14.479 -6.707 -25.693 374 1HG1 VAL 55 2HG1 VAL 55 -14.136 -4.169 -27.033 375 2HG1 VAL 55 3HG1 VAL 55 -14.380 -5.467 -28.226 376 3HG1 VAL 55 1HG1 VAL 55 -15.576 -5.211 -26.932 377 1HG2 VAL 55 3HG2 VAL 55 -11.888 -6.960 -27.005 378 2HG2 VAL 55 1HG2 VAL 55 -13.173 -8.169 -26.770 379 3HG2 VAL 55 2HG2 VAL 55 -13.235 -7.065 -28.165 380 H ARG 56 H ARG 56 -14.846 -5.256 -23.683 381 HA ARG 56 HA ARG 56 -15.659 -2.696 -24.143 382 1HB ARG 56 1HB ARG 56 -17.084 -4.247 -22.934 383 2HB ARG 56 2HB ARG 56 -15.885 -4.481 -21.678 384 1HG ARG 56 1HG ARG 56 -16.439 -2.528 -20.585 385 2HG ARG 56 2HG ARG 56 -16.716 -1.646 -22.074 386 1HD ARG 56 1HD ARG 56 -18.665 -3.839 -21.364 387 2HD ARG 56 2HD ARG 56 -18.747 -2.347 -20.447 388 HE ARG 56 HE ARG 56 -18.690 -1.372 -22.987 389 2HH1 ARG 56 1HH ARG 56 -21.824 -2.053 -24.321 390 1HH2 ARG 56 2HH2 ARG 56 -20.606 -3.995 -21.573 391 2HH2 ARG 56 1HH2 ARG 56 -21.938 -3.774 -22.657 392 H PHE 57 H PHE 57 -13.473 -3.988 -21.541 393 HA PHE 57 HA PHE 57 -13.030 -1.572 -20.258 394 1HB PHE 57 1HB PHE 57 -12.254 -3.500 -19.120 395 2HB PHE 57 2HB PHE 57 -11.726 -4.274 -20.600 396 HD1 PHE 57 1HD PHE 57 -9.463 -4.280 -21.183 397 HD2 PHE 57 2HD PHE 57 -10.831 -1.545 -18.241 398 HE1 PHE 57 1HE PHE 57 -7.090 -3.650 -20.666 399 HE2 PHE 57 2HE PHE 57 -8.457 -0.914 -17.724 400 HZ PHE 57 HZ PHE 57 -6.615 -1.975 -18.942 401 H GLN 58 H GLN 58 -11.220 -3.180 -22.953 402 HA GLN 58 HA GLN 58 -9.160 -1.378 -23.074 403 1HB GLN 58 1HB GLN 58 -10.489 -3.094 -25.204 404 2HB GLN 58 2HB GLN 58 -9.071 -2.125 -25.554 405 1HG GLN 58 1HG GLN 58 -8.703 -3.651 -23.076 406 2HG GLN 58 2HG GLN 58 -9.120 -4.714 -24.405 407 1HE2 GLN 58 1HE2 GLN 58 -6.940 -5.506 -24.034 408 2HE2 GLN 58 2HE2 GLN 58 -5.596 -4.739 -24.814 409 H GLU 59 H GLU 59 -12.203 -1.433 -25.075 410 HA GLU 59 HA GLU 59 -11.735 0.883 -26.425 411 1HB GLU 59 1HB GLU 59 -14.337 -0.404 -25.510 412 2HB GLU 59 2HB GLU 59 -14.308 0.992 -26.569 413 1HG GLU 59 1HG GLU 59 -12.574 -1.359 -27.313 414 2HG GLU 59 2HG GLU 59 -14.305 -1.528 -27.529 415 HE2 GLU 59 HE GLU 59 -14.746 -1.082 -29.520 416 H ALA 60 H ALA 60 -12.725 0.385 -23.067 417 HA ALA 60 HA ALA 60 -13.588 3.116 -22.738 418 1HB ALA 60 2HB ALA 60 -13.281 0.694 -20.941 419 2HB ALA 60 1HB ALA 60 -14.772 1.531 -21.438 420 3HB ALA 60 3HB ALA 60 -13.659 2.304 -20.284 421 H ALA 61 H ALA 61 -10.651 1.175 -22.470 422 HA ALA 61 HA ALA 61 -9.231 2.695 -20.643 423 1HB ALA 61 3HB ALA 61 -8.764 0.428 -21.979 424 2HB ALA 61 1HB ALA 61 -7.857 1.530 -23.043 425 3HB ALA 61 2HB ALA 61 -7.435 1.411 -21.317 426 H ASN 62 H ASN 62 -9.121 2.896 -24.277 427 HA ASN 62 HA ASN 62 -7.545 5.074 -24.448 428 1HB ASN 62 1HB ASN 62 -9.323 5.511 -26.532 429 2HB ASN 62 2HB ASN 62 -7.992 4.373 -26.594 430 1HD2 ASN 62 1HD2 ASN 62 -8.399 2.171 -25.816 431 2HD2 ASN 62 2HD2 ASN 62 -9.942 1.439 -26.105 432 H LYS 63 H LYS 63 -11.194 4.971 -24.416 433 HA LYS 63 HA LYS 63 -11.698 7.650 -24.505 434 1HB LYS 63 1HB LYS 63 -13.195 5.474 -23.016 435 2HB LYS 63 2HB LYS 63 -13.830 7.074 -23.340 436 1HG LYS 63 1HG LYS 63 -13.482 6.678 -25.810 437 2HG LYS 63 2HG LYS 63 -12.936 5.052 -25.449 438 1HD LYS 63 1HD LYS 63 -15.306 4.980 -26.067 439 2HD LYS 63 2HD LYS 63 -15.144 4.550 -24.376 440 1HE LYS 63 1HE LYS 63 -16.462 6.289 -23.748 441 2HE LYS 63 2HE LYS 63 -15.429 7.433 -24.581 442 H GLN 64 H GLN 64 -10.562 5.655 -21.770 443 HA GLN 64 HA GLN 64 -10.993 7.728 -19.889 444 1HB GLN 64 1HB GLN 64 -10.392 4.964 -19.813 445 2HB GLN 64 2HB GLN 64 -9.002 5.742 -19.082 446 1HG GLN 64 1HG GLN 64 -11.905 6.256 -18.277 447 2HG GLN 64 2HG GLN 64 -10.804 5.199 -17.416 448 1HE2 GLN 64 1HE2 GLN 64 -9.650 6.009 -15.836 449 2HE2 GLN 64 2HE2 GLN 64 -9.331 7.683 -15.526 450 H LYS 65 H LYS 65 -8.259 6.531 -21.884 451 HA LYS 65 HA LYS 65 -6.304 8.127 -20.611 452 1HB LYS 65 1HB LYS 65 -6.486 6.361 -22.987 453 2HB LYS 65 2HB LYS 65 -5.264 7.614 -23.069 454 1HG LYS 65 1HG LYS 65 -4.175 5.752 -22.035 455 2HG LYS 65 2HG LYS 65 -4.502 6.871 -20.726 456 1HD LYS 65 1HD LYS 65 -6.606 4.806 -21.353 457 2HD LYS 65 2HD LYS 65 -5.142 4.257 -20.562 458 1HE LYS 65 1HE LYS 65 -6.852 6.575 -19.542 459 2HE LYS 65 2HE LYS 65 -7.008 4.926 -18.969 460 H GLN 66 H GLN 66 -8.494 8.558 -23.431 461 HA GLN 66 HA GLN 66 -7.333 10.895 -24.343 462 1HB GLN 66 1HB GLN 66 -9.473 9.253 -25.079 463 2HB GLN 66 2HB GLN 66 -10.262 10.765 -24.678 464 1HG GLN 66 1HG GLN 66 -7.896 10.487 -26.592 465 2HG GLN 66 2HG GLN 66 -9.570 10.647 -27.087 466 1HE2 GLN 66 1HE2 GLN 66 -7.107 12.330 -27.418 467 2HE2 GLN 66 2HE2 GLN 66 -7.551 13.927 -26.914 468 H GLU 67 H GLU 67 -10.172 10.378 -22.133 469 HA GLU 67 HA GLU 67 -10.495 13.125 -21.677 470 1HB GLU 67 1HB GLU 67 -12.449 11.971 -21.225 471 2HB GLU 67 2HB GLU 67 -11.612 10.578 -20.569 472 1HG GLU 67 1HG GLU 67 -12.635 11.578 -18.670 473 2HG GLU 67 2HG GLU 67 -10.962 12.091 -18.567 474 HE2 GLU 67 HE GLU 67 -11.961 15.344 -19.921 475 H LEU 68 H LEU 68 -8.471 10.588 -20.266 476 HA LEU 68 HA LEU 68 -7.931 12.003 -17.853 477 1HB LEU 68 1HB LEU 68 -7.810 9.618 -17.893 478 2HB LEU 68 2HB LEU 68 -6.657 9.632 -19.212 479 HG LEU 68 HG LEU 68 -5.152 10.969 -17.518 480 1HD1 LEU 68 2HD1 LEU 68 -7.420 10.252 -15.875 481 2HD1 LEU 68 3HD1 LEU 68 -5.924 9.522 -15.245 482 3HD1 LEU 68 1HD1 LEU 68 -6.017 11.281 -15.498 483 1HD2 LEU 68 1HD2 LEU 68 -5.350 8.291 -18.328 484 2HD2 LEU 68 2HD2 LEU 68 -3.942 9.111 -17.610 485 3HD2 LEU 68 3HD2 LEU 68 -5.093 8.242 -16.567 486 H ASP 69 H ASP 69 -6.549 11.833 -21.138 487 HA ASP 69 HA ASP 69 -4.204 13.227 -20.372 488 1HB ASP 69 1HB ASP 69 -5.205 11.840 -22.680 489 2HB ASP 69 2HB ASP 69 -4.806 13.464 -23.204 490 HD2 ASP 69 HD ASP 69 -3.222 12.741 -24.374 491 H GLU 70 H GLU 70 -7.213 13.949 -22.295 492 HA GLU 70 HA GLU 70 -6.711 16.510 -22.962 493 1HB GLU 70 1HB GLU 70 -9.007 16.697 -23.422 494 2HB GLU 70 2HB GLU 70 -8.756 14.963 -23.460 495 1HG GLU 70 1HG GLU 70 -9.553 14.771 -21.113 496 2HG GLU 70 2HG GLU 70 -9.744 16.511 -21.017 497 HE2 GLU 70 HE GLU 70 -13.010 15.925 -21.959 498 H ILE 71 H ILE 71 -8.060 15.264 -19.849 499 HA ILE 71 HA ILE 71 -8.498 17.805 -18.731 500 HB ILE 71 HB ILE 71 -8.257 15.015 -17.654 501 1HG1 ILE 71 1HG1 ILE 71 -10.578 16.963 -17.654 502 2HG1 ILE 71 2HG1 ILE 71 -10.290 15.790 -18.924 503 1HG2 ILE 71 2HG2 ILE 71 -7.831 17.456 -16.159 504 2HG2 ILE 71 3HG2 ILE 71 -9.287 16.604 -15.593 505 3HG2 ILE 71 1HG2 ILE 71 -7.721 15.760 -15.633 506 1HD1 ILE 71 2HD1 ILE 71 -10.392 14.892 -16.029 507 2HD1 ILE 71 3HD1 ILE 71 -11.892 15.140 -16.955 508 3HD1 ILE 71 1HD1 ILE 71 -10.695 13.942 -17.503 509 H SER 72 H SER 72 -5.678 15.605 -18.889 510 HA SER 72 HA SER 72 -4.182 16.984 -16.980 511 1HB SER 72 1HB SER 72 -3.064 15.040 -17.306 512 2HB SER 72 2HB SER 72 -3.808 14.787 -18.872 513 HG SER 72 HG SER 72 -2.204 16.071 -19.864 514 H THR 73 H THR 73 -4.925 17.534 -20.388 515 HA THR 73 HA THR 73 -2.756 19.463 -20.666 516 HB THR 73 HB THR 73 -4.710 18.015 -22.465 517 HG1 THR 73 1HG THR 73 -1.897 18.854 -22.561 518 1HG2 THR 73 3HG2 THR 73 -3.660 20.790 -22.873 519 2HG2 THR 73 1HG2 THR 73 -3.351 19.654 -24.208 520 3HG2 THR 73 2HG2 THR 73 -5.020 19.969 -23.674 521 H ASN 74 H ASN 74 -6.195 19.294 -19.936 522 HA ASN 74 HA ASN 74 -7.051 21.704 -20.783 523 1HB ASN 74 1HB ASN 74 -7.746 19.823 -18.597 524 2HB ASN 74 2HB ASN 74 -8.195 21.475 -18.223 525 1HD2 ASN 74 1HD2 ASN 74 -8.631 18.766 -20.368 526 2HD2 ASN 74 2HD2 ASN 74 -10.073 19.301 -21.163 527 H ILE 75 H ILE 75 -5.217 20.841 -17.780 528 HA ILE 75 HA ILE 75 -5.291 23.323 -16.550 529 HB ILE 75 HB ILE 75 -2.974 21.409 -16.409 530 1HG1 ILE 75 1HG1 ILE 75 -4.844 19.954 -16.299 531 2HG1 ILE 75 2HG1 ILE 75 -4.305 20.205 -14.650 532 1HG2 ILE 75 3HG2 ILE 75 -3.977 23.670 -14.825 533 2HG2 ILE 75 1HG2 ILE 75 -3.602 22.217 -13.868 534 3HG2 ILE 75 2HG2 ILE 75 -2.353 22.946 -14.906 535 1HD1 ILE 75 3HD1 ILE 75 -6.606 21.706 -15.985 536 2HD1 ILE 75 1HD1 ILE 75 -6.780 20.361 -14.833 537 3HD1 ILE 75 2HD1 ILE 75 -6.076 21.905 -14.298 538 H ARG 76 H ARG 76 -2.884 21.933 -18.876 539 HA ARG 76 HA ARG 76 -1.143 23.996 -18.877 540 1HB ARG 76 1HB ARG 76 -2.049 22.072 -21.047 541 2HB ARG 76 2HB ARG 76 -0.851 23.294 -21.420 542 1HG ARG 76 1HG ARG 76 0.290 21.230 -20.751 543 2HG ARG 76 2HG ARG 76 0.581 22.464 -19.541 544 1HD ARG 76 1HD ARG 76 -1.049 21.500 -18.024 545 2HD ARG 76 2HD ARG 76 -1.692 20.449 -19.270 546 HE ARG 76 HE ARG 76 0.627 19.928 -17.627 547 2HH1 ARG 76 1HH ARG 76 1.783 17.201 -19.442 548 1HH2 ARG 76 2HH2 ARG 76 -0.637 19.401 -20.895 549 2HH2 ARG 76 1HH2 ARG 76 0.311 17.977 -21.167 550 H GLN 77 H GLN 77 -4.202 23.608 -20.766 551 HA GLN 77 HA GLN 77 -3.831 26.004 -22.196 552 1HB GLN 77 1HB GLN 77 -6.360 24.372 -21.694 553 2HB GLN 77 2HB GLN 77 -6.210 25.649 -22.885 554 1HG GLN 77 1HG GLN 77 -3.993 23.875 -23.299 555 2HG GLN 77 2HG GLN 77 -5.413 22.867 -23.102 556 1HE2 GLN 77 1HE2 GLN 77 -3.786 25.225 -25.028 557 2HE2 GLN 77 2HE2 GLN 77 -4.840 25.220 -26.402 558 H ALA 78 H ALA 78 -4.998 25.187 -18.996 559 HA ALA 78 HA ALA 78 -6.737 27.349 -18.595 560 1HB ALA 78 3HB ALA 78 -5.862 25.100 -17.194 561 2HB ALA 78 2HB ALA 78 -6.986 26.342 -16.591 562 3HB ALA 78 1HB ALA 78 -5.247 26.464 -16.229 563 H GLY 79 H GLY 79 -3.243 27.075 -18.809 564 1HA GLY 79 2HA GLY 79 -3.025 29.901 -17.962 565 2HA GLY 79 1HA GLY 79 -2.092 29.161 -19.247 566 H VAL 80 H VAL 80 -2.043 26.580 -17.419 567 HA VAL 80 HA VAL 80 0.136 27.556 -15.703 568 HB VAL 80 HB VAL 80 -1.351 26.912 -14.123 569 1HG1 VAL 80 1HG1 VAL 80 -3.105 26.333 -15.828 570 2HG1 VAL 80 2HG1 VAL 80 -2.442 24.682 -15.867 571 3HG1 VAL 80 3HG1 VAL 80 -3.138 25.327 -14.361 572 1HG2 VAL 80 2HG2 VAL 80 0.702 25.324 -14.217 573 2HG2 VAL 80 3HG2 VAL 80 -0.666 24.896 -13.161 574 3HG2 VAL 80 1HG2 VAL 80 -0.473 24.093 -14.738 575 H GLN 81 H GLN 81 1.807 27.199 -17.198 576 HA GLN 81 HA GLN 81 2.278 24.378 -17.680 577 1HB GLN 81 1HB GLN 81 3.181 25.073 -20.004 578 2HB GLN 81 2HB GLN 81 1.442 24.981 -19.809 579 1HG GLN 81 1HG GLN 81 1.241 27.162 -20.386 580 2HG GLN 81 2HG GLN 81 2.242 27.631 -19.027 581 1HE2 GLN 81 1HE2 GLN 81 2.262 26.564 -22.382 582 2HE2 GLN 81 2HE2 GLN 81 3.783 27.254 -22.842 583 H TYR 82 H TYR 82 3.239 26.975 -16.058 584 HA TYR 82 HA TYR 82 6.046 26.238 -16.265 585 1HB TYR 82 1HB TYR 82 6.679 28.584 -16.597 586 2HB TYR 82 2HB TYR 82 5.428 28.261 -17.781 587 HD1 TYR 82 1HD TYR 82 6.514 30.558 -15.395 588 HD2 TYR 82 2HD TYR 82 2.929 28.719 -16.833 589 HE1 TYR 82 1HE TYR 82 5.146 32.500 -14.489 590 HE2 TYR 82 2HE TYR 82 1.573 30.667 -15.923 591 HH TYR 82 HH TYR 82 2.328 33.311 -15.432 592 H SER 83 H SER 83 6.627 25.701 -14.224 593 HA SER 83 HA SER 83 5.826 27.518 -12.128 594 1HB SER 83 1HB SER 83 4.154 25.596 -12.233 595 2HB SER 83 2HB SER 83 5.469 24.504 -11.846 596 HG SER 83 HG SER 83 5.584 26.494 -10.033 597 H ARG 84 H ARG 84 7.466 24.313 -12.708 598 HA ARG 84 HA ARG 84 9.509 25.098 -10.860 599 1HB ARG 84 1HB ARG 84 8.397 22.631 -11.737 600 2HB ARG 84 2HB ARG 84 10.044 22.618 -12.337 601 1HG ARG 84 1HG ARG 84 10.759 23.347 -9.950 602 2HG ARG 84 2HG ARG 84 9.124 22.957 -9.452 603 1HD ARG 84 1HD ARG 84 10.164 20.766 -11.056 604 2HD ARG 84 2HD ARG 84 11.328 21.155 -9.804 605 HE ARG 84 HE ARG 84 8.527 20.965 -8.890 606 2HH1 ARG 84 1HH ARG 84 9.133 18.116 -6.999 607 1HH2 ARG 84 2HH2 ARG 84 11.619 19.283 -9.294 608 2HH2 ARG 84 1HH2 ARG 84 11.246 18.058 -8.129 609 H ALA 85 H ALA 85 9.020 26.329 -13.686 610 HA ALA 85 HA ALA 85 11.322 25.531 -15.191 611 1HB ALA 85 1HB ALA 85 9.075 26.382 -16.082 612 2HB ALA 85 3HB ALA 85 10.534 27.111 -16.794 613 3HB ALA 85 2HB ALA 85 9.601 28.003 -15.570 614 H ASP 86 H ASP 86 12.493 25.955 -12.875 615 HA ASP 86 HA ASP 86 13.588 28.643 -13.147 616 1HB ASP 86 1HB ASP 86 12.133 28.065 -11.032 617 2HB ASP 86 2HB ASP 86 13.511 27.108 -10.525 618 HD2 ASP 86 HD ASP 86 12.835 28.971 -8.948 619 H GLU 87 H GLU 87 14.025 25.215 -12.053 620 HA GLU 87 HA GLU 87 16.893 25.580 -12.174 621 1HB GLU 87 1HB GLU 87 15.119 23.359 -11.090 622 2HB GLU 87 2HB GLU 87 16.856 23.173 -11.234 623 1HG GLU 87 1HG GLU 87 16.415 25.713 -9.983 624 2HG GLU 87 2HG GLU 87 15.342 24.577 -9.189 625 HE2 GLU 87 HE GLU 87 18.840 25.055 -8.208 626 H GLU 88 H GLU 88 14.682 25.230 -14.454 627 HA GLU 88 HA GLU 88 14.845 22.944 -15.759 628 1HB GLU 88 1HB GLU 88 14.042 25.488 -16.402 629 2HB GLU 88 2HB GLU 88 15.391 25.300 -17.505 630 1HG GLU 88 1HG GLU 88 13.539 22.956 -17.333 631 2HG GLU 88 2HG GLU 88 12.850 24.408 -18.032 632 HE2 GLU 88 HE GLU 88 14.377 22.061 -20.230 633 H GLN 89 H GLN 89 17.425 25.470 -15.689 634 HA GLN 89 HA GLN 89 19.093 24.408 -17.550 635 1HB GLN 89 1HB GLN 89 19.214 26.564 -15.973 636 2HB GLN 89 2HB GLN 89 20.261 25.540 -15.010 637 1HG GLN 89 1HG GLN 89 21.236 25.090 -17.575 638 2HG GLN 89 2HG GLN 89 20.751 26.772 -17.669 639 1HE2 GLN 89 1HE2 GLN 89 23.397 25.441 -17.620 640 2HE2 GLN 89 2HE2 GLN 89 24.302 26.186 -16.345 641 H GLN 90 H GLN 90 18.891 23.642 -14.012 642 HA GLN 90 HA GLN 90 21.004 21.901 -13.936 643 1HB GLN 90 1HB GLN 90 18.864 22.722 -12.215 644 2HB GLN 90 2HB GLN 90 18.900 20.970 -12.181 645 1HG GLN 90 1HG GLN 90 21.524 22.450 -11.969 646 2HG GLN 90 2HG GLN 90 20.470 22.435 -10.568 647 1HE2 GLN 90 1HE2 GLN 90 23.023 20.979 -11.858 648 2HE2 GLN 90 2HE2 GLN 90 22.876 19.362 -11.256 649 H GLN 91 H GLN 91 17.802 21.543 -15.342 650 HA GLN 91 HA GLN 91 18.119 18.672 -15.460 651 1HB GLN 91 1HB GLN 91 15.906 19.986 -14.916 652 2HB GLN 91 2HB GLN 91 15.803 20.224 -16.649 653 1HG GLN 91 1HG GLN 91 16.195 17.467 -15.408 654 2HG GLN 91 2HG GLN 91 14.605 18.145 -15.693 655 1HE2 GLN 91 1HE2 GLN 91 15.563 15.791 -16.853 656 2HE2 GLN 91 2HE2 GLN 91 15.681 15.989 -18.569 657 H ALA 92 H ALA 92 18.438 21.600 -17.403 658 HA ALA 92 HA ALA 92 18.805 19.941 -19.799 659 1HB ALA 92 1HB ALA 92 18.554 22.202 -20.962 660 2HB ALA 92 3HB ALA 92 18.063 22.857 -19.382 661 3HB ALA 92 2HB ALA 92 17.097 21.577 -20.154 662 H LEU 93 H LEU 93 20.729 20.231 -17.531 663 HA LEU 93 HA LEU 93 22.721 22.079 -18.343 664 1HB LEU 93 1HB LEU 93 22.224 21.026 -16.033 665 2HB LEU 93 2HB LEU 93 23.179 19.672 -16.605 666 HG LEU 93 HG LEU 93 25.041 21.362 -17.078 667 1HD1 LEU 93 3HD1 LEU 93 22.981 23.152 -16.090 668 2HD1 LEU 93 1HD1 LEU 93 24.476 23.277 -15.132 669 3HD1 LEU 93 2HD1 LEU 93 24.526 23.517 -16.895 670 1HD2 LEU 93 1HD2 LEU 93 24.426 19.846 -14.864 671 2HD2 LEU 93 2HD2 LEU 93 25.972 20.674 -15.169 672 3HD2 LEU 93 3HD2 LEU 93 24.725 21.457 -14.169 673 H SER 94 H SER 94 22.322 21.194 -20.722 674 HA SER 94 HA SER 94 23.512 18.747 -21.351 675 1HB SER 94 1HB SER 94 21.957 20.587 -22.687 676 2HB SER 94 2HB SER 94 23.514 20.869 -23.441 677 HG SER 94 HG SER 94 21.777 18.736 -23.746 678 H SER 95 H SER 95 24.658 22.179 -21.390 679 HA SER 95 HA SER 95 26.989 21.989 -22.632 680 1HB SER 95 1HB SER 95 25.992 24.004 -21.434 681 2HB SER 95 2HB SER 95 26.671 23.386 -19.942 682 HG SER 95 HG SER 95 28.332 24.625 -20.579 683 H GLN 96 H GLN 96 26.816 21.646 -19.008 684 HA GLN 96 HA GLN 96 29.330 20.586 -18.759 685 1HB GLN 96 1HB GLN 96 27.721 21.500 -16.954 686 2HB GLN 96 2HB GLN 96 27.001 19.903 -16.925 687 1HG GLN 96 1HG GLN 96 29.951 19.807 -16.784 688 2HG GLN 96 2HG GLN 96 29.250 20.724 -15.465 689 1HE2 GLN 96 1HE2 GLN 96 28.570 19.668 -13.763 690 2HE2 GLN 96 2HE2 GLN 96 28.189 17.981 -13.660 691 H MET 97 H MET 97 26.180 18.764 -18.534 692 HA MET 97 HA MET 97 27.501 16.293 -18.743 693 1HB MET 97 1HB MET 97 25.106 17.027 -17.782 694 2HB MET 97 2HB MET 97 24.565 16.718 -19.420 695 1HG MET 97 1HG MET 97 26.218 14.494 -18.677 696 2HG MET 97 2HG MET 97 25.158 14.803 -17.316 697 1HE MET 97 1HE MET 97 23.351 13.438 -17.094 698 2HE MET 97 2HE MET 97 22.367 14.839 -17.583 699 3HE MET 97 3HE MET 97 22.012 13.226 -18.248 700 H GLY 98 H GLY 98 28.749 16.173 -20.655 701 1HA GLY 98 2HA GLY 98 28.940 16.694 -23.005 702 2HA GLY 98 1HA GLY 98 27.226 16.377 -23.182 703 H PHE 99 H PHE 99 30.262 15.082 -23.710 704 HA PHE 99 HA PHE 99 29.292 12.609 -24.504 705 1HB PHE 99 1HB PHE 99 31.555 14.092 -24.850 706 2HB PHE 99 2HB PHE 99 32.156 13.049 -23.576 707 HD1 PHE 99 1HD PHE 99 33.387 11.257 -24.308 708 HD2 PHE 99 2HD PHE 99 30.172 12.616 -26.721 709 HE1 PHE 99 1HE PHE 99 33.912 9.485 -26.006 710 HE2 PHE 99 2HE PHE 99 30.697 10.844 -28.419 711 HZ PHE 99 HZ PHE 99 32.561 9.299 -28.041 712 H MET 601 H MET 601 9.676 -21.220 -20.166 713 HA MET 601 HA MET 601 7.627 -20.009 -21.471 714 1HB MET 601 1HB MET 601 10.448 -20.815 -22.331 715 2HB MET 601 2HB MET 601 9.424 -19.870 -23.394 716 1HG MET 601 1HG MET 601 9.554 -17.967 -22.069 717 2HG MET 601 2HG MET 601 9.626 -18.877 -20.573 718 1HE MET 601 2HE MET 601 10.948 -16.641 -20.622 719 2HE MET 601 3HE MET 601 12.331 -17.285 -19.705 720 3HE MET 601 1HE MET 601 12.601 -16.446 -21.251 721 H THR 602 H THR 602 6.519 -22.500 -21.260 722 HA THR 602 HA THR 602 6.942 -24.291 -23.327 723 HB THR 602 HB THR 602 4.374 -23.539 -21.832 724 HG1 THR 602 1HG THR 602 6.458 -25.573 -21.458 725 1HG2 THR 602 3HG2 THR 602 5.047 -25.674 -23.779 726 2HG2 THR 602 1HG2 THR 602 4.486 -26.307 -22.213 727 3HG2 THR 602 2HG2 THR 602 3.457 -25.191 -23.143 728 H GLU 603 H GLU 603 4.990 -21.278 -23.257 729 HA GLU 603 HA GLU 603 5.131 -21.258 -26.109 730 1HB GLU 603 1HB GLU 603 2.612 -20.915 -26.330 731 2HB GLU 603 2HB GLU 603 3.122 -22.553 -25.971 732 1HG GLU 603 1HG GLU 603 2.802 -21.230 -23.448 733 2HG GLU 603 2HG GLU 603 1.403 -20.803 -24.414 734 HE2 GLU 603 HE GLU 603 2.181 -22.795 -22.259 735 H GLN 604 H GLN 604 5.867 -19.214 -26.477 736 HA GLN 604 HA GLN 604 5.802 -17.215 -24.624 737 1HB GLN 604 1HB GLN 604 6.777 -17.587 -27.253 738 2HB GLN 604 2HB GLN 604 5.772 -16.154 -27.352 739 1HG GLN 604 1HG GLN 604 7.312 -15.987 -24.914 740 2HG GLN 604 2HG GLN 604 8.409 -16.411 -26.213 741 1HE2 GLN 604 1HE2 GLN 604 8.423 -15.110 -28.141 742 2HE2 GLN 604 2HE2 GLN 604 8.051 -13.420 -28.068 743 H GLN 605 H GLN 605 3.470 -18.001 -27.249 744 HA GLN 605 HA GLN 605 1.982 -15.817 -27.402 745 1HB GLN 605 1HB GLN 605 1.010 -18.697 -27.180 746 2HB GLN 605 2HB GLN 605 -0.011 -17.375 -27.710 747 1HG GLN 605 1HG GLN 605 2.327 -17.089 -29.263 748 2HG GLN 605 2HG GLN 605 2.080 -18.822 -29.190 749 1HE2 GLN 605 1HE2 GLN 605 0.632 -15.731 -30.015 750 2HE2 GLN 605 2HE2 GLN 605 -0.569 -16.314 -31.119 751 H TRP 606 H TRP 606 1.697 -18.322 -24.793 752 HA TRP 606 HA TRP 606 0.719 -16.254 -23.013 753 1HB TRP 606 1HB TRP 606 -1.256 -17.433 -22.349 754 2HB TRP 606 2HB TRP 606 -1.324 -17.094 -24.067 755 HD1 TRP 606 HD TRP 606 -0.599 -19.364 -25.684 756 HE1 TRP 606 1HE TRP 606 -1.221 -21.914 -25.413 757 HE3 TRP 606 3HE TRP 606 -1.749 -19.098 -20.738 758 HZ2 TRP 606 2HZ TRP 606 -2.105 -23.498 -23.211 759 HZ3 TRP 606 3HZ TRP 606 -2.483 -21.193 -19.603 760 HH2 TRP 606 HH TRP 606 -2.669 -23.339 -20.758 761 H ASN 607 H ASN 607 2.572 -16.496 -21.734 762 HA ASN 607 HA ASN 607 3.706 -18.988 -21.219 763 1HB ASN 607 1HB ASN 607 3.903 -16.309 -19.749 764 2HB ASN 607 2HB ASN 607 4.904 -17.691 -19.348 765 1HD2 ASN 607 1HD2 ASN 607 6.569 -16.056 -19.878 766 2HD2 ASN 607 2HD2 ASN 607 7.133 -15.938 -21.511 767 H PHE 608 H PHE 608 3.077 -20.543 -19.701 768 HA PHE 608 HA PHE 608 0.711 -20.373 -18.321 769 1HB PHE 608 1HB PHE 608 3.034 -22.104 -18.644 770 2HB PHE 608 2HB PHE 608 2.659 -22.045 -16.933 771 HD1 PHE 608 1HD PHE 608 2.117 -23.883 -19.766 772 HD2 PHE 608 2HD PHE 608 -0.063 -22.189 -16.543 773 HE1 PHE 608 1HE PHE 608 0.298 -25.578 -20.106 774 HE2 PHE 608 2HE PHE 608 -1.883 -23.884 -16.884 775 HZ PHE 608 HZ PHE 608 -1.681 -25.558 -18.661 776 H ALA 609 H ALA 609 4.085 -19.742 -17.163 777 HA ALA 609 HA ALA 609 3.256 -19.204 -14.504 778 1HB ALA 609 2HB ALA 609 5.801 -18.454 -16.001 779 2HB ALA 609 1HB ALA 609 5.522 -19.987 -15.139 780 3HB ALA 609 3HB ALA 609 5.582 -18.455 -14.234 781 H GLY 610 H GLY 610 2.805 -17.541 -17.433 782 1HA GLY 610 2HA GLY 610 2.775 -15.249 -17.899 783 2HA GLY 610 1HA GLY 610 2.946 -14.884 -16.194 784 H ILE 611 H ILE 611 0.657 -16.769 -18.312 785 HA ILE 611 HA ILE 611 -1.519 -15.141 -17.918 786 HB ILE 611 HB ILE 611 -1.364 -16.830 -19.644 787 1HG1 ILE 611 1HG1 ILE 611 -3.599 -15.991 -18.554 788 2HG1 ILE 611 2HG1 ILE 611 -3.612 -17.254 -19.768 789 1HG2 ILE 611 1HG2 ILE 611 -1.054 -18.648 -17.332 790 2HG2 ILE 611 2HG2 ILE 611 -2.089 -19.243 -18.652 791 3HG2 ILE 611 3HG2 ILE 611 -0.409 -18.761 -18.988 792 1HD1 ILE 611 1HD1 ILE 611 -3.342 -18.039 -16.861 793 2HD1 ILE 611 2HD1 ILE 611 -4.940 -17.581 -17.498 794 3HD1 ILE 611 3HD1 ILE 611 -4.057 -18.951 -18.212 795 H GLU 612 H GLU 612 0.070 -17.303 -15.690 796 HA GLU 612 HA GLU 612 -2.204 -17.752 -14.077 797 1HB GLU 612 1HB GLU 612 -0.319 -19.316 -14.059 798 2HB GLU 612 2HB GLU 612 0.780 -18.055 -13.536 799 1HG GLU 612 1HG GLU 612 0.317 -18.996 -11.469 800 2HG GLU 612 2HG GLU 612 -0.980 -17.818 -11.522 801 HE2 GLU 612 HE GLU 612 -2.372 -20.529 -10.326 802 H ALA 613 H ALA 613 0.741 -15.641 -13.774 803 HA ALA 613 HA ALA 613 -0.385 -14.302 -11.497 804 1HB ALA 613 2HB ALA 613 1.701 -13.067 -11.515 805 2HB ALA 613 1HB ALA 613 2.061 -13.612 -13.171 806 3HB ALA 613 3HB ALA 613 2.063 -14.781 -11.829 807 H ALA 614 H ALA 614 -0.634 -14.096 -14.945 808 HA ALA 614 HA ALA 614 -0.798 -11.440 -15.481 809 1HB ALA 614 3HB ALA 614 -2.663 -13.633 -16.476 810 2HB ALA 614 1HB ALA 614 -2.315 -12.090 -17.293 811 3HB ALA 614 2HB ALA 614 -1.031 -13.309 -17.107 812 H ALA 615 H ALA 615 -3.437 -13.566 -14.176 813 HA ALA 615 HA ALA 615 -5.347 -11.554 -13.979 814 1HB ALA 615 2HB ALA 615 -6.616 -13.220 -13.080 815 2HB ALA 615 3HB ALA 615 -5.267 -14.255 -13.606 816 3HB ALA 615 1HB ALA 615 -5.355 -13.697 -11.919 817 H SER 616 H SER 616 -2.926 -12.791 -11.581 818 HA SER 616 HA SER 616 -3.702 -11.266 -9.470 819 1HB SER 616 1HB SER 616 -1.564 -12.972 -10.096 820 2HB SER 616 2HB SER 616 -0.772 -11.456 -9.713 821 HG SER 616 HG SER 616 -2.476 -11.590 -7.781 822 H ALA 617 H ALA 617 -1.975 -10.353 -12.429 823 HA ALA 617 HA ALA 617 -0.997 -7.876 -11.400 824 1HB ALA 617 1HB ALA 617 -0.580 -9.519 -13.655 825 2HB ALA 617 3HB ALA 617 0.211 -7.965 -13.295 826 3HB ALA 617 2HB ALA 617 -1.262 -8.005 -14.294 827 H ILE 618 H ILE 618 -3.848 -9.007 -13.288 828 HA ILE 618 HA ILE 618 -4.841 -6.486 -13.925 829 HB ILE 618 HB ILE 618 -6.287 -9.099 -13.473 830 1HG1 ILE 618 1HG1 ILE 618 -4.431 -9.172 -15.139 831 2HG1 ILE 618 2HG1 ILE 618 -6.014 -9.516 -15.806 832 1HG2 ILE 618 3HG2 ILE 618 -7.733 -7.042 -13.430 833 2HG2 ILE 618 1HG2 ILE 618 -7.212 -6.723 -15.102 834 3HG2 ILE 618 2HG2 ILE 618 -8.111 -8.211 -14.718 835 1HD1 ILE 618 1HD1 ILE 618 -4.714 -6.757 -15.895 836 2HD1 ILE 618 2HD1 ILE 618 -4.629 -7.943 -17.219 837 3HD1 ILE 618 3HD1 ILE 618 -6.201 -7.266 -16.731 838 H GLN 619 H GLN 619 -5.229 -8.566 -11.012 839 HA GLN 619 HA GLN 619 -7.205 -7.092 -9.807 840 1HB GLN 619 1HB GLN 619 -5.240 -9.134 -9.028 841 2HB GLN 619 2HB GLN 619 -5.582 -8.031 -7.711 842 1HG GLN 619 1HG GLN 619 -7.118 -10.117 -7.970 843 2HG GLN 619 2HG GLN 619 -7.889 -8.571 -7.673 844 1HE2 GLN 619 1HE2 GLN 619 -9.784 -8.858 -8.660 845 2HE2 GLN 619 2HE2 GLN 619 -10.011 -9.156 -10.351 846 H GLY 620 H GLY 620 -3.628 -6.942 -9.119 847 1HA GLY 620 2HA GLY 620 -2.319 -5.239 -8.458 848 2HA GLY 620 1HA GLY 620 -3.667 -4.732 -7.461 849 H ASN 621 H ASN 621 -3.764 -4.951 -11.045 850 HA ASN 621 HA ASN 621 -3.188 -2.229 -11.424 851 1HB ASN 621 1HB ASN 621 -4.331 -4.460 -13.144 852 2HB ASN 621 2HB ASN 621 -4.352 -2.816 -13.751 853 1HD2 ASN 621 1HD2 ASN 621 -2.276 -1.605 -13.610 854 2HD2 ASN 621 2HD2 ASN 621 -0.806 -2.442 -13.980 855 H VAL 622 H VAL 622 -6.147 -4.268 -11.134 856 HA VAL 622 HA VAL 622 -8.029 -2.403 -11.948 857 HB VAL 622 HB VAL 622 -8.100 -4.730 -10.034 858 1HG1 VAL 622 2HG1 VAL 622 -10.302 -2.827 -10.813 859 2HG1 VAL 622 3HG1 VAL 622 -10.663 -4.534 -10.458 860 3HG1 VAL 622 1HG1 VAL 622 -9.906 -3.507 -9.217 861 1HG2 VAL 622 3HG2 VAL 622 -7.895 -4.669 -12.766 862 2HG2 VAL 622 1HG2 VAL 622 -8.584 -6.012 -11.823 863 3HG2 VAL 622 2HG2 VAL 622 -9.657 -4.785 -12.539 864 H THR 623 H THR 623 -6.817 -3.163 -8.607 865 HA THR 623 HA THR 623 -8.288 -1.124 -7.361 866 HB THR 623 HB THR 623 -6.771 -1.642 -5.464 867 HG1 THR 623 1HG THR 623 -5.367 -3.306 -7.404 868 1HG2 THR 623 2HG2 THR 623 -8.457 -3.459 -6.309 869 2HG2 THR 623 3HG2 THR 623 -7.033 -4.241 -7.037 870 3HG2 THR 623 1HG2 THR 623 -7.117 -4.008 -5.274 871 H SER 624 H SER 624 -5.064 -1.157 -8.926 872 HA SER 624 HA SER 624 -4.101 1.185 -7.976 873 1HB SER 624 1HB SER 624 -3.490 -0.618 -10.073 874 2HB SER 624 2HB SER 624 -3.598 0.950 -10.848 875 HG SER 624 HG SER 624 -2.156 0.814 -8.396 876 H ILE 625 H ILE 625 -6.377 0.633 -10.736 877 HA ILE 625 HA ILE 625 -6.545 3.405 -11.361 878 HB ILE 625 HB ILE 625 -7.792 0.871 -12.277 879 1HG1 ILE 625 1HG1 ILE 625 -7.233 2.662 -14.386 880 2HG1 ILE 625 2HG1 ILE 625 -5.924 2.860 -13.238 881 1HG2 ILE 625 2HG2 ILE 625 -9.097 3.576 -12.534 882 2HG2 ILE 625 3HG2 ILE 625 -9.331 2.301 -13.754 883 3HG2 ILE 625 1HG2 ILE 625 -9.818 2.017 -12.065 884 1HD1 ILE 625 1HD1 ILE 625 -5.717 0.311 -13.169 885 2HD1 ILE 625 2HD1 ILE 625 -6.862 0.266 -14.532 886 3HD1 ILE 625 3HD1 ILE 625 -5.284 1.067 -14.721 887 H HIS 626 H HIS 626 -8.171 1.160 -9.155 888 HA HIS 626 HA HIS 626 -10.506 2.615 -8.771 889 1HB HIS 626 1HB HIS 626 -9.942 0.241 -8.047 890 2HB HIS 626 2HB HIS 626 -9.088 0.943 -6.687 891 HD1 HIS 626 1HD HIS 626 -10.943 -0.432 -5.259 892 HD2 HIS 626 2HD HIS 626 -12.338 2.863 -7.448 893 HE1 HIS 626 1HE HIS 626 -13.237 0.144 -4.301 894 H SER 627 H SER 627 -7.283 2.765 -7.141 895 HA SER 627 HA SER 627 -8.192 4.878 -5.460 896 1HB SER 627 1HB SER 627 -5.560 3.444 -5.888 897 2HB SER 627 2HB SER 627 -5.595 4.931 -4.961 898 HG SER 627 HG SER 627 -7.069 3.974 -3.477 899 H LEU 628 H LEU 628 -5.949 4.470 -8.278 900 HA LEU 628 HA LEU 628 -4.910 6.948 -8.493 901 1HB LEU 628 1HB LEU 628 -5.655 4.805 -10.390 902 2HB LEU 628 2HB LEU 628 -5.380 6.386 -11.096 903 HG LEU 628 HG LEU 628 -3.325 5.352 -9.189 904 1HD1 LEU 628 3HD1 LEU 628 -4.171 3.875 -11.531 905 2HD1 LEU 628 1HD1 LEU 628 -2.486 4.426 -11.692 906 3HD1 LEU 628 2HD1 LEU 628 -2.973 3.453 -10.284 907 1HD2 LEU 628 1HD2 LEU 628 -3.448 7.618 -10.571 908 2HD2 LEU 628 2HD2 LEU 628 -1.908 6.785 -10.251 909 3HD2 LEU 628 3HD2 LEU 628 -2.710 6.597 -11.829 910 H LEU 629 H LEU 629 -8.095 5.899 -9.895 911 HA LEU 629 HA LEU 629 -8.838 8.338 -10.907 912 1HB LEU 629 1HB LEU 629 -10.062 5.800 -10.282 913 2HB LEU 629 2HB LEU 629 -11.167 7.111 -9.922 914 HG LEU 629 HG LEU 629 -11.410 6.166 -12.209 915 1HD1 LEU 629 1HD1 LEU 629 -10.888 9.048 -11.658 916 2HD1 LEU 629 2HD1 LEU 629 -11.096 8.548 -13.353 917 3HD1 LEU 629 3HD1 LEU 629 -12.382 8.223 -12.166 918 1HD2 LEU 629 3HD2 LEU 629 -8.842 5.868 -12.425 919 2HD2 LEU 629 1HD2 LEU 629 -9.793 6.308 -13.863 920 3HD2 LEU 629 2HD2 LEU 629 -8.862 7.554 -12.997 921 H ASP 630 H ASP 630 -9.241 7.030 -7.564 922 HA ASP 630 HA ASP 630 -10.705 9.188 -6.635 923 1HB ASP 630 1HB ASP 630 -9.100 6.954 -5.458 924 2HB ASP 630 2HB ASP 630 -9.345 8.331 -4.402 925 HD2 ASP 630 HD ASP 630 -11.200 8.196 -3.251 926 H GLU 631 H GLU 631 -7.264 8.644 -7.274 927 HA GLU 631 HA GLU 631 -6.344 10.711 -5.577 928 1HB GLU 631 1HB GLU 631 -5.204 8.681 -7.337 929 2HB GLU 631 2HB GLU 631 -4.400 10.218 -7.584 930 1HG GLU 631 1HG GLU 631 -4.713 8.695 -4.963 931 2HG GLU 631 2HG GLU 631 -3.222 9.069 -5.804 932 HE2 GLU 631 HE GLU 631 -3.608 12.570 -4.921 933 H GLY 632 H GLY 632 -6.955 10.353 -9.127 934 1HA GLY 632 2HA GLY 632 -7.056 11.880 -10.782 935 2HA GLY 632 1HA GLY 632 -6.120 12.985 -9.795 936 H LYS 633 H LYS 633 -9.239 11.466 -8.834 937 HA LYS 633 HA LYS 633 -10.934 13.498 -9.627 938 1HB LYS 633 1HB LYS 633 -11.394 11.117 -8.686 939 2HB LYS 633 2HB LYS 633 -11.368 11.892 -7.115 940 1HG LYS 633 1HG LYS 633 -13.672 11.861 -7.920 941 2HG LYS 633 2HG LYS 633 -13.113 13.521 -7.910 942 1HD LYS 633 1HD LYS 633 -12.375 12.617 -10.463 943 2HD LYS 633 2HD LYS 633 -13.916 11.829 -10.193 944 1HE LYS 633 1HE LYS 633 -14.846 14.121 -9.488 945 2HE LYS 633 2HE LYS 633 -13.340 14.822 -10.046 946 H GLN 634 H GLN 634 -8.707 13.249 -6.864 947 HA GLN 634 HA GLN 634 -9.860 15.386 -5.451 948 1HB GLN 634 1HB GLN 634 -7.186 13.956 -5.320 949 2HB GLN 634 2HB GLN 634 -7.512 15.344 -4.301 950 1HG GLN 634 1HG GLN 634 -9.634 13.225 -4.358 951 2HG GLN 634 2HG GLN 634 -8.125 12.782 -3.584 952 1HE2 GLN 634 1HE2 GLN 634 -11.062 14.431 -3.318 953 2HE2 GLN 634 2HE2 GLN 634 -10.823 15.221 -1.794 954 H SER 635 H SER 635 -7.588 15.102 -8.140 955 HA SER 635 HA SER 635 -6.659 17.791 -7.787 956 1HB SER 635 1HB SER 635 -5.797 15.429 -9.218 957 2HB SER 635 2HB SER 635 -5.938 16.749 -10.362 958 HG SER 635 HG SER 635 -3.824 16.464 -9.129 959 H LEU 636 H LEU 636 -9.282 16.098 -9.307 960 HA LEU 636 HA LEU 636 -9.678 17.738 -11.545 961 1HB LEU 636 1HB LEU 636 -10.977 15.553 -10.202 962 2HB LEU 636 2HB LEU 636 -12.165 16.770 -10.624 963 HG LEU 636 HG LEU 636 -11.827 14.954 -12.321 964 1HD1 LEU 636 2HD1 LEU 636 -11.344 17.816 -13.188 965 2HD1 LEU 636 3HD1 LEU 636 -11.821 16.489 -14.274 966 3HD1 LEU 636 1HD1 LEU 636 -12.912 17.003 -12.965 967 1HD2 LEU 636 2HD2 LEU 636 -9.383 14.741 -12.077 968 2HD2 LEU 636 3HD2 LEU 636 -9.881 14.994 -13.767 969 3HD2 LEU 636 1HD2 LEU 636 -9.181 16.339 -12.834 970 H THR 637 H THR 637 -11.129 17.807 -8.218 971 HA THR 637 HA THR 637 -12.497 20.255 -8.742 972 HB THR 637 HB THR 637 -13.477 18.789 -7.126 973 HG1 THR 637 1HG THR 637 -13.347 20.202 -5.285 974 1HG2 THR 637 2HG2 THR 637 -10.625 18.507 -6.152 975 2HG2 THR 637 3HG2 THR 637 -11.944 18.355 -4.967 976 3HG2 THR 637 1HG2 THR 637 -11.868 17.250 -6.360 977 H LYS 638 H LYS 638 -9.265 19.371 -7.632 978 HA LYS 638 HA LYS 638 -8.766 21.982 -6.545 979 1HB LYS 638 1HB LYS 638 -7.067 19.525 -7.012 980 2HB LYS 638 2HB LYS 638 -6.385 21.036 -6.447 981 1HG LYS 638 1HG LYS 638 -8.189 20.994 -4.589 982 2HG LYS 638 2HG LYS 638 -8.517 19.343 -5.076 983 1HD LYS 638 1HD LYS 638 -5.944 20.478 -3.921 984 2HD LYS 638 2HD LYS 638 -6.931 19.177 -3.284 985 1HE LYS 638 1HE LYS 638 -6.345 18.082 -5.697 986 2HE LYS 638 2HE LYS 638 -4.946 19.127 -5.545 987 H LEU 639 H LEU 639 -8.622 20.369 -9.661 988 HA LEU 639 HA LEU 639 -6.929 22.494 -10.723 989 1HB LEU 639 1HB LEU 639 -7.872 19.852 -11.829 990 2HB LEU 639 2HB LEU 639 -7.044 21.053 -12.801 991 HG LEU 639 HG LEU 639 -5.788 20.062 -10.253 992 1HD1 LEU 639 2HD1 LEU 639 -6.557 18.114 -11.718 993 2HD1 LEU 639 3HD1 LEU 639 -5.350 18.678 -12.899 994 3HD1 LEU 639 1HD1 LEU 639 -4.835 18.173 -11.271 995 1HD2 LEU 639 3HD2 LEU 639 -5.052 21.954 -12.136 996 2HD2 LEU 639 1HD2 LEU 639 -3.988 21.185 -10.934 997 3HD2 LEU 639 2HD2 LEU 639 -4.093 20.523 -12.583 998 H ALA 640 H ALA 640 -10.228 21.663 -10.228 999 HA ALA 640 HA ALA 640 -11.520 22.466 -12.476 1000 1HB ALA 640 2HB ALA 640 -13.396 22.780 -11.080 1001 2HB ALA 640 3HB ALA 640 -12.385 21.626 -10.177 1002 3HB ALA 640 1HB ALA 640 -12.402 23.345 -9.716 1003 H ALA 641 H ALA 641 -9.897 24.483 -9.987 1004 HA ALA 641 HA ALA 641 -10.873 26.950 -10.709 1005 1HB ALA 641 1HB ALA 641 -9.154 27.781 -9.389 1006 2HB ALA 641 2HB ALA 641 -9.219 26.095 -8.822 1007 3HB ALA 641 3HB ALA 641 -7.972 26.593 -9.991 1008 H ALA 642 H ALA 642 -8.496 24.837 -12.313 1009 HA ALA 642 HA ALA 642 -7.344 26.763 -13.977 1010 1HB ALA 642 1HB ALA 642 -6.877 24.163 -13.427 1011 2HB ALA 642 3HB ALA 642 -6.260 24.961 -14.894 1012 3HB ALA 642 2HB ALA 642 -7.739 23.974 -14.973 1013 H TRP 643 H TRP 643 -10.258 24.656 -14.332 1014 HA TRP 643 HA TRP 643 -10.823 25.464 -16.967 1015 1HB TRP 643 1HB TRP 643 -12.404 24.151 -14.773 1016 2HB TRP 643 2HB TRP 643 -13.172 24.628 -16.275 1017 HD1 TRP 643 HD TRP 643 -12.704 23.080 -18.410 1018 HE1 TRP 643 1HE TRP 643 -11.493 20.780 -18.867 1019 HE3 TRP 643 3HE TRP 643 -10.335 22.835 -13.917 1020 HZ2 TRP 643 2HZ TRP 643 -9.720 19.153 -17.332 1021 HZ3 TRP 643 3HZ TRP 643 -8.882 20.858 -13.477 1022 HH2 TRP 643 HH TRP 643 -8.556 19.057 -15.097 1023 H GLY 644 H GLY 644 -11.046 27.009 -13.856 1024 1HA GLY 644 2HA GLY 644 -12.831 29.077 -14.997 1025 2HA GLY 644 1HA GLY 644 -11.383 29.446 -14.081 1026 H GLY 645 H GLY 645 -11.791 27.099 -12.210 1027 1HA GLY 645 2HA GLY 645 -14.054 28.218 -10.664 1028 2HA GLY 645 1HA GLY 645 -12.536 27.708 -9.951 1029 H SER 646 H SER 646 -14.428 26.443 -8.725 1030 HA SER 646 HA SER 646 -14.631 23.876 -10.094 1031 1HB SER 646 1HB SER 646 -14.571 22.805 -7.904 1032 2HB SER 646 2HB SER 646 -13.193 23.878 -8.049 1033 HG SER 646 HG SER 646 -15.658 24.384 -6.618 1034 H GLY 647 H GLY 647 -16.636 24.892 -11.098 1035 1HA GLY 647 2HA GLY 647 -18.841 25.651 -9.495 1036 2HA GLY 647 1HA GLY 647 -18.967 23.952 -9.908 1037 H SER 648 H SER 648 -17.343 26.392 -11.977 1038 HA SER 648 HA SER 648 -19.437 27.158 -13.519 1039 1HB SER 648 1HB SER 648 -16.487 26.954 -13.858 1040 2HB SER 648 2HB SER 648 -17.387 27.029 -15.360 1041 HG SER 648 HG SER 648 -17.013 29.161 -14.805 1042 H GLU 649 H GLU 649 -20.448 26.366 -15.442 1043 HA GLU 649 HA GLU 649 -20.907 23.709 -15.581 1044 1HB GLU 649 1HB GLU 649 -21.783 24.166 -17.890 1045 2HB GLU 649 2HB GLU 649 -22.342 25.321 -16.697 1046 1HG GLU 649 1HG GLU 649 -20.657 26.965 -17.419 1047 2HG GLU 649 2HG GLU 649 -19.931 25.801 -18.509 1048 HE2 GLU 649 HE GLU 649 -22.629 26.048 -20.807 1049 H ALA 650 H ALA 650 -18.257 25.593 -17.051 1050 HA ALA 650 HA ALA 650 -17.377 23.802 -18.947 1051 1HB ALA 650 2HB ALA 650 -16.419 26.149 -17.541 1052 2HB ALA 650 1HB ALA 650 -15.993 25.558 -19.165 1053 3HB ALA 650 3HB ALA 650 -15.097 24.975 -17.742 1054 H TYR 651 H TYR 651 -15.898 24.189 -15.646 1055 HA TYR 651 HA TYR 651 -14.473 21.833 -15.709 1056 1HB TYR 651 1HB TYR 651 -14.024 23.429 -13.969 1057 2HB TYR 651 2HB TYR 651 -15.727 23.697 -13.655 1058 HD1 TYR 651 1HD TYR 651 -16.456 22.995 -11.577 1059 HD2 TYR 651 2HD TYR 651 -13.357 20.777 -13.522 1060 HE1 TYR 651 1HE TYR 651 -16.332 21.413 -9.591 1061 HE2 TYR 651 2HE TYR 651 -13.244 19.202 -11.529 1062 HH TYR 651 HH TYR 651 -14.887 19.910 -8.577 1063 H GLN 652 H GLN 652 -17.898 22.437 -14.842 1064 HA GLN 652 HA GLN 652 -18.370 20.051 -13.560 1065 1HB GLN 652 1HB GLN 652 -20.187 21.844 -15.220 1066 2HB GLN 652 2HB GLN 652 -20.790 20.463 -14.324 1067 1HG GLN 652 1HG GLN 652 -19.161 21.849 -12.470 1068 2HG GLN 652 2HG GLN 652 -20.006 23.115 -13.338 1069 1HE2 GLN 652 1HE2 GLN 652 -20.164 21.676 -10.601 1070 2HE2 GLN 652 2HE2 GLN 652 -21.857 21.409 -10.354 1071 H GLY 653 H GLY 653 -18.853 20.926 -17.057 1072 1HA GLY 653 2HA GLY 653 -18.923 19.656 -18.908 1073 2HA GLY 653 1HA GLY 653 -19.749 18.449 -17.942 1074 H VAL 654 H VAL 654 -16.531 19.512 -16.930 1075 HA VAL 654 HA VAL 654 -15.183 17.420 -18.368 1076 HB VAL 654 HB VAL 654 -14.365 19.497 -16.341 1077 1HG1 VAL 654 2HG1 VAL 654 -13.062 17.356 -16.056 1078 2HG1 VAL 654 3HG1 VAL 654 -12.489 17.560 -17.729 1079 3HG1 VAL 654 1HG1 VAL 654 -12.087 18.779 -16.496 1080 1HG2 VAL 654 3HG2 VAL 654 -14.863 19.859 -18.941 1081 2HG2 VAL 654 1HG2 VAL 654 -13.552 20.716 -18.096 1082 3HG2 VAL 654 2HG2 VAL 654 -13.187 19.276 -19.077 1083 H GLN 655 H GLN 655 -16.180 18.137 -14.968 1084 HA GLN 655 HA GLN 655 -14.997 16.032 -13.747 1085 1HB GLN 655 1HB GLN 655 -17.286 17.810 -13.221 1086 2HB GLN 655 2HB GLN 655 -17.483 16.240 -12.468 1087 1HG GLN 655 1HG GLN 655 -14.737 17.162 -12.115 1088 2HG GLN 655 2HG GLN 655 -15.850 18.401 -11.572 1089 1HE2 GLN 655 1HE2 GLN 655 -14.122 16.967 -9.907 1090 2HE2 GLN 655 2HE2 GLN 655 -15.042 16.008 -8.796 1091 H GLN 656 H GLN 656 -18.176 16.120 -15.472 1092 HA GLN 656 HA GLN 656 -18.859 13.499 -14.851 1093 1HB GLN 656 1HB GLN 656 -19.794 15.621 -16.709 1094 2HB GLN 656 2HB GLN 656 -20.147 13.991 -17.247 1095 1HG GLN 656 1HG GLN 656 -21.960 14.105 -15.871 1096 2HG GLN 656 2HG GLN 656 -20.827 13.840 -14.562 1097 1HE2 GLN 656 1HE2 GLN 656 -21.379 16.629 -16.699 1098 2HE2 GLN 656 2HE2 GLN 656 -21.727 17.791 -15.463 1099 H LYS 657 H LYS 657 -16.862 14.963 -17.425 1100 HA LYS 657 HA LYS 657 -16.766 12.667 -19.061 1101 1HB LYS 657 1HB LYS 657 -15.019 15.128 -18.837 1102 2HB LYS 657 2HB LYS 657 -14.742 13.869 -20.023 1103 1HG LYS 657 1HG LYS 657 -16.886 14.236 -21.070 1104 2HG LYS 657 2HG LYS 657 -17.462 15.205 -19.728 1105 1HD LYS 657 1HD LYS 657 -15.518 16.840 -20.280 1106 2HD LYS 657 2HD LYS 657 -15.337 15.950 -21.778 1107 1HE LYS 657 1HE LYS 657 -17.825 16.376 -22.226 1108 2HE LYS 657 2HE LYS 657 -17.829 17.438 -20.832 1109 H TRP 658 H TRP 658 -14.874 13.849 -16.257 1110 HA TRP 658 HA TRP 658 -12.817 11.927 -16.517 1111 1HB TRP 658 1HB TRP 658 -12.383 13.922 -15.312 1112 2HB TRP 658 2HB TRP 658 -13.759 13.682 -14.255 1113 HD1 TRP 658 HD TRP 658 -13.413 11.981 -12.175 1114 HE1 TRP 658 1HE TRP 658 -11.334 10.859 -11.000 1115 HE3 TRP 658 3HE TRP 658 -10.107 12.965 -15.911 1116 HZ2 TRP 658 2HZ TRP 658 -8.601 10.518 -11.747 1117 HZ3 TRP 658 3HZ TRP 658 -7.753 12.204 -15.609 1118 HH2 TRP 658 HH TRP 658 -6.982 11.019 -13.615 1119 H ASP 659 H ASP 659 -15.722 12.207 -14.338 1120 HA ASP 659 HA ASP 659 -15.393 9.722 -13.194 1121 1HB ASP 659 1HB ASP 659 -17.253 11.870 -13.091 1122 2HB ASP 659 2HB ASP 659 -18.212 10.461 -13.497 1123 HD2 ASP 659 HD ASP 659 -16.210 11.845 -11.130 1124 H ALA 660 H ALA 660 -16.898 10.846 -16.233 1125 HA ALA 660 HA ALA 660 -18.531 8.717 -16.839 1126 1HB ALA 660 3HB ALA 660 -18.725 10.528 -18.275 1127 2HB ALA 660 1HB ALA 660 -16.964 10.754 -18.402 1128 3HB ALA 660 2HB ALA 660 -17.756 9.422 -19.278 1129 H THR 661 H THR 661 -15.531 9.075 -18.766 1130 HA THR 661 HA THR 661 -15.245 6.397 -19.295 1131 HB THR 661 HB THR 661 -12.917 7.080 -19.939 1132 HG1 THR 661 1HG THR 661 -12.246 9.171 -19.176 1133 1HG2 THR 661 1HG2 THR 661 -15.336 8.644 -20.663 1134 2HG2 THR 661 2HG2 THR 661 -13.819 9.554 -20.865 1135 3HG2 THR 661 3HG2 THR 661 -14.050 8.007 -21.715 1136 H ALA 662 H ALA 662 -14.454 8.155 -16.345 1137 HA ALA 662 HA ALA 662 -12.540 6.478 -15.282 1138 1HB ALA 662 3HB ALA 662 -12.906 8.439 -14.090 1139 2HB ALA 662 2HB ALA 662 -13.758 7.258 -13.066 1140 3HB ALA 662 1HB ALA 662 -14.678 8.292 -14.184 1141 H THR 663 H THR 663 -15.860 6.426 -13.897 1142 HA THR 663 HA THR 663 -15.761 3.879 -12.942 1143 HB THR 663 HB THR 663 -17.561 5.288 -12.261 1144 HG1 THR 663 1HG THR 663 -18.329 3.128 -12.653 1145 1HG2 THR 663 3HG2 THR 663 -17.582 6.070 -15.083 1146 2HG2 THR 663 1HG2 THR 663 -19.215 5.594 -14.559 1147 3HG2 THR 663 2HG2 THR 663 -18.345 6.885 -13.697 1148 H GLU 664 H GLU 664 -16.129 4.900 -16.296 1149 HA GLU 664 HA GLU 664 -17.280 2.550 -17.230 1150 1HB GLU 664 1HB GLU 664 -17.246 4.616 -18.552 1151 2HB GLU 664 2HB GLU 664 -15.494 4.596 -18.616 1152 1HG GLU 664 1HG GLU 664 -16.368 3.716 -20.724 1153 2HG GLU 664 2HG GLU 664 -15.573 2.416 -19.857 1154 HE2 GLU 664 HE GLU 664 -18.048 1.170 -21.375 1155 H LEU 665 H LEU 665 -13.828 3.626 -16.972 1156 HA LEU 665 HA LEU 665 -12.878 1.113 -17.963 1157 1HB LEU 665 1HB LEU 665 -11.801 3.366 -18.293 1158 2HB LEU 665 2HB LEU 665 -11.335 3.322 -16.605 1159 HG LEU 665 HG LEU 665 -9.490 2.662 -18.048 1160 1HD1 LEU 665 3HD1 LEU 665 -10.267 1.405 -15.755 1161 2HD1 LEU 665 1HD1 LEU 665 -10.064 0.027 -16.865 1162 3HD1 LEU 665 2HD1 LEU 665 -8.712 1.151 -16.585 1163 1HD2 LEU 665 1HD2 LEU 665 -10.919 1.751 -19.891 1164 2HD2 LEU 665 2HD2 LEU 665 -9.516 0.740 -19.468 1165 3HD2 LEU 665 3HD2 LEU 665 -11.144 0.280 -18.914 1166 H ASN 666 H ASN 666 -13.783 2.515 -14.866 1167 HA ASN 666 HA ASN 666 -12.219 0.801 -13.297 1168 1HB ASN 666 1HB ASN 666 -13.831 3.017 -12.833 1169 2HB ASN 666 2HB ASN 666 -14.823 1.735 -12.167 1170 1HD2 ASN 666 1HD2 ASN 666 -12.796 3.998 -11.279 1171 2HD2 ASN 666 2HD2 ASN 666 -11.946 3.271 -9.957 1172 H ASN 667 H ASN 667 -15.695 0.856 -14.367 1173 HA ASN 667 HA ASN 667 -16.450 -1.445 -13.045 1174 1HB ASN 667 1HB ASN 667 -17.508 -0.275 -15.673 1175 2HB ASN 667 2HB ASN 667 -18.351 -1.475 -14.714 1176 1HD2 ASN 667 1HD2 ASN 667 -18.908 1.370 -15.499 1177 2HD2 ASN 667 2HD2 ASN 667 -19.308 2.198 -14.031 1178 H ALA 668 H ALA 668 -15.398 -0.841 -16.479 1179 HA ALA 668 HA ALA 668 -15.623 -3.387 -17.461 1180 1HB ALA 668 3HB ALA 668 -14.875 -1.038 -18.479 1181 2HB ALA 668 1HB ALA 668 -13.249 -1.712 -18.220 1182 3HB ALA 668 2HB ALA 668 -14.414 -2.572 -19.255 1183 H LEU 669 H LEU 669 -12.856 -1.875 -15.678 1184 HA LEU 669 HA LEU 669 -11.141 -4.044 -15.848 1185 1HB LEU 669 1HB LEU 669 -11.356 -1.552 -14.379 1186 2HB LEU 669 2HB LEU 669 -10.663 -2.819 -13.386 1187 HG LEU 669 HG LEU 669 -9.591 -2.367 -16.155 1188 1HD1 LEU 669 1HD1 LEU 669 -9.797 -0.189 -14.665 1189 2HD1 LEU 669 2HD1 LEU 669 -8.348 -0.871 -13.889 1190 3HD1 LEU 669 3HD1 LEU 669 -8.344 -0.527 -15.635 1191 1HD2 LEU 669 1HD2 LEU 669 -9.000 -4.245 -14.332 1192 2HD2 LEU 669 2HD2 LEU 669 -7.810 -3.592 -15.484 1193 3HD2 LEU 669 3HD2 LEU 669 -7.865 -2.974 -13.816 1194 H GLN 670 H GLN 670 -13.761 -3.274 -13.493 1195 HA GLN 670 HA GLN 670 -13.224 -5.310 -11.734 1196 1HB GLN 670 1HB GLN 670 -15.590 -3.626 -12.433 1197 2HB GLN 670 2HB GLN 670 -15.948 -5.104 -11.563 1198 1HG GLN 670 1HG GLN 670 -13.972 -2.946 -10.684 1199 2HG GLN 670 2HG GLN 670 -15.555 -3.230 -9.989 1200 1HE2 GLN 670 1HE2 GLN 670 -15.920 -4.938 -8.638 1201 2HE2 GLN 670 2HE2 GLN 670 -14.670 -5.930 -7.966 1202 H ASN 671 H ASN 671 -15.467 -5.268 -14.593 1203 HA ASN 671 HA ASN 671 -16.183 -7.950 -14.271 1204 1HB ASN 671 1HB ASN 671 -17.068 -5.825 -15.819 1205 2HB ASN 671 2HB ASN 671 -16.265 -6.801 -17.033 1206 1HD2 ASN 671 1HD2 ASN 671 -17.621 -8.027 -18.074 1207 2HD2 ASN 671 2HD2 ASN 671 -18.965 -8.906 -17.424 1208 H LEU 672 H LEU 672 -13.465 -6.228 -15.722 1209 HA LEU 672 HA LEU 672 -12.696 -8.333 -17.494 1210 1HB LEU 672 1HB LEU 672 -12.173 -6.078 -18.064 1211 2HB LEU 672 2HB LEU 672 -11.361 -5.805 -16.535 1212 HG LEU 672 HG LEU 672 -9.903 -6.116 -18.598 1213 1HD1 LEU 672 2HD1 LEU 672 -9.163 -6.269 -16.188 1214 2HD1 LEU 672 3HD1 LEU 672 -9.290 -8.038 -16.345 1215 3HD1 LEU 672 1HD1 LEU 672 -8.149 -7.133 -17.369 1216 1HD2 LEU 672 3HD2 LEU 672 -11.334 -8.161 -19.318 1217 2HD2 LEU 672 1HD2 LEU 672 -9.573 -8.189 -19.576 1218 3HD2 LEU 672 2HD2 LEU 672 -10.285 -9.071 -18.204 1219 H ALA 673 H ALA 673 -11.742 -7.172 -14.214 1220 HA ALA 673 HA ALA 673 -9.764 -9.245 -13.978 1221 1HB ALA 673 1HB ALA 673 -10.075 -6.760 -12.890 1222 2HB ALA 673 2HB ALA 673 -10.708 -7.777 -11.573 1223 3HB ALA 673 3HB ALA 673 -9.055 -8.035 -12.182 1224 H ARG 674 H ARG 674 -13.198 -8.822 -13.418 1225 HA ARG 674 HA ARG 674 -13.442 -10.699 -11.371 1226 1HB ARG 674 1HB ARG 674 -15.316 -9.403 -13.360 1227 2HB ARG 674 2HB ARG 674 -15.905 -10.784 -12.457 1228 1HG ARG 674 1HG ARG 674 -14.486 -8.787 -10.777 1229 2HG ARG 674 2HG ARG 674 -15.923 -8.154 -11.555 1230 1HD ARG 674 1HD ARG 674 -17.254 -10.083 -10.649 1231 2HD ARG 674 2HD ARG 674 -15.816 -10.694 -9.855 1232 HE ARG 674 HE ARG 674 -16.489 -7.900 -9.196 1233 2HH1 ARG 674 1HH ARG 674 -17.336 -8.659 -5.914 1234 1HH2 ARG 674 2HH2 ARG 674 -16.844 -11.303 -8.276 1235 2HH2 ARG 674 1HH2 ARG 674 -17.242 -10.944 -6.628 1236 H THR 675 H THR 675 -13.108 -10.900 -14.886 1237 HA THR 675 HA THR 675 -13.785 -13.761 -14.802 1238 HB THR 675 HB THR 675 -13.485 -11.863 -17.187 1239 HG1 THR 675 1HG THR 675 -15.235 -11.366 -15.607 1240 1HG2 THR 675 2HG2 THR 675 -13.467 -14.548 -17.362 1241 2HG2 THR 675 3HG2 THR 675 -15.214 -14.343 -17.085 1242 3HG2 THR 675 1HG2 THR 675 -14.439 -13.572 -18.490 1243 H ILE 676 H ILE 676 -11.160 -11.604 -14.657 1244 HA ILE 676 HA ILE 676 -9.391 -13.498 -16.004 1245 HB ILE 676 HB ILE 676 -9.197 -10.621 -15.199 1246 1HG1 ILE 676 1HG1 ILE 676 -8.819 -12.192 -17.754 1247 2HG1 ILE 676 2HG1 ILE 676 -10.043 -10.991 -17.394 1248 1HG2 ILE 676 3HG2 ILE 676 -7.034 -12.554 -15.045 1249 2HG2 ILE 676 1HG2 ILE 676 -6.698 -11.278 -16.239 1250 3HG2 ILE 676 2HG2 ILE 676 -7.080 -10.844 -14.556 1251 1HD1 ILE 676 3HD1 ILE 676 -7.964 -9.388 -16.996 1252 2HD1 ILE 676 1HD1 ILE 676 -7.108 -10.591 -17.990 1253 3HD1 ILE 676 2HD1 ILE 676 -8.520 -9.732 -18.652 1254 H SER 677 H SER 677 -9.791 -11.730 -12.861 1255 HA SER 677 HA SER 677 -7.746 -12.738 -11.490 1256 1HB SER 677 1HB SER 677 -9.128 -12.482 -9.452 1257 2HB SER 677 2HB SER 677 -9.374 -11.145 -10.557 1258 HG SER 677 HG SER 677 -11.138 -13.299 -9.896 1259 H GLU 678 H GLU 678 -10.635 -14.465 -12.610 1260 HA GLU 678 HA GLU 678 -10.432 -16.638 -10.879 1261 1HB GLU 678 1HB GLU 678 -11.897 -17.785 -12.556 1262 2HB GLU 678 2HB GLU 678 -12.486 -16.197 -12.109 1263 1HG GLU 678 1HG GLU 678 -11.046 -15.397 -14.208 1264 2HG GLU 678 2HG GLU 678 -11.181 -17.075 -14.694 1265 HE2 GLU 678 HE GLU 678 -13.605 -14.945 -13.177 1266 H ALA 679 H ALA 679 -8.869 -15.801 -13.981 1267 HA ALA 679 HA ALA 679 -7.960 -18.150 -14.905 1268 1HB ALA 679 2HB ALA 679 -5.894 -16.833 -15.583 1269 2HB ALA 679 1HB ALA 679 -6.529 -15.485 -14.609 1270 3HB ALA 679 3HB ALA 679 -7.449 -16.081 -16.012 1271 H GLY 680 H GLY 680 -7.120 -16.589 -11.846 1272 1HA GLY 680 2HA GLY 680 -6.038 -17.428 -10.051 1273 2HA GLY 680 1HA GLY 680 -4.705 -17.620 -11.172 1274 H GLN 681 H GLN 681 -7.585 -19.242 -9.758 1275 HA GLN 681 HA GLN 681 -6.334 -21.770 -10.506 1276 1HB GLN 681 1HB GLN 681 -7.525 -22.604 -8.326 1277 2HB GLN 681 2HB GLN 681 -6.021 -21.715 -8.184 1278 1HG GLN 681 1HG GLN 681 -7.072 -19.772 -7.392 1279 2HG GLN 681 2HG GLN 681 -8.588 -20.132 -8.193 1280 1HE2 GLN 681 1HE2 GLN 681 -8.950 -19.356 -5.784 1281 2HE2 GLN 681 2HE2 GLN 681 -9.275 -20.627 -4.653 1282 H ALA 682 H ALA 682 -9.340 -19.897 -9.962 1283 HA ALA 682 HA ALA 682 -11.294 -21.703 -10.247 1284 1HB ALA 682 2HB ALA 682 -10.897 -18.901 -11.275 1285 2HB ALA 682 3HB ALA 682 -12.366 -19.793 -11.739 1286 3HB ALA 682 1HB ALA 682 -12.007 -19.504 -10.020 1287 H MET 683 H MET 683 -9.905 -19.991 -13.143 1288 HA MET 683 HA MET 683 -11.040 -21.472 -15.047 1289 1HB MET 683 1HB MET 683 -9.651 -19.605 -15.672 1290 2HB MET 683 2HB MET 683 -8.265 -20.231 -14.801 1291 1HG MET 683 1HG MET 683 -9.347 -21.939 -17.030 1292 2HG MET 683 2HG MET 683 -8.524 -20.464 -17.494 1293 1HE MET 683 2HE MET 683 -6.567 -19.656 -16.554 1294 2HE MET 683 3HE MET 683 -5.330 -20.528 -15.617 1295 3HE MET 683 1HE MET 683 -5.346 -20.644 -17.393 1296 H ALA 684 H ALA 684 -8.356 -22.440 -12.917 1297 HA ALA 684 HA ALA 684 -7.728 -24.767 -14.482 1298 1HB ALA 684 1HB ALA 684 -6.297 -25.245 -12.409 1299 2HB ALA 684 2HB ALA 684 -5.924 -23.749 -13.299 1300 3HB ALA 684 3HB ALA 684 -6.858 -23.675 -11.786 1301 H SER 685 H SER 685 -9.560 -23.937 -11.491 1302 HA SER 685 HA SER 685 -10.025 -26.286 -10.396 1303 1HB SER 685 1HB SER 685 -12.050 -24.092 -10.996 1304 2HB SER 685 2HB SER 685 -12.404 -25.436 -9.929 1305 HG SER 685 HG SER 685 -9.985 -24.326 -9.238 1306 H THR 686 H THR 686 -12.738 -25.115 -12.461 1307 HA THR 686 HA THR 686 -12.621 -27.031 -14.456 1308 HB THR 686 HB THR 686 -13.325 -28.138 -11.885 1309 HG1 THR 686 1HG THR 686 -13.437 -28.944 -14.705 1310 1HG2 THR 686 3HG2 THR 686 -15.557 -28.099 -13.982 1311 2HG2 THR 686 1HG2 THR 686 -15.450 -29.305 -12.677 1312 3HG2 THR 686 2HG2 THR 686 -15.684 -27.586 -12.282 1313 H GLU 687 H GLU 687 -14.169 -26.652 -16.003 1314 HA GLU 687 HA GLU 687 -15.378 -24.275 -16.072 1315 1HB GLU 687 1HB GLU 687 -15.187 -26.315 -17.807 1316 2HB GLU 687 2HB GLU 687 -16.852 -26.581 -17.328 1317 1HG GLU 687 1HG GLU 687 -17.572 -24.482 -18.156 1318 2HG GLU 687 2HG GLU 687 -15.967 -23.783 -18.076 1319 HE2 GLU 687 HE GLU 687 -17.346 -24.295 -21.136 1320 H GLY 688 H GLY 688 -17.168 -23.277 -15.195 1321 1HA GLY 688 2HA GLY 688 -19.152 -25.003 -13.850 1322 2HA GLY 688 1HA GLY 688 -19.460 -23.413 -14.520 1323 H ASN 689 H ASN 689 -16.460 -24.153 -12.733 1324 HA ASN 689 HA ASN 689 -17.542 -23.083 -10.312 1325 1HB ASN 689 1HB ASN 689 -14.946 -24.345 -11.192 1326 2HB ASN 689 2HB ASN 689 -14.874 -23.293 -9.793 1327 1HD2 ASN 689 1HD2 ASN 689 -14.906 -24.403 -8.004 1328 2HD2 ASN 689 2HD2 ASN 689 -15.892 -25.778 -7.633 1329 H VAL 690 H VAL 690 -16.747 -21.680 -13.153 1330 HA VAL 690 HA VAL 690 -14.913 -19.663 -12.219 1331 HB VAL 690 HB VAL 690 -16.462 -19.698 -14.803 1332 1HG1 VAL 690 1HG1 VAL 690 -14.076 -18.279 -13.724 1333 2HG1 VAL 690 2HG1 VAL 690 -14.011 -18.782 -15.431 1334 3HG1 VAL 690 3HG1 VAL 690 -15.326 -17.725 -14.864 1335 1HG2 VAL 690 1HG2 VAL 690 -14.089 -21.373 -13.990 1336 2HG2 VAL 690 2HG2 VAL 690 -15.570 -21.857 -14.850 1337 3HG2 VAL 690 3HG2 VAL 690 -14.333 -20.887 -15.685 1338 H THR 691 H THR 691 -15.615 -17.265 -12.825 1339 HA THR 691 HA THR 691 -17.371 -16.355 -11.014 1340 HB THR 691 HB THR 691 -16.639 -15.348 -13.803 1341 HG1 THR 691 1HG THR 691 -15.323 -13.992 -12.323 1342 1HG2 THR 691 2HG2 THR 691 -18.862 -14.381 -12.535 1343 2HG2 THR 691 3HG2 THR 691 -17.603 -13.466 -11.671 1344 3HG2 THR 691 1HG2 THR 691 -17.743 -13.334 -13.440 1345 H GLY 692 H GLY 692 -18.194 -17.954 -14.062 1346 1HA GLY 692 2HA GLY 692 -20.168 -18.757 -14.787 1347 2HA GLY 692 1HA GLY 692 -20.773 -17.140 -14.486 1348 H MET 693 H MET 693 -20.097 -20.302 -12.860 1349 HA MET 693 HA MET 693 -22.445 -19.759 -11.222 1350 1HB MET 693 1HB MET 693 -21.871 -21.906 -12.886 1351 2HB MET 693 2HB MET 693 -21.282 -22.523 -11.355 1352 1HG MET 693 1HG MET 693 -23.493 -22.039 -10.296 1353 2HG MET 693 2HG MET 693 -24.085 -21.386 -11.811 1354 1HE MET 693 2HE MET 693 -25.829 -22.945 -10.871 1355 2HE MET 693 3HE MET 693 -26.131 -23.489 -12.539 1356 3HE MET 693 1HE MET 693 -25.937 -24.684 -11.235 1357 H PHE 694 H PHE 694 -19.412 -19.048 -10.858 1358 HA PHE 694 HA PHE 694 -18.171 -20.513 -8.978 1359 1HB PHE 694 1HB PHE 694 -17.997 -17.974 -10.113 1360 2HB PHE 694 2HB PHE 694 -18.390 -17.553 -8.458 1361 HD1 PHE 694 1HD PHE 694 -15.767 -17.311 -10.307 1362 HD2 PHE 694 2HD PHE 694 -16.926 -19.710 -7.004 1363 HE1 PHE 694 1HE PHE 694 -13.357 -17.589 -9.663 1364 HE2 PHE 694 2HE PHE 694 -14.516 -19.987 -6.360 1365 HZ PHE 694 HZ PHE 694 -12.760 -18.923 -7.697 1366 H ALA 695 H ALA 695 -19.371 -21.590 -7.399 1367 HA ALA 695 HA ALA 695 -20.516 -19.832 -5.359 1368 1HB ALA 695 3HB ALA 695 -21.853 -22.381 -6.341 1369 2HB ALA 695 1HB ALA 695 -22.495 -21.191 -5.183 1370 3HB ALA 695 2HB ALA 695 -22.310 -20.753 -6.898 No H/Q in entry = 1370 Start of MODEL 4 1 H ALA 1 H ALA 1 -1.501 29.849 1.294 2 HA ALA 1 HA ALA 1 -1.339 30.150 -1.110 3 1HB ALA 1 3HB ALA 1 -3.972 29.745 -1.471 4 2HB ALA 1 1HB ALA 1 -2.913 28.512 -0.746 5 3HB ALA 1 2HB ALA 1 -3.913 29.551 0.297 6 H GLU 2 H GLU 2 -1.967 31.343 -3.000 7 HA GLU 2 HA GLU 2 -2.811 34.030 -2.298 8 1HB GLU 2 1HB GLU 2 -1.000 32.852 -4.345 9 2HB GLU 2 2HB GLU 2 -1.988 34.179 -4.923 10 1HG GLU 2 1HG GLU 2 -1.218 35.549 -2.928 11 2HG GLU 2 2HG GLU 2 -0.142 34.237 -2.490 12 HE2 GLU 2 HE GLU 2 1.184 36.811 -5.043 13 H MET 3 H MET 3 -3.113 31.959 -5.275 14 HA MET 3 HA MET 3 -5.943 32.679 -5.260 15 1HB MET 3 1HB MET 3 -3.829 32.750 -7.401 16 2HB MET 3 2HB MET 3 -5.397 32.159 -7.914 17 1HG MET 3 1HG MET 3 -5.809 34.511 -6.272 18 2HG MET 3 2HG MET 3 -4.589 34.887 -7.473 19 1HE MET 3 2HE MET 3 -7.891 34.504 -6.447 20 2HE MET 3 3HE MET 3 -8.174 35.907 -7.505 21 3HE MET 3 1HE MET 3 -8.973 34.355 -7.853 22 H LYS 4 H LYS 4 -7.318 31.080 -6.610 23 HA LYS 4 HA LYS 4 -6.383 28.389 -5.949 24 1HB LYS 4 1HB LYS 4 -8.683 27.746 -5.887 25 2HB LYS 4 2HB LYS 4 -8.512 29.214 -4.946 26 1HG LYS 4 1HG LYS 4 -9.054 30.300 -7.404 27 2HG LYS 4 2HG LYS 4 -9.916 28.781 -7.555 28 1HD LYS 4 1HD LYS 4 -10.340 30.127 -4.942 29 2HD LYS 4 2HD LYS 4 -10.897 31.069 -6.311 30 1HE LYS 4 1HE LYS 4 -12.665 29.676 -6.680 31 2HE LYS 4 2HE LYS 4 -11.658 28.245 -6.595 32 H THR 5 H THR 5 -6.621 30.588 -8.541 33 HA THR 5 HA THR 5 -6.732 28.356 -10.463 34 HB THR 5 HB THR 5 -7.719 29.952 -12.023 35 HG1 THR 5 1HG THR 5 -6.908 31.983 -11.650 36 1HG2 THR 5 3HG2 THR 5 -8.901 29.602 -9.355 37 2HG2 THR 5 1HG2 THR 5 -9.338 31.182 -10.048 38 3HG2 THR 5 2HG2 THR 5 -9.715 29.686 -10.936 39 H ASP 6 H ASP 6 -4.726 30.635 -8.906 40 HA ASP 6 HA ASP 6 -3.100 31.638 -10.734 41 1HB ASP 6 1HB ASP 6 -2.914 30.884 -7.972 42 2HB ASP 6 2HB ASP 6 -1.434 30.339 -8.735 43 HD2 ASP 6 HD ASP 6 -0.782 33.692 -9.840 44 H ALA 7 H ALA 7 -1.261 30.893 -11.998 45 HA ALA 7 HA ALA 7 -1.451 28.287 -12.986 46 1HB ALA 7 1HB ALA 7 0.470 30.592 -13.224 47 2HB ALA 7 2HB ALA 7 0.942 29.004 -13.874 48 3HB ALA 7 3HB ALA 7 -0.526 29.810 -14.475 49 H ALA 8 H ALA 8 0.342 29.734 -10.284 50 HA ALA 8 HA ALA 8 2.205 27.620 -10.010 51 1HB ALA 8 1HB ALA 8 2.061 28.768 -7.540 52 2HB ALA 8 3HB ALA 8 1.355 30.060 -8.540 53 3HB ALA 8 2HB ALA 8 2.988 29.449 -8.898 54 H THR 9 H THR 9 -0.966 28.434 -8.460 55 HA THR 9 HA THR 9 -0.968 26.187 -6.753 56 HB THR 9 HB THR 9 -2.404 28.523 -7.010 57 HG1 THR 9 1HG THR 9 -3.138 27.619 -5.107 58 1HG2 THR 9 2HG2 THR 9 -4.217 26.203 -7.863 59 2HG2 THR 9 3HG2 THR 9 -4.776 27.819 -7.370 60 3HG2 THR 9 1HG2 THR 9 -3.826 27.623 -8.863 61 H LEU 10 H LEU 10 -2.152 26.734 -10.096 62 HA LEU 10 HA LEU 10 -3.522 24.283 -10.260 63 1HB LEU 10 1HB LEU 10 -2.482 26.286 -12.236 64 2HB LEU 10 2HB LEU 10 -3.139 24.757 -12.787 65 HG LEU 10 HG LEU 10 -4.607 26.838 -11.144 66 1HD1 LEU 10 2HD1 LEU 10 -4.133 27.388 -13.560 67 2HD1 LEU 10 3HD1 LEU 10 -5.145 25.991 -13.997 68 3HD1 LEU 10 1HD1 LEU 10 -5.851 27.355 -13.098 69 1HD2 LEU 10 1HD2 LEU 10 -5.428 24.095 -12.097 70 2HD2 LEU 10 2HD2 LEU 10 -5.506 24.781 -10.457 71 3HD2 LEU 10 3HD2 LEU 10 -6.614 25.368 -11.719 72 H ALA 11 H ALA 11 -0.210 25.320 -11.317 73 HA ALA 11 HA ALA 11 0.544 22.837 -12.324 74 1HB ALA 11 2HB ALA 11 2.081 25.192 -11.178 75 2HB ALA 11 3HB ALA 11 2.883 23.779 -11.904 76 3HB ALA 11 1HB ALA 11 1.799 24.791 -12.889 77 H GLN 12 H GLN 12 0.571 24.219 -9.013 78 HA GLN 12 HA GLN 12 2.173 22.292 -7.862 79 1HB GLN 12 1HB GLN 12 0.512 24.489 -7.010 80 2HB GLN 12 2HB GLN 12 0.160 23.117 -5.978 81 1HG GLN 12 1HG GLN 12 2.127 23.372 -4.881 82 2HG GLN 12 2HG GLN 12 3.025 23.240 -6.380 83 1HE2 GLN 12 1HE2 GLN 12 4.407 24.835 -6.486 84 2HE2 GLN 12 2HE2 GLN 12 4.098 26.513 -6.185 85 H GLU 13 H GLU 13 -1.258 22.277 -8.802 86 HA GLU 13 HA GLU 13 -1.631 19.769 -7.412 87 1HB GLU 13 1HB GLU 13 -3.568 21.573 -8.924 88 2HB GLU 13 2HB GLU 13 -4.033 20.052 -8.189 89 1HG GLU 13 1HG GLU 13 -3.957 20.900 -6.052 90 2HG GLU 13 2HG GLU 13 -2.527 21.862 -6.370 91 HE2 GLU 13 HE GLU 13 -3.395 23.514 -8.367 92 H ALA 14 H ALA 14 -1.607 21.205 -10.718 93 HA ALA 14 HA ALA 14 -2.424 18.997 -12.147 94 1HB ALA 14 3HB ALA 14 -1.710 21.524 -12.746 95 2HB ALA 14 1HB ALA 14 -0.217 20.692 -13.245 96 3HB ALA 14 2HB ALA 14 -1.776 20.234 -13.971 97 H GLY 15 H GLY 15 0.938 19.972 -11.177 98 1HA GLY 15 2HA GLY 15 2.771 18.720 -10.803 99 2HA GLY 15 1HA GLY 15 2.358 17.921 -12.307 100 H ASN 16 H ASN 16 0.309 17.893 -9.356 101 HA ASN 16 HA ASN 16 1.278 15.376 -8.520 102 1HB ASN 16 1HB ASN 16 0.363 16.648 -6.749 103 2HB ASN 16 2HB ASN 16 -0.970 17.238 -7.721 104 1HD2 ASN 16 1HD2 ASN 16 -2.747 16.611 -6.743 105 2HD2 ASN 16 2HD2 ASN 16 -3.148 15.001 -6.246 106 H PHE 17 H PHE 17 -1.306 16.651 -10.611 107 HA PHE 17 HA PHE 17 -2.854 14.266 -10.641 108 1HB PHE 17 1HB PHE 17 -3.740 16.557 -11.135 109 2HB PHE 17 2HB PHE 17 -2.596 16.741 -12.450 110 HD1 PHE 17 1HD PHE 17 -3.115 15.977 -14.619 111 HD2 PHE 17 2HD PHE 17 -5.565 14.817 -11.355 112 HE1 PHE 17 1HE PHE 17 -4.807 15.043 -16.221 113 HE2 PHE 17 2HE PHE 17 -7.258 13.883 -12.957 114 HZ PHE 17 HZ PHE 17 -6.858 14.008 -15.371 115 H GLU 18 H GLU 18 -0.653 15.874 -13.053 116 HA GLU 18 HA GLU 18 -0.782 14.200 -15.079 117 1HB GLU 18 1HB GLU 18 1.437 15.767 -13.852 118 2HB GLU 18 2HB GLU 18 1.945 14.531 -14.986 119 1HG GLU 18 1HG GLU 18 1.202 15.730 -16.770 120 2HG GLU 18 2HG GLU 18 -0.368 15.988 -16.034 121 HE2 GLU 18 HE GLU 18 -0.201 18.196 -16.780 122 H ARG 19 H ARG 19 0.773 13.514 -11.929 123 HA ARG 19 HA ARG 19 2.060 11.192 -12.758 124 1HB ARG 19 1HB ARG 19 2.064 12.710 -10.471 125 2HB ARG 19 2HB ARG 19 1.084 11.364 -9.924 126 1HG ARG 19 1HG ARG 19 2.824 9.804 -10.174 127 2HG ARG 19 2HG ARG 19 3.633 10.739 -11.416 128 1HD ARG 19 1HD ARG 19 4.989 11.656 -9.844 129 2HD ARG 19 2HD ARG 19 3.598 12.374 -9.057 130 HE ARG 19 HE ARG 19 3.499 9.765 -8.169 131 2HH1 ARG 19 1HH ARG 19 5.924 9.659 -5.685 132 1HH2 ARG 19 2HH2 ARG 19 6.073 12.200 -8.201 133 2HH2 ARG 19 1HH2 ARG 19 6.851 11.575 -6.785 134 H ILE 20 H ILE 20 -1.153 11.849 -11.226 135 HA ILE 20 HA ILE 20 -1.886 9.171 -10.893 136 HB ILE 20 HB ILE 20 -3.598 11.632 -11.265 137 1HG1 ILE 20 1HG1 ILE 20 -2.911 10.393 -8.615 138 2HG1 ILE 20 2HG1 ILE 20 -1.774 11.485 -9.380 139 1HG2 ILE 20 1HG2 ILE 20 -4.660 9.296 -11.547 140 2HG2 ILE 20 2HG2 ILE 20 -4.406 9.135 -9.792 141 3HG2 ILE 20 3HG2 ILE 20 -5.420 10.453 -10.427 142 1HD1 ILE 20 3HD1 ILE 20 -4.169 12.859 -9.688 143 2HD1 ILE 20 1HD1 ILE 20 -4.378 12.071 -8.105 144 3HD1 ILE 20 2HD1 ILE 20 -2.985 13.142 -8.389 145 H SER 21 H SER 21 -2.338 11.506 -13.608 146 HA SER 21 HA SER 21 -3.947 9.874 -15.133 147 1HB SER 21 1HB SER 21 -3.016 11.273 -17.076 148 2HB SER 21 2HB SER 21 -3.764 12.162 -15.764 149 HG SER 21 HG SER 21 -1.300 12.496 -16.730 150 H GLY 22 H GLY 22 -0.346 10.222 -14.992 151 1HA GLY 22 2HA GLY 22 1.318 8.940 -15.794 152 2HA GLY 22 1HA GLY 22 0.247 8.439 -17.088 153 H ASP 23 H ASP 23 0.415 7.962 -13.478 154 HA ASP 23 HA ASP 23 1.063 5.340 -13.527 155 1HB ASP 23 1HB ASP 23 -0.465 7.106 -11.627 156 2HB ASP 23 2HB ASP 23 -0.513 5.382 -11.320 157 HD2 ASP 23 HD ASP 23 0.573 5.883 -9.429 158 H LEU 24 H LEU 24 -2.216 6.903 -13.540 159 HA LEU 24 HA LEU 24 -3.753 4.618 -13.396 160 1HB LEU 24 1HB LEU 24 -4.502 6.975 -13.163 161 2HB LEU 24 2HB LEU 24 -4.362 7.166 -14.899 162 HG LEU 24 HG LEU 24 -6.007 5.120 -14.988 163 1HD1 LEU 24 2HD1 LEU 24 -5.777 4.898 -12.416 164 2HD1 LEU 24 3HD1 LEU 24 -6.938 6.246 -12.359 165 3HD1 LEU 24 1HD1 LEU 24 -7.383 4.722 -13.163 166 1HD2 LEU 24 3HD2 LEU 24 -6.617 8.010 -14.455 167 2HD2 LEU 24 1HD2 LEU 24 -6.771 7.069 -15.958 168 3HD2 LEU 24 2HD2 LEU 24 -7.943 6.836 -14.638 169 H LYS 25 H LYS 25 -2.241 6.240 -16.240 170 HA LYS 25 HA LYS 25 -3.409 4.469 -18.111 171 1HB LYS 25 1HB LYS 25 -2.797 6.408 -19.136 172 2HB LYS 25 2HB LYS 25 -1.388 6.647 -18.122 173 1HG LYS 25 1HG LYS 25 -0.009 5.394 -19.490 174 2HG LYS 25 2HG LYS 25 -1.271 4.248 -19.899 175 1HD LYS 25 1HD LYS 25 -0.768 5.493 -21.912 176 2HD LYS 25 2HD LYS 25 -2.341 6.032 -21.358 177 1HE LYS 25 1HE LYS 25 -1.498 8.146 -21.489 178 2HE LYS 25 2HE LYS 25 -0.635 7.772 -20.010 179 H THR 26 H THR 26 -0.411 4.493 -16.158 180 HA THR 26 HA THR 26 0.926 2.445 -17.506 181 HB THR 26 HB THR 26 0.971 3.744 -14.781 182 HG1 THR 26 1HG THR 26 2.075 4.365 -16.907 183 1HG2 THR 26 2HG2 THR 26 1.873 0.980 -15.329 184 2HG2 THR 26 3HG2 THR 26 3.212 2.053 -14.857 185 3HG2 THR 26 1HG2 THR 26 1.809 1.854 -13.780 186 H GLN 27 H GLN 27 -1.381 2.295 -14.722 187 HA GLN 27 HA GLN 27 -1.194 -0.477 -14.514 188 1HB GLN 27 1HB GLN 27 -3.503 1.334 -13.684 189 2HB GLN 27 2HB GLN 27 -3.196 -0.281 -13.079 190 1HG GLN 27 1HG GLN 27 -1.089 1.899 -12.846 191 2HG GLN 27 2HG GLN 27 -2.370 1.756 -11.659 192 1HE2 GLN 27 1HE2 GLN 27 0.705 0.888 -12.408 193 2HE2 GLN 27 2HE2 GLN 27 0.907 -0.528 -11.431 194 H ILE 28 H ILE 28 -3.429 1.724 -16.295 195 HA ILE 28 HA ILE 28 -5.243 -0.196 -17.132 196 HB ILE 28 HB ILE 28 -4.349 2.455 -18.223 197 1HG1 ILE 28 1HG1 ILE 28 -6.927 1.517 -16.930 198 2HG1 ILE 28 2HG1 ILE 28 -5.649 2.408 -16.128 199 1HG2 ILE 28 3HG2 ILE 28 -5.640 0.397 -19.732 200 2HG2 ILE 28 1HG2 ILE 28 -6.804 1.710 -19.436 201 3HG2 ILE 28 2HG2 ILE 28 -5.243 2.065 -20.212 202 1HD1 ILE 28 3HD1 ILE 28 -6.852 3.522 -18.672 203 2HD1 ILE 28 1HD1 ILE 28 -7.714 3.712 -17.126 204 3HD1 ILE 28 2HD1 ILE 28 -6.079 4.388 -17.323 205 H ASP 29 H ASP 29 -2.298 1.081 -18.835 206 HA ASP 29 HA ASP 29 -2.495 -0.522 -21.024 207 1HB ASP 29 1HB ASP 29 -0.716 1.352 -20.109 208 2HB ASP 29 2HB ASP 29 0.250 -0.095 -19.899 209 HD2 ASP 29 HD ASP 29 1.309 1.508 -22.027 210 H GLN 30 H GLN 30 -1.048 -1.110 -17.769 211 HA GLN 30 HA GLN 30 0.285 -3.432 -18.302 212 1HB GLN 30 1HB GLN 30 -0.853 -2.096 -15.905 213 2HB GLN 30 2HB GLN 30 -0.641 -3.826 -15.725 214 1HG GLN 30 1HG GLN 30 1.384 -2.472 -15.039 215 2HG GLN 30 2HG GLN 30 1.724 -3.686 -16.256 216 1HE2 GLN 30 1HE2 GLN 30 2.905 -1.010 -15.488 217 2HE2 GLN 30 2HE2 GLN 30 3.054 -0.126 -16.970 218 H VAL 31 H VAL 31 -3.186 -2.909 -17.448 219 HA VAL 31 HA VAL 31 -3.808 -5.659 -17.320 220 HB VAL 31 HB VAL 31 -5.394 -3.116 -17.608 221 1HG1 VAL 31 1HG1 VAL 31 -6.517 -5.056 -18.799 222 2HG1 VAL 31 2HG1 VAL 31 -6.621 -5.858 -17.213 223 3HG1 VAL 31 3HG1 VAL 31 -7.451 -4.307 -17.482 224 1HG2 VAL 31 3HG2 VAL 31 -4.206 -4.370 -15.427 225 2HG2 VAL 31 1HG2 VAL 31 -5.477 -3.125 -15.371 226 3HG2 VAL 31 2HG2 VAL 31 -5.917 -4.848 -15.315 227 H GLU 32 H GLU 32 -4.316 -3.126 -19.875 228 HA GLU 32 HA GLU 32 -5.514 -4.665 -21.727 229 1HB GLU 32 1HB GLU 32 -3.670 -2.299 -21.845 230 2HB GLU 32 2HB GLU 32 -3.997 -3.124 -23.357 231 1HG GLU 32 1HG GLU 32 -6.511 -2.965 -22.721 232 2HG GLU 32 2HG GLU 32 -6.015 -1.847 -21.466 233 HE2 GLU 32 HE GLU 32 -4.617 0.235 -24.216 234 H SER 33 H SER 33 -2.022 -4.519 -20.900 235 HA SER 33 HA SER 33 -1.313 -6.205 -23.071 236 1HB SER 33 1HB SER 33 0.038 -4.498 -21.263 237 2HB SER 33 2HB SER 33 0.646 -6.100 -20.898 238 HG SER 33 HG SER 33 1.033 -4.509 -23.175 239 H THR 34 H THR 34 -1.408 -6.544 -19.447 240 HA THR 34 HA THR 34 -0.724 -9.215 -19.309 241 HB THR 34 HB THR 34 -2.225 -7.213 -17.627 242 HG1 THR 34 1HG THR 34 -0.397 -7.947 -16.261 243 1HG2 THR 34 3HG2 THR 34 -3.456 -9.448 -17.336 244 2HG2 THR 34 1HG2 THR 34 -1.899 -10.151 -16.838 245 3HG2 THR 34 2HG2 THR 34 -2.640 -8.854 -15.870 246 H ALA 35 H ALA 35 -3.996 -7.744 -19.743 247 HA ALA 35 HA ALA 35 -5.461 -10.064 -19.615 248 1HB ALA 35 2HB ALA 35 -7.183 -8.763 -20.438 249 2HB ALA 35 1HB ALA 35 -6.153 -7.979 -21.660 250 3HB ALA 35 3HB ALA 35 -6.046 -7.481 -19.955 251 H GLY 36 H GLY 36 -3.252 -8.885 -22.118 252 1HA GLY 36 2HA GLY 36 -2.402 -9.939 -23.920 253 2HA GLY 36 1HA GLY 36 -4.078 -10.157 -24.382 254 H SER 37 H SER 37 -2.110 -11.574 -21.673 255 HA SER 37 HA SER 37 -1.893 -14.066 -22.900 256 1HB SER 37 1HB SER 37 -1.331 -12.888 -20.220 257 2HB SER 37 2HB SER 37 -1.603 -14.619 -20.220 258 HG SER 37 HG SER 37 0.537 -13.131 -21.283 259 H LEU 38 H LEU 38 -4.333 -12.536 -20.799 260 HA LEU 38 HA LEU 38 -5.654 -14.913 -20.057 261 1HB LEU 38 1HB LEU 38 -6.264 -11.990 -20.010 262 2HB LEU 38 2HB LEU 38 -7.573 -13.128 -19.758 263 HG LEU 38 HG LEU 38 -6.982 -12.840 -17.595 264 1HD1 LEU 38 2HD1 LEU 38 -6.480 -15.234 -18.259 265 2HD1 LEU 38 3HD1 LEU 38 -4.757 -14.786 -18.225 266 3HD1 LEU 38 1HD1 LEU 38 -5.739 -14.662 -16.745 267 1HD2 LEU 38 2HD2 LEU 38 -4.164 -12.258 -18.532 268 2HD2 LEU 38 3HD2 LEU 38 -5.373 -11.108 -17.911 269 3HD2 LEU 38 1HD2 LEU 38 -4.654 -12.318 -16.822 270 H GLN 39 H GLN 39 -6.689 -12.332 -22.404 271 HA GLN 39 HA GLN 39 -8.728 -13.736 -23.497 272 1HB GLN 39 1HB GLN 39 -8.118 -12.307 -25.628 273 2HB GLN 39 2HB GLN 39 -8.635 -11.502 -24.159 274 1HG GLN 39 1HG GLN 39 -5.768 -11.937 -24.022 275 2HG GLN 39 2HG GLN 39 -6.150 -11.188 -25.560 276 1HE2 GLN 39 1HE2 GLN 39 -7.901 -10.901 -22.499 277 2HE2 GLN 39 2HE2 GLN 39 -7.657 -9.204 -22.252 278 H GLY 40 H GLY 40 -5.255 -14.180 -23.926 279 1HA GLY 40 2HA GLY 40 -4.083 -15.388 -25.496 280 2HA GLY 40 1HA GLY 40 -5.574 -15.815 -26.313 281 H GLN 41 H GLN 41 -6.237 -16.285 -23.069 282 HA GLN 41 HA GLN 41 -5.734 -19.112 -23.379 283 1HB GLN 41 1HB GLN 41 -4.612 -17.371 -21.175 284 2HB GLN 41 2HB GLN 41 -5.025 -19.038 -20.826 285 1HG GLN 41 1HG GLN 41 -2.880 -19.436 -21.555 286 2HG GLN 41 2HG GLN 41 -3.637 -19.427 -23.135 287 1HE2 GLN 41 1HE2 GLN 41 -1.623 -17.748 -20.880 288 2HE2 GLN 41 2HE2 GLN 41 -1.072 -16.474 -21.917 289 H TRP 42 H TRP 42 -7.856 -19.784 -23.394 290 HA TRP 42 HA TRP 42 -9.344 -19.526 -20.976 291 1HB TRP 42 1HB TRP 42 -10.300 -18.032 -23.422 292 2HB TRP 42 2HB TRP 42 -11.332 -18.464 -22.072 293 HD1 TRP 42 HD TRP 42 -9.461 -15.577 -23.215 294 HE1 TRP 42 1HE TRP 42 -8.857 -13.834 -21.327 295 HE3 TRP 42 3HE TRP 42 -10.396 -18.694 -19.308 296 HZ2 TRP 42 2HZ TRP 42 -8.839 -13.953 -18.476 297 HZ3 TRP 42 3HZ TRP 42 -10.060 -17.802 -17.004 298 HH2 TRP 42 HH TRP 42 -9.309 -15.519 -16.556 299 H ARG 43 H ARG 43 -11.270 -20.959 -21.071 300 HA ARG 43 HA ARG 43 -11.119 -22.741 -23.368 301 1HB ARG 43 1HB ARG 43 -11.301 -23.386 -20.400 302 2HB ARG 43 2HB ARG 43 -11.894 -24.533 -21.585 303 1HG ARG 43 1HG ARG 43 -9.144 -23.381 -22.024 304 2HG ARG 43 2HG ARG 43 -9.332 -24.550 -20.732 305 1HD ARG 43 1HD ARG 43 -10.187 -26.239 -22.268 306 2HD ARG 43 2HD ARG 43 -10.336 -25.071 -23.567 307 HE ARG 43 HE ARG 43 -8.039 -25.273 -23.994 308 2HH1 ARG 43 1HH ARG 43 -5.529 -27.015 -22.341 309 1HH2 ARG 43 2HH2 ARG 43 -8.747 -26.666 -20.814 310 2HH2 ARG 43 1HH2 ARG 43 -7.160 -27.330 -20.614 311 H GLY 44 H GLY 44 -12.882 -20.798 -23.723 312 1HA GLY 44 2HA GLY 44 -15.436 -22.078 -23.558 313 2HA GLY 44 1HA GLY 44 -15.065 -20.507 -24.240 314 H ALA 45 H ALA 45 -16.915 -19.513 -23.245 315 HA ALA 45 HA ALA 45 -18.019 -18.435 -21.660 316 1HB ALA 45 3HB ALA 45 -18.725 -20.139 -20.344 317 2HB ALA 45 1HB ALA 45 -17.125 -20.918 -20.337 318 3HB ALA 45 2HB ALA 45 -17.471 -19.584 -19.209 319 H ALA 46 H ALA 46 -15.195 -19.435 -19.628 320 HA ALA 46 HA ALA 46 -14.788 -16.962 -18.515 321 1HB ALA 46 1HB ALA 46 -12.271 -18.315 -18.817 322 2HB ALA 46 2HB ALA 46 -13.319 -18.224 -17.381 323 3HB ALA 46 3HB ALA 46 -13.541 -19.535 -18.563 324 H GLY 47 H GLY 47 -13.995 -18.156 -21.736 325 1HA GLY 47 2HA GLY 47 -12.852 -17.248 -23.458 326 2HA GLY 47 1HA GLY 47 -11.965 -16.243 -22.329 327 H THR 48 H THR 48 -15.306 -16.587 -23.726 328 HA THR 48 HA THR 48 -15.363 -14.009 -24.780 329 HB THR 48 HB THR 48 -17.901 -14.545 -24.809 330 HG1 THR 48 1HG THR 48 -18.191 -16.859 -24.098 331 1HG2 THR 48 3HG2 THR 48 -15.940 -16.696 -25.771 332 2HG2 THR 48 1HG2 THR 48 -17.644 -16.581 -26.273 333 3HG2 THR 48 2HG2 THR 48 -16.497 -15.294 -26.716 334 H ALA 49 H ALA 49 -15.972 -15.192 -21.503 335 HA ALA 49 HA ALA 49 -17.419 -12.912 -20.656 336 1HB ALA 49 2HB ALA 49 -15.897 -15.133 -19.255 337 2HB ALA 49 3HB ALA 49 -16.732 -13.837 -18.365 338 3HB ALA 49 1HB ALA 49 -17.659 -14.933 -19.417 339 H ALA 50 H ALA 50 -13.944 -13.891 -20.624 340 HA ALA 50 HA ALA 50 -13.161 -11.493 -19.275 341 1HB ALA 50 3HB ALA 50 -11.008 -12.425 -19.330 342 2HB ALA 50 1HB ALA 50 -12.057 -13.863 -19.303 343 3HB ALA 50 2HB ALA 50 -11.328 -13.322 -20.834 344 H GLN 51 H GLN 51 -12.958 -12.796 -22.653 345 HA GLN 51 HA GLN 51 -11.594 -10.780 -23.799 346 1HB GLN 51 1HB GLN 51 -12.100 -12.627 -25.173 347 2HB GLN 51 2HB GLN 51 -13.808 -12.584 -24.787 348 1HG GLN 51 1HG GLN 51 -12.779 -10.114 -26.100 349 2HG GLN 51 2HG GLN 51 -12.695 -11.553 -27.097 350 1HE2 GLN 51 1HE2 GLN 51 -14.611 -9.050 -25.982 351 2HE2 GLN 51 2HE2 GLN 51 -16.177 -9.615 -26.463 352 H ALA 52 H ALA 52 -15.212 -10.967 -23.451 353 HA ALA 52 HA ALA 52 -15.768 -8.491 -24.545 354 1HB ALA 52 3HB ALA 52 -17.105 -10.441 -22.720 355 2HB ALA 52 1HB ALA 52 -17.770 -8.790 -22.755 356 3HB ALA 52 2HB ALA 52 -17.668 -9.741 -24.257 357 H ALA 53 H ALA 53 -14.949 -9.440 -21.156 358 HA ALA 53 HA ALA 53 -15.346 -6.900 -20.051 359 1HB ALA 53 1HB ALA 53 -13.374 -9.016 -19.122 360 2HB ALA 53 3HB ALA 53 -15.132 -9.152 -18.878 361 3HB ALA 53 2HB ALA 53 -14.232 -7.809 -18.134 362 H VAL 54 H VAL 54 -12.648 -8.408 -21.833 363 HA VAL 54 HA VAL 54 -10.810 -6.323 -21.152 364 HB VAL 54 HB VAL 54 -10.642 -8.374 -23.363 365 1HG1 VAL 54 1HG1 VAL 54 -8.998 -6.297 -22.984 366 2HG1 VAL 54 2HG1 VAL 54 -8.273 -7.426 -21.815 367 3HG1 VAL 54 3HG1 VAL 54 -8.416 -7.888 -23.528 368 1HG2 VAL 54 3HG2 VAL 54 -10.838 -8.842 -20.557 369 2HG2 VAL 54 1HG2 VAL 54 -10.492 -10.009 -21.856 370 3HG2 VAL 54 2HG2 VAL 54 -9.155 -9.159 -21.045 371 H VAL 55 H VAL 55 -12.882 -7.217 -23.973 372 HA VAL 55 HA VAL 55 -11.983 -5.186 -25.658 373 HB VAL 55 HB VAL 55 -13.586 -7.322 -25.896 374 1HG1 VAL 55 2HG1 VAL 55 -15.450 -4.938 -25.699 375 2HG1 VAL 55 3HG1 VAL 55 -15.883 -6.465 -26.504 376 3HG1 VAL 55 1HG1 VAL 55 -15.505 -6.452 -24.765 377 1HG2 VAL 55 1HG2 VAL 55 -13.043 -4.935 -27.576 378 2HG2 VAL 55 2HG2 VAL 55 -12.773 -6.663 -27.908 379 3HG2 VAL 55 3HG2 VAL 55 -14.399 -5.964 -28.095 380 H ARG 56 H ARG 56 -14.821 -5.317 -23.397 381 HA ARG 56 HA ARG 56 -15.692 -2.774 -23.937 382 1HB ARG 56 1HB ARG 56 -15.926 -4.597 -21.514 383 2HB ARG 56 2HB ARG 56 -16.623 -2.990 -21.468 384 1HG ARG 56 1HG ARG 56 -18.294 -3.514 -22.972 385 2HG ARG 56 2HG ARG 56 -17.258 -4.554 -23.929 386 1HD ARG 56 1HD ARG 56 -17.369 -6.262 -22.012 387 2HD ARG 56 2HD ARG 56 -18.596 -5.251 -21.274 388 HE ARG 56 HE ARG 56 -18.884 -6.841 -23.755 389 2HH1 ARG 56 1HH ARG 56 -22.299 -6.234 -23.947 390 1HH2 ARG 56 2HH2 ARG 56 -20.304 -4.419 -21.594 391 2HH2 ARG 56 1HH2 ARG 56 -21.911 -4.636 -22.203 392 H PHE 57 H PHE 57 -13.344 -4.017 -21.482 393 HA PHE 57 HA PHE 57 -12.965 -1.584 -20.161 394 1HB PHE 57 1HB PHE 57 -12.117 -3.483 -19.032 395 2HB PHE 57 2HB PHE 57 -11.627 -4.265 -20.521 396 HD1 PHE 57 1HD PHE 57 -10.677 -1.629 -18.103 397 HD2 PHE 57 2HD PHE 57 -9.400 -4.119 -21.294 398 HE1 PHE 57 1HE PHE 57 -8.296 -0.963 -17.670 399 HE2 PHE 57 2HE PHE 57 -7.019 -3.453 -20.860 400 HZ PHE 57 HZ PHE 57 -6.496 -1.883 -19.053 401 H GLN 58 H GLN 58 -11.219 -3.153 -22.918 402 HA GLN 58 HA GLN 58 -9.165 -1.370 -23.100 403 1HB GLN 58 1HB GLN 58 -10.628 -2.978 -25.228 404 2HB GLN 58 2HB GLN 58 -9.199 -2.034 -25.598 405 1HG GLN 58 1HG GLN 58 -8.649 -3.575 -23.217 406 2HG GLN 58 2HG GLN 58 -9.346 -4.656 -24.407 407 1HE2 GLN 58 1HE2 GLN 58 -7.147 -5.565 -24.222 408 2HE2 GLN 58 2HE2 GLN 58 -5.902 -4.970 -25.269 409 H GLU 59 H GLU 59 -12.299 -1.309 -24.955 410 HA GLU 59 HA GLU 59 -11.866 1.037 -26.253 411 1HB GLU 59 1HB GLU 59 -14.449 -0.192 -25.208 412 2HB GLU 59 2HB GLU 59 -14.428 1.205 -26.265 413 1HG GLU 59 1HG GLU 59 -12.811 -1.194 -27.107 414 2HG GLU 59 2HG GLU 59 -14.555 -1.317 -27.222 415 HE2 GLU 59 HE GLU 59 -12.200 -0.025 -29.615 416 H ALA 60 H ALA 60 -12.922 0.462 -22.885 417 HA ALA 60 HA ALA 60 -13.603 3.203 -22.432 418 1HB ALA 60 1HB ALA 60 -13.161 0.819 -20.591 419 2HB ALA 60 2HB ALA 60 -13.763 2.407 -20.057 420 3HB ALA 60 3HB ALA 60 -14.719 1.430 -21.197 421 H ALA 61 H ALA 61 -10.712 1.163 -22.283 422 HA ALA 61 HA ALA 61 -9.205 2.704 -20.514 423 1HB ALA 61 2HB ALA 61 -8.777 0.353 -21.466 424 2HB ALA 61 3HB ALA 61 -8.122 1.177 -22.901 425 3HB ALA 61 1HB ALA 61 -7.365 1.425 -21.309 426 H ASN 62 H ASN 62 -9.446 2.778 -24.137 427 HA ASN 62 HA ASN 62 -7.659 4.819 -24.501 428 1HB ASN 62 1HB ASN 62 -10.205 4.371 -26.140 429 2HB ASN 62 2HB ASN 62 -8.717 5.102 -26.707 430 1HD2 ASN 62 1HD2 ASN 62 -10.319 2.161 -25.737 431 2HD2 ASN 62 2HD2 ASN 62 -9.181 1.028 -26.388 432 H LYS 63 H LYS 63 -11.263 4.843 -24.037 433 HA LYS 63 HA LYS 63 -11.708 7.537 -24.365 434 1HB LYS 63 1HB LYS 63 -13.313 5.494 -24.002 435 2HB LYS 63 2HB LYS 63 -13.209 5.936 -22.310 436 1HG LYS 63 1HG LYS 63 -14.949 7.339 -22.852 437 2HG LYS 63 2HG LYS 63 -13.655 8.408 -23.356 438 1HD LYS 63 1HD LYS 63 -15.308 8.269 -25.154 439 2HD LYS 63 2HD LYS 63 -13.827 7.502 -25.690 440 1HE LYS 63 1HE LYS 63 -14.878 5.506 -25.976 441 2HE LYS 63 2HE LYS 63 -15.506 5.537 -24.340 442 H GLN 64 H GLN 64 -10.441 5.718 -21.551 443 HA GLN 64 HA GLN 64 -10.600 7.949 -19.832 444 1HB GLN 64 1HB GLN 64 -9.424 5.188 -19.726 445 2HB GLN 64 2HB GLN 64 -8.792 6.363 -18.590 446 1HG GLN 64 1HG GLN 64 -11.630 6.693 -18.560 447 2HG GLN 64 2HG GLN 64 -11.346 4.964 -18.538 448 1HE2 GLN 64 1HE2 GLN 64 -10.026 7.954 -17.119 449 2HE2 GLN 64 2HE2 GLN 64 -9.817 7.359 -15.506 450 H LYS 65 H LYS 65 -8.083 6.497 -21.949 451 HA LYS 65 HA LYS 65 -5.935 8.014 -21.020 452 1HB LYS 65 1HB LYS 65 -6.552 6.271 -23.308 453 2HB LYS 65 2HB LYS 65 -5.387 7.526 -23.680 454 1HG LYS 65 1HG LYS 65 -4.121 5.650 -22.852 455 2HG LYS 65 2HG LYS 65 -4.102 6.856 -21.581 456 1HD LYS 65 1HD LYS 65 -4.674 4.967 -20.341 457 2HD LYS 65 2HD LYS 65 -6.272 5.577 -20.722 458 1HE LYS 65 1HE LYS 65 -6.392 3.263 -21.273 459 2HE LYS 65 2HE LYS 65 -6.194 4.057 -22.822 460 H GLN 66 H GLN 66 -8.630 8.742 -23.227 461 HA GLN 66 HA GLN 66 -7.413 11.057 -24.276 462 1HB GLN 66 1HB GLN 66 -9.564 9.517 -24.986 463 2HB GLN 66 2HB GLN 66 -10.392 10.872 -24.246 464 1HG GLN 66 1HG GLN 66 -10.103 11.337 -26.629 465 2HG GLN 66 2HG GLN 66 -9.104 12.449 -25.714 466 1HE2 GLN 66 1HE2 GLN 66 -8.141 12.541 -27.935 467 2HE2 GLN 66 2HE2 GLN 66 -6.824 11.475 -28.296 468 H GLU 67 H GLU 67 -10.028 10.482 -21.817 469 HA GLU 67 HA GLU 67 -10.373 13.147 -21.192 470 1HB GLU 67 1HB GLU 67 -10.965 10.531 -19.818 471 2HB GLU 67 2HB GLU 67 -11.138 12.007 -18.889 472 1HG GLU 67 1HG GLU 67 -12.521 11.375 -21.538 473 2HG GLU 67 2HG GLU 67 -13.283 11.421 -19.961 474 HE2 GLU 67 HE GLU 67 -13.955 12.943 -22.108 475 H LEU 68 H LEU 68 -7.843 10.858 -20.339 476 HA LEU 68 HA LEU 68 -6.974 12.225 -18.002 477 1HB LEU 68 1HB LEU 68 -6.357 9.828 -19.448 478 2HB LEU 68 2HB LEU 68 -4.873 10.711 -19.152 479 HG LEU 68 HG LEU 68 -5.243 10.695 -16.771 480 1HD1 LEU 68 1HD1 LEU 68 -7.944 9.511 -17.438 481 2HD1 LEU 68 2HD1 LEU 68 -7.221 9.456 -15.813 482 3HD1 LEU 68 3HD1 LEU 68 -7.585 11.024 -16.572 483 1HD2 LEU 68 2HD2 LEU 68 -5.713 7.974 -18.015 484 2HD2 LEU 68 3HD2 LEU 68 -4.148 8.741 -17.657 485 3HD2 LEU 68 1HD2 LEU 68 -5.225 8.254 -16.326 486 H ASP 69 H ASP 69 -5.673 11.987 -21.390 487 HA ASP 69 HA ASP 69 -3.702 13.871 -20.984 488 1HB ASP 69 1HB ASP 69 -4.398 12.198 -23.018 489 2HB ASP 69 2HB ASP 69 -5.019 13.697 -23.679 490 HD2 ASP 69 HD ASP 69 -2.733 15.473 -23.079 491 H GLU 70 H GLU 70 -7.013 14.110 -22.487 492 HA GLU 70 HA GLU 70 -6.983 16.724 -23.166 493 1HB GLU 70 1HB GLU 70 -9.256 16.480 -23.499 494 2HB GLU 70 2HB GLU 70 -8.822 14.790 -23.339 495 1HG GLU 70 1HG GLU 70 -9.420 14.838 -20.927 496 2HG GLU 70 2HG GLU 70 -9.790 16.548 -21.035 497 HE2 GLU 70 HE GLU 70 -12.519 16.638 -21.996 498 H ILE 71 H ILE 71 -7.858 15.277 -19.963 499 HA ILE 71 HA ILE 71 -8.441 17.778 -18.778 500 HB ILE 71 HB ILE 71 -7.907 15.016 -17.709 501 1HG1 ILE 71 1HG1 ILE 71 -10.433 16.688 -17.858 502 2HG1 ILE 71 2HG1 ILE 71 -10.006 15.399 -18.966 503 1HG2 ILE 71 3HG2 ILE 71 -7.312 17.166 -16.214 504 2HG2 ILE 71 1HG2 ILE 71 -9.061 17.067 -15.901 505 3HG2 ILE 71 2HG2 ILE 71 -8.013 15.672 -15.548 506 1HD1 ILE 71 3HD1 ILE 71 -10.065 14.870 -15.980 507 2HD1 ILE 71 1HD1 ILE 71 -11.566 14.843 -16.936 508 3HD1 ILE 71 2HD1 ILE 71 -10.245 13.715 -17.322 509 H SER 72 H SER 72 -5.525 15.675 -18.977 510 HA SER 72 HA SER 72 -4.016 17.160 -17.186 511 1HB SER 72 1HB SER 72 -2.985 15.147 -17.589 512 2HB SER 72 2HB SER 72 -3.530 15.076 -19.253 513 HG SER 72 HG SER 72 -1.464 16.894 -18.363 514 H THR 73 H THR 73 -4.944 17.668 -20.550 515 HA THR 73 HA THR 73 -2.882 19.697 -20.928 516 HB THR 73 HB THR 73 -4.898 18.223 -22.662 517 HG1 THR 73 1HG THR 73 -2.731 17.992 -23.780 518 1HG2 THR 73 1HG2 THR 73 -4.697 20.844 -23.162 519 2HG2 THR 73 2HG2 THR 73 -3.091 20.386 -23.776 520 3HG2 THR 73 3HG2 THR 73 -4.555 19.671 -24.493 521 H ASN 74 H ASN 74 -6.274 19.358 -20.054 522 HA ASN 74 HA ASN 74 -7.193 21.801 -20.862 523 1HB ASN 74 1HB ASN 74 -7.931 19.755 -18.838 524 2HB ASN 74 2HB ASN 74 -8.452 21.367 -18.391 525 1HD2 ASN 74 1HD2 ASN 74 -8.914 18.670 -20.436 526 2HD2 ASN 74 2HD2 ASN 74 -10.254 19.248 -21.367 527 H ILE 75 H ILE 75 -4.909 20.885 -18.352 528 HA ILE 75 HA ILE 75 -5.274 23.197 -16.721 529 HB ILE 75 HB ILE 75 -2.869 21.389 -16.794 530 1HG1 ILE 75 1HG1 ILE 75 -4.896 19.986 -16.804 531 2HG1 ILE 75 2HG1 ILE 75 -3.992 19.853 -15.308 532 1HG2 ILE 75 1HG2 ILE 75 -2.706 23.400 -15.405 533 2HG2 ILE 75 2HG2 ILE 75 -4.198 22.937 -14.552 534 3HG2 ILE 75 3HG2 ILE 75 -2.743 21.921 -14.415 535 1HD1 ILE 75 3HD1 ILE 75 -6.458 21.605 -15.729 536 2HD1 ILE 75 1HD1 ILE 75 -6.418 20.054 -14.856 537 3HD1 ILE 75 2HD1 ILE 75 -5.542 21.462 -14.209 538 H ARG 76 H ARG 76 -2.845 22.129 -19.192 539 HA ARG 76 HA ARG 76 -1.260 24.338 -19.038 540 1HB ARG 76 1HB ARG 76 -1.897 22.928 -21.666 541 2HB ARG 76 2HB ARG 76 -0.377 23.658 -21.188 542 1HG ARG 76 1HG ARG 76 -0.623 21.860 -19.163 543 2HG ARG 76 2HG ARG 76 -1.556 21.014 -20.381 544 1HD ARG 76 1HD ARG 76 0.916 22.086 -21.539 545 2HD ARG 76 2HD ARG 76 1.271 21.083 -20.146 546 HE ARG 76 HE ARG 76 0.083 20.198 -22.690 547 2HH1 ARG 76 1HH ARG 76 -0.016 16.859 -21.738 548 1HH2 ARG 76 2HH2 ARG 76 0.665 19.382 -19.292 549 2HH2 ARG 76 1HH2 ARG 76 0.475 17.678 -19.539 550 H GLN 77 H GLN 77 -4.477 23.931 -20.416 551 HA GLN 77 HA GLN 77 -4.298 26.181 -22.131 552 1HB GLN 77 1HB GLN 77 -6.542 24.374 -21.190 553 2HB GLN 77 2HB GLN 77 -6.907 25.832 -22.092 554 1HG GLN 77 1HG GLN 77 -4.730 24.449 -23.419 555 2HG GLN 77 2HG GLN 77 -6.015 23.298 -23.111 556 1HE2 GLN 77 1HE2 GLN 77 -6.168 23.268 -25.442 557 2HE2 GLN 77 2HE2 GLN 77 -7.134 24.443 -26.271 558 H ALA 78 H ALA 78 -5.090 25.574 -18.743 559 HA ALA 78 HA ALA 78 -6.628 27.875 -18.277 560 1HB ALA 78 3HB ALA 78 -4.837 26.708 -16.168 561 2HB ALA 78 1HB ALA 78 -6.545 27.198 -16.068 562 3HB ALA 78 2HB ALA 78 -6.102 25.672 -16.870 563 H GLY 79 H GLY 79 -3.235 27.361 -18.922 564 1HA GLY 79 2HA GLY 79 -2.712 30.177 -18.183 565 2HA GLY 79 1HA GLY 79 -1.999 29.339 -19.547 566 H VAL 80 H VAL 80 -1.908 26.811 -17.642 567 HA VAL 80 HA VAL 80 0.160 27.646 -15.799 568 HB VAL 80 HB VAL 80 -0.763 24.832 -16.309 569 1HG1 VAL 80 3HG1 VAL 80 0.867 26.209 -14.333 570 2HG1 VAL 80 1HG1 VAL 80 -0.483 25.335 -13.570 571 3HG1 VAL 80 2HG1 VAL 80 0.657 24.465 -14.623 572 1HG2 VAL 80 2HG2 VAL 80 -2.425 27.051 -15.466 573 2HG2 VAL 80 3HG2 VAL 80 -2.868 25.356 -15.781 574 3HG2 VAL 80 1HG2 VAL 80 -2.285 25.839 -14.170 575 H GLN 81 H GLN 81 1.894 28.301 -17.133 576 HA GLN 81 HA GLN 81 3.133 26.052 -18.503 577 1HB GLN 81 1HB GLN 81 3.768 27.428 -20.380 578 2HB GLN 81 2HB GLN 81 2.044 27.637 -20.145 579 1HG GLN 81 1HG GLN 81 2.319 29.796 -19.143 580 2HG GLN 81 2HG GLN 81 4.025 29.537 -18.839 581 1HE2 GLN 81 1HE2 GLN 81 5.508 29.543 -20.568 582 2HE2 GLN 81 2HE2 GLN 81 5.175 30.356 -22.060 583 H TYR 82 H TYR 82 3.272 28.087 -15.942 584 HA TYR 82 HA TYR 82 6.156 27.867 -15.797 585 1HB TYR 82 1HB TYR 82 6.368 30.307 -15.357 586 2HB TYR 82 2HB TYR 82 5.561 30.102 -16.899 587 HD1 TYR 82 1HD TYR 82 2.879 29.970 -16.710 588 HD2 TYR 82 2HD TYR 82 5.467 31.832 -13.857 589 HE1 TYR 82 1HE TYR 82 0.949 31.404 -15.884 590 HE2 TYR 82 2HE TYR 82 3.528 33.260 -13.041 591 HH TYR 82 HH TYR 82 1.299 34.109 -14.219 592 H SER 83 H SER 83 6.445 26.853 -13.877 593 HA SER 83 HA SER 83 4.992 27.952 -11.622 594 1HB SER 83 1HB SER 83 4.253 25.838 -10.823 595 2HB SER 83 2HB SER 83 3.867 25.824 -12.532 596 HG SER 83 HG SER 83 5.242 23.985 -11.266 597 H ARG 84 H ARG 84 7.412 25.405 -12.596 598 HA ARG 84 HA ARG 84 8.894 25.985 -10.216 599 1HB ARG 84 1HB ARG 84 8.991 23.893 -12.389 600 2HB ARG 84 2HB ARG 84 10.467 24.187 -11.493 601 1HG ARG 84 1HG ARG 84 9.539 23.473 -9.447 602 2HG ARG 84 2HG ARG 84 7.896 23.824 -9.946 603 1HD ARG 84 1HD ARG 84 9.273 21.758 -11.601 604 2HD ARG 84 2HD ARG 84 9.019 21.298 -9.930 605 HE ARG 84 HE ARG 84 6.644 22.477 -11.183 606 2HH1 ARG 84 1HH ARG 84 4.934 19.460 -11.375 607 1HH2 ARG 84 2HH2 ARG 84 8.433 19.470 -10.624 608 2HH2 ARG 84 1HH2 ARG 84 7.049 18.457 -10.862 609 H ALA 85 H ALA 85 8.563 27.877 -12.676 610 HA ALA 85 HA ALA 85 10.718 28.121 -14.246 611 1HB ALA 85 2HB ALA 85 10.254 30.510 -14.277 612 2HB ALA 85 1HB ALA 85 9.424 30.407 -12.706 613 3HB ALA 85 3HB ALA 85 8.715 29.625 -14.139 614 H ASP 86 H ASP 86 10.494 29.236 -10.802 615 HA ASP 86 HA ASP 86 13.135 30.161 -10.779 616 1HB ASP 86 1HB ASP 86 11.200 30.762 -9.186 617 2HB ASP 86 2HB ASP 86 11.481 29.226 -8.392 618 HD2 ASP 86 HD ASP 86 12.877 32.429 -7.389 619 H GLU 87 H GLU 87 11.460 27.222 -9.420 620 HA GLU 87 HA GLU 87 13.541 26.003 -8.244 621 1HB GLU 87 1HB GLU 87 10.944 25.321 -8.863 622 2HB GLU 87 2HB GLU 87 11.828 24.174 -9.851 623 1HG GLU 87 1HG GLU 87 13.224 23.648 -7.730 624 2HG GLU 87 2HG GLU 87 12.023 24.557 -6.835 625 HE2 GLU 87 HE GLU 87 10.528 22.787 -5.973 626 H GLU 88 H GLU 88 12.612 25.783 -11.744 627 HA GLU 88 HA GLU 88 14.339 23.968 -12.626 628 1HB GLU 88 1HB GLU 88 12.667 25.487 -13.912 629 2HB GLU 88 2HB GLU 88 14.002 26.608 -14.092 630 1HG GLU 88 1HG GLU 88 14.553 25.410 -15.950 631 2HG GLU 88 2HG GLU 88 15.186 24.210 -14.841 632 HE2 GLU 88 HE GLU 88 11.836 23.519 -16.866 633 H GLN 89 H GLN 89 15.122 27.504 -12.265 634 HA GLN 89 HA GLN 89 17.675 27.462 -13.078 635 1HB GLN 89 1HB GLN 89 16.007 29.168 -11.443 636 2HB GLN 89 2HB GLN 89 17.607 29.110 -10.730 637 1HG GLN 89 1HG GLN 89 18.658 29.932 -12.712 638 2HG GLN 89 2HG GLN 89 17.281 29.534 -13.720 639 1HE2 GLN 89 1HE2 GLN 89 18.527 31.675 -11.238 640 2HE2 GLN 89 2HE2 GLN 89 17.430 32.993 -11.480 641 H GLN 90 H GLN 90 16.445 26.612 -9.780 642 HA GLN 90 HA GLN 90 18.924 26.210 -8.641 643 1HB GLN 90 1HB GLN 90 16.169 25.860 -7.926 644 2HB GLN 90 2HB GLN 90 16.995 24.367 -7.525 645 1HG GLN 90 1HG GLN 90 18.835 26.069 -6.534 646 2HG GLN 90 2HG GLN 90 17.454 27.145 -6.443 647 1HE2 GLN 90 1HE2 GLN 90 15.581 26.486 -5.269 648 2HE2 GLN 90 2HE2 GLN 90 15.699 25.385 -3.937 649 H GLN 91 H GLN 91 16.685 23.911 -10.321 650 HA GLN 91 HA GLN 91 18.457 21.742 -9.949 651 1HB GLN 91 1HB GLN 91 15.774 22.173 -10.928 652 2HB GLN 91 2HB GLN 91 16.649 21.238 -12.124 653 1HG GLN 91 1HG GLN 91 17.170 19.497 -10.556 654 2HG GLN 91 2HG GLN 91 16.776 20.503 -9.176 655 1HE2 GLN 91 1HE2 GLN 91 15.262 19.202 -8.293 656 2HE2 GLN 91 2HE2 GLN 91 13.718 18.857 -8.998 657 H ALA 92 H ALA 92 18.627 24.489 -11.887 658 HA ALA 92 HA ALA 92 20.055 23.050 -14.013 659 1HB ALA 92 3HB ALA 92 19.770 25.405 -15.128 660 2HB ALA 92 2HB ALA 92 18.517 25.647 -13.887 661 3HB ALA 92 1HB ALA 92 18.372 24.306 -15.049 662 H LEU 93 H LEU 93 21.191 23.408 -11.371 663 HA LEU 93 HA LEU 93 22.713 25.668 -11.053 664 1HB LEU 93 1HB LEU 93 24.304 23.983 -9.879 665 2HB LEU 93 2HB LEU 93 22.712 24.320 -9.228 666 HG LEU 93 HG LEU 93 22.561 22.096 -11.067 667 1HD1 LEU 93 1HD1 LEU 93 24.942 22.170 -9.363 668 2HD1 LEU 93 2HD1 LEU 93 23.933 20.725 -9.113 669 3HD1 LEU 93 3HD1 LEU 93 24.541 21.115 -10.740 670 1HD2 LEU 93 2HD2 LEU 93 21.633 22.890 -8.425 671 2HD2 LEU 93 3HD2 LEU 93 20.876 21.830 -9.638 672 3HD2 LEU 93 1HD2 LEU 93 22.069 21.166 -8.496 673 H SER 94 H SER 94 24.728 22.837 -11.636 674 HA SER 94 HA SER 94 25.539 23.872 -14.197 675 1HB SER 94 1HB SER 94 27.024 25.149 -12.817 676 2HB SER 94 2HB SER 94 27.331 23.796 -11.747 677 HG SER 94 HG SER 94 28.773 22.942 -13.141 678 H SER 95 H SER 95 26.455 21.573 -11.523 679 HA SER 95 HA SER 95 27.680 19.679 -12.941 680 1HB SER 95 1HB SER 95 26.353 19.858 -10.402 681 2HB SER 95 2HB SER 95 25.866 18.340 -11.130 682 HG SER 95 HG SER 95 28.363 18.215 -11.608 683 H GLN 96 H GLN 96 24.169 19.302 -12.050 684 HA GLN 96 HA GLN 96 23.770 17.424 -14.086 685 1HB GLN 96 1HB GLN 96 22.467 17.781 -11.862 686 2HB GLN 96 2HB GLN 96 21.571 19.016 -12.723 687 1HG GLN 96 1HG GLN 96 21.783 16.530 -14.291 688 2HG GLN 96 2HG GLN 96 21.033 16.252 -12.731 689 1HE2 GLN 96 1HE2 GLN 96 20.643 17.381 -15.881 690 2HE2 GLN 96 2HE2 GLN 96 19.062 18.080 -15.758 691 H MET 97 H MET 97 24.206 20.771 -14.231 692 HA MET 97 HA MET 97 22.238 21.367 -16.170 693 1HB MET 97 1HB MET 97 23.650 22.906 -14.506 694 2HB MET 97 2HB MET 97 24.843 22.902 -15.789 695 1HG MET 97 1HG MET 97 22.079 23.456 -16.735 696 2HG MET 97 2HG MET 97 22.693 24.657 -15.616 697 1HE MET 97 1HE MET 97 22.031 24.158 -18.904 698 2HE MET 97 2HE MET 97 22.169 25.872 -18.442 699 3HE MET 97 3HE MET 97 23.173 25.222 -19.760 700 H GLY 98 H GLY 98 22.273 20.944 -18.337 701 1HA GLY 98 2HA GLY 98 24.615 21.118 -19.914 702 2HA GLY 98 1HA GLY 98 23.051 20.495 -20.401 703 H PHE 99 H PHE 99 26.281 19.677 -19.947 704 HA PHE 99 HA PHE 99 25.632 16.873 -20.146 705 1HB PHE 99 1HB PHE 99 27.682 18.758 -20.969 706 2HB PHE 99 2HB PHE 99 28.475 17.555 -19.973 707 HD1 PHE 99 1HD PHE 99 27.991 15.065 -20.584 708 HD2 PHE 99 2HD PHE 99 27.325 18.321 -23.222 709 HE1 PHE 99 1HE PHE 99 28.071 13.495 -22.541 710 HE2 PHE 99 2HE PHE 99 27.406 16.752 -25.179 711 HZ PHE 99 HZ PHE 99 27.778 14.358 -24.816 712 H MET 601 H MET 601 5.840 -20.538 -18.352 713 HA MET 601 HA MET 601 7.891 -19.537 -20.067 714 1HB MET 601 1HB MET 601 7.708 -20.997 -17.415 715 2HB MET 601 2HB MET 601 9.243 -21.037 -18.260 716 1HG MET 601 1HG MET 601 8.044 -18.325 -18.167 717 2HG MET 601 2HG MET 601 8.373 -18.984 -16.576 718 1HE MET 601 2HE MET 601 9.793 -17.755 -15.746 719 2HE MET 601 3HE MET 601 11.418 -18.480 -15.716 720 3HE MET 601 1HE MET 601 11.159 -16.907 -16.508 721 H THR 602 H THR 602 7.142 -22.846 -18.733 722 HA THR 602 HA THR 602 8.798 -24.345 -20.237 723 HB THR 602 HB THR 602 7.365 -25.295 -18.509 724 HG1 THR 602 1HG THR 602 7.916 -26.553 -20.529 725 1HG2 THR 602 2HG2 THR 602 5.128 -24.328 -20.337 726 2HG2 THR 602 3HG2 THR 602 4.873 -25.701 -19.234 727 3HG2 THR 602 1HG2 THR 602 5.293 -24.100 -18.580 728 H GLU 603 H GLU 603 5.811 -22.739 -21.360 729 HA GLU 603 HA GLU 603 6.635 -23.523 -24.039 730 1HB GLU 603 1HB GLU 603 3.800 -23.545 -22.919 731 2HB GLU 603 2HB GLU 603 4.162 -23.656 -24.630 732 1HG GLU 603 1HG GLU 603 5.523 -25.565 -22.713 733 2HG GLU 603 2HG GLU 603 3.857 -25.862 -23.170 734 HE2 GLU 603 HE GLU 603 3.788 -26.795 -25.680 735 H GLN 604 H GLN 604 7.251 -21.668 -25.058 736 HA GLN 604 HA GLN 604 6.612 -19.159 -24.118 737 1HB GLN 604 1HB GLN 604 7.447 -18.412 -26.432 738 2HB GLN 604 2HB GLN 604 8.554 -19.377 -25.476 739 1HG GLN 604 1HG GLN 604 6.910 -21.199 -26.985 740 2HG GLN 604 2HG GLN 604 7.463 -19.956 -28.090 741 1HE2 GLN 604 1HE2 GLN 604 8.919 -21.114 -29.207 742 2HE2 GLN 604 2HE2 GLN 604 10.378 -21.785 -28.557 743 H GLN 605 H GLN 605 4.687 -21.419 -25.865 744 HA GLN 605 HA GLN 605 3.231 -19.762 -27.504 745 1HB GLN 605 1HB GLN 605 2.340 -22.267 -26.008 746 2HB GLN 605 2HB GLN 605 1.463 -21.542 -27.341 747 1HG GLN 605 1HG GLN 605 4.187 -21.828 -28.201 748 2HG GLN 605 2HG GLN 605 3.739 -23.339 -27.435 749 1HE2 GLN 605 1HE2 GLN 605 1.720 -24.355 -28.095 750 2HE2 GLN 605 2HE2 GLN 605 1.190 -24.232 -29.740 751 H TRP 606 H TRP 606 2.728 -20.672 -24.037 752 HA TRP 606 HA TRP 606 1.267 -18.203 -23.664 753 1HB TRP 606 1HB TRP 606 -0.720 -19.139 -22.827 754 2HB TRP 606 2HB TRP 606 -0.439 -19.875 -24.393 755 HD1 TRP 606 HD TRP 606 0.481 -22.525 -24.309 756 HE1 TRP 606 1HE TRP 606 0.054 -24.497 -22.609 757 HE3 TRP 606 3HE TRP 606 -1.093 -19.578 -20.476 758 HZ2 TRP 606 2HZ TRP 606 -0.874 -24.601 -19.912 759 HZ3 TRP 606 3HZ TRP 606 -1.742 -20.694 -18.344 760 HH2 TRP 606 HH TRP 606 -1.651 -23.116 -18.027 761 H ASN 607 H ASN 607 3.165 -17.682 -22.404 762 HA ASN 607 HA ASN 607 4.399 -19.257 -20.614 763 1HB ASN 607 1HB ASN 607 3.754 -16.270 -20.446 764 2HB ASN 607 2HB ASN 607 4.866 -17.055 -19.342 765 1HD2 ASN 607 1HD2 ASN 607 5.662 -14.988 -20.938 766 2HD2 ASN 607 2HD2 ASN 607 6.779 -15.529 -22.146 767 H PHE 608 H PHE 608 3.216 -20.578 -19.175 768 HA PHE 608 HA PHE 608 0.780 -19.891 -18.045 769 1HB PHE 608 1HB PHE 608 1.515 -22.200 -18.096 770 2HB PHE 608 2HB PHE 608 3.086 -21.798 -17.432 771 HD1 PHE 608 1HD PHE 608 3.460 -21.794 -15.091 772 HD2 PHE 608 2HD PHE 608 -0.491 -22.177 -16.589 773 HE1 PHE 608 1HE PHE 608 2.651 -22.415 -12.797 774 HE2 PHE 608 2HE PHE 608 -1.301 -22.797 -14.296 775 HZ PHE 608 HZ PHE 608 0.280 -22.909 -12.427 776 H ALA 609 H ALA 609 4.155 -19.542 -16.803 777 HA ALA 609 HA ALA 609 3.401 -18.673 -14.241 778 1HB ALA 609 3HB ALA 609 5.868 -17.582 -14.632 779 2HB ALA 609 2HB ALA 609 5.852 -18.808 -15.922 780 3HB ALA 609 1HB ALA 609 5.596 -19.294 -14.229 781 H GLY 610 H GLY 610 3.052 -17.232 -17.332 782 1HA GLY 610 2HA GLY 610 3.088 -14.982 -17.962 783 2HA GLY 610 1HA GLY 610 3.217 -14.497 -16.283 784 H ILE 611 H ILE 611 0.941 -16.537 -18.269 785 HA ILE 611 HA ILE 611 -1.209 -14.774 -17.946 786 HB ILE 611 HB ILE 611 -0.926 -16.441 -19.750 787 1HG1 ILE 611 1HG1 ILE 611 -3.167 -15.366 -18.870 788 2HG1 ILE 611 2HG1 ILE 611 -3.171 -16.568 -20.145 789 1HG2 ILE 611 3HG2 ILE 611 -1.108 -18.310 -17.462 790 2HG2 ILE 611 1HG2 ILE 611 -2.027 -18.765 -18.917 791 3HG2 ILE 611 2HG2 ILE 611 -0.274 -18.474 -19.026 792 1HD1 ILE 611 3HD1 ILE 611 -3.264 -17.662 -17.367 793 2HD1 ILE 611 1HD1 ILE 611 -4.704 -16.759 -17.896 794 3HD1 ILE 611 2HD1 ILE 611 -4.151 -18.175 -18.822 795 H GLU 612 H GLU 612 0.236 -17.180 -15.849 796 HA GLU 612 HA GLU 612 -2.077 -17.685 -14.338 797 1HB GLU 612 1HB GLU 612 -0.263 -19.280 -14.289 798 2HB GLU 612 2HB GLU 612 0.893 -18.060 -13.792 799 1HG GLU 612 1HG GLU 612 -0.522 -17.750 -11.663 800 2HG GLU 612 2HG GLU 612 -1.424 -19.172 -12.149 801 HE2 GLU 612 HE GLU 612 -0.702 -20.319 -10.506 802 H ALA 613 H ALA 613 0.815 -15.543 -13.854 803 HA ALA 613 HA ALA 613 -0.369 -14.380 -11.506 804 1HB ALA 613 2HB ALA 613 1.706 -12.934 -11.646 805 2HB ALA 613 1HB ALA 613 2.154 -13.834 -13.115 806 3HB ALA 613 3HB ALA 613 2.021 -14.683 -11.556 807 H ALA 614 H ALA 614 -0.502 -13.935 -14.953 808 HA ALA 614 HA ALA 614 -0.735 -11.250 -15.286 809 1HB ALA 614 1HB ALA 614 -2.036 -13.658 -16.545 810 2HB ALA 614 2HB ALA 614 -2.551 -12.028 -17.040 811 3HB ALA 614 3HB ALA 614 -0.852 -12.521 -17.232 812 H ALA 615 H ALA 615 -3.346 -13.561 -14.272 813 HA ALA 615 HA ALA 615 -5.369 -11.697 -14.042 814 1HB ALA 615 3HB ALA 615 -6.514 -13.519 -13.361 815 2HB ALA 615 1HB ALA 615 -4.999 -14.423 -13.600 816 3HB ALA 615 2HB ALA 615 -5.415 -13.793 -11.988 817 H SER 616 H SER 616 -3.021 -12.872 -11.531 818 HA SER 616 HA SER 616 -3.960 -11.369 -9.469 819 1HB SER 616 1HB SER 616 -1.788 -13.057 -9.931 820 2HB SER 616 2HB SER 616 -1.009 -11.531 -9.565 821 HG SER 616 HG SER 616 -1.738 -13.153 -7.751 822 H ALA 617 H ALA 617 -2.047 -10.421 -12.303 823 HA ALA 617 HA ALA 617 -1.165 -7.939 -11.219 824 1HB ALA 617 1HB ALA 617 -0.473 -9.533 -13.351 825 2HB ALA 617 3HB ALA 617 0.038 -7.841 -13.141 826 3HB ALA 617 2HB ALA 617 -1.371 -8.226 -14.157 827 H ILE 618 H ILE 618 -3.916 -9.078 -13.248 828 HA ILE 618 HA ILE 618 -4.909 -6.584 -13.936 829 HB ILE 618 HB ILE 618 -6.321 -9.214 -13.482 830 1HG1 ILE 618 1HG1 ILE 618 -4.483 -9.243 -15.155 831 2HG1 ILE 618 2HG1 ILE 618 -6.062 -9.582 -15.835 832 1HG2 ILE 618 2HG2 ILE 618 -7.903 -7.343 -13.391 833 2HG2 ILE 618 3HG2 ILE 618 -7.295 -6.751 -14.956 834 3HG2 ILE 618 1HG2 ILE 618 -8.123 -8.323 -14.861 835 1HD1 ILE 618 1HD1 ILE 618 -5.461 -6.699 -15.845 836 2HD1 ILE 618 2HD1 ILE 618 -4.264 -7.650 -16.756 837 3HD1 ILE 618 3HD1 ILE 618 -5.990 -7.751 -17.180 838 H GLN 619 H GLN 619 -5.449 -8.626 -11.011 839 HA GLN 619 HA GLN 619 -7.417 -7.062 -9.901 840 1HB GLN 619 1HB GLN 619 -5.626 -9.217 -9.058 841 2HB GLN 619 2HB GLN 619 -5.887 -8.082 -7.749 842 1HG GLN 619 1HG GLN 619 -8.046 -9.525 -9.356 843 2HG GLN 619 2HG GLN 619 -7.622 -9.820 -7.681 844 1HE2 GLN 619 1HE2 GLN 619 -10.071 -8.830 -9.197 845 2HE2 GLN 619 2HE2 GLN 619 -10.605 -7.428 -8.330 846 H GLY 620 H GLY 620 -3.816 -6.923 -9.493 847 1HA GLY 620 2HA GLY 620 -2.466 -5.305 -8.713 848 2HA GLY 620 1HA GLY 620 -3.772 -4.800 -7.659 849 H ASN 621 H ASN 621 -3.903 -4.923 -11.256 850 HA ASN 621 HA ASN 621 -3.361 -2.176 -11.536 851 1HB ASN 621 1HB ASN 621 -4.613 -4.245 -13.413 852 2HB ASN 621 2HB ASN 621 -4.261 -2.603 -13.914 853 1HD2 ASN 621 1HD2 ASN 621 -1.992 -1.840 -13.373 854 2HD2 ASN 621 2HD2 ASN 621 -0.687 -2.926 -13.716 855 H VAL 622 H VAL 622 -6.265 -4.279 -11.278 856 HA VAL 622 HA VAL 622 -8.191 -2.458 -12.105 857 HB VAL 622 HB VAL 622 -8.191 -4.819 -10.237 858 1HG1 VAL 622 2HG1 VAL 622 -10.447 -2.932 -10.887 859 2HG1 VAL 622 3HG1 VAL 622 -10.771 -4.656 -10.587 860 3HG1 VAL 622 1HG1 VAL 622 -9.995 -3.664 -9.328 861 1HG2 VAL 622 3HG2 VAL 622 -8.142 -4.600 -13.008 862 2HG2 VAL 622 1HG2 VAL 622 -8.599 -6.041 -12.069 863 3HG2 VAL 622 2HG2 VAL 622 -9.854 -4.916 -12.638 864 H THR 623 H THR 623 -7.023 -3.228 -8.748 865 HA THR 623 HA THR 623 -8.533 -1.197 -7.527 866 HB THR 623 HB THR 623 -6.925 -1.685 -5.620 867 HG1 THR 623 1HG THR 623 -5.079 -2.830 -6.193 868 1HG2 THR 623 1HG2 THR 623 -8.872 -3.312 -6.310 869 2HG2 THR 623 2HG2 THR 623 -7.581 -4.306 -7.027 870 3HG2 THR 623 3HG2 THR 623 -7.574 -3.961 -5.281 871 H SER 624 H SER 624 -5.308 -1.219 -9.067 872 HA SER 624 HA SER 624 -4.325 1.092 -8.051 873 1HB SER 624 1HB SER 624 -3.579 -0.690 -10.019 874 2HB SER 624 2HB SER 624 -3.915 0.737 -10.979 875 HG SER 624 HG SER 624 -2.002 0.417 -8.849 876 H ILE 625 H ILE 625 -6.551 0.625 -10.873 877 HA ILE 625 HA ILE 625 -6.702 3.405 -11.432 878 HB ILE 625 HB ILE 625 -8.010 0.909 -12.388 879 1HG1 ILE 625 1HG1 ILE 625 -7.359 2.487 -14.544 880 2HG1 ILE 625 2HG1 ILE 625 -6.142 2.963 -13.376 881 1HG2 ILE 625 3HG2 ILE 625 -9.182 3.672 -12.660 882 2HG2 ILE 625 1HG2 ILE 625 -9.443 2.418 -13.896 883 3HG2 ILE 625 2HG2 ILE 625 -9.985 2.145 -12.223 884 1HD1 ILE 625 3HD1 ILE 625 -6.783 0.066 -14.098 885 2HD1 ILE 625 1HD1 ILE 625 -5.434 1.006 -14.779 886 3HD1 ILE 625 2HD1 ILE 625 -5.464 0.625 -13.041 887 H HIS 626 H HIS 626 -8.374 1.135 -9.284 888 HA HIS 626 HA HIS 626 -10.692 2.616 -8.889 889 1HB HIS 626 1HB HIS 626 -10.259 0.234 -8.224 890 2HB HIS 626 2HB HIS 626 -9.279 0.823 -6.896 891 HD1 HIS 626 1HD HIS 626 -11.104 -0.473 -5.379 892 HD2 HIS 626 2HD HIS 626 -12.462 2.946 -7.396 893 HE1 HIS 626 1HE HIS 626 -13.298 0.193 -4.259 894 H SER 627 H SER 627 -7.485 2.674 -7.220 895 HA SER 627 HA SER 627 -8.376 4.765 -5.502 896 1HB SER 627 1HB SER 627 -5.737 3.337 -5.948 897 2HB SER 627 2HB SER 627 -5.812 4.766 -4.937 898 HG SER 627 HG SER 627 -6.102 2.969 -3.588 899 H LEU 628 H LEU 628 -6.094 4.386 -8.295 900 HA LEU 628 HA LEU 628 -5.020 6.850 -8.446 901 1HB LEU 628 1HB LEU 628 -5.790 4.773 -10.410 902 2HB LEU 628 2HB LEU 628 -5.456 6.364 -11.063 903 HG LEU 628 HG LEU 628 -3.468 5.212 -9.154 904 1HD1 LEU 628 1HD1 LEU 628 -4.302 3.853 -11.581 905 2HD1 LEU 628 2HD1 LEU 628 -2.589 4.332 -11.648 906 3HD1 LEU 628 3HD1 LEU 628 -3.181 3.330 -10.301 907 1HD2 LEU 628 3HD2 LEU 628 -3.345 7.517 -10.221 908 2HD2 LEU 628 1HD2 LEU 628 -1.903 6.485 -10.373 909 3HD2 LEU 628 2HD2 LEU 628 -3.008 6.678 -11.754 910 H LEU 629 H LEU 629 -8.217 5.884 -9.876 911 HA LEU 629 HA LEU 629 -8.904 8.364 -10.844 912 1HB LEU 629 1HB LEU 629 -10.168 5.827 -10.319 913 2HB LEU 629 2HB LEU 629 -11.261 7.137 -9.920 914 HG LEU 629 HG LEU 629 -11.527 6.307 -12.231 915 1HD1 LEU 629 1HD1 LEU 629 -10.842 9.147 -11.617 916 2HD1 LEU 629 2HD1 LEU 629 -11.104 8.689 -13.317 917 3HD1 LEU 629 3HD1 LEU 629 -12.387 8.416 -12.115 918 1HD2 LEU 629 3HD2 LEU 629 -8.922 5.952 -12.397 919 2HD2 LEU 629 1HD2 LEU 629 -9.897 6.314 -13.841 920 3HD2 LEU 629 2HD2 LEU 629 -8.960 7.606 -13.053 921 H ASP 630 H ASP 630 -9.345 6.971 -7.543 922 HA ASP 630 HA ASP 630 -10.802 9.116 -6.568 923 1HB ASP 630 1HB ASP 630 -10.630 6.918 -5.431 924 2HB ASP 630 2HB ASP 630 -8.919 7.173 -5.150 925 HD2 ASP 630 HD ASP 630 -9.015 8.905 -2.529 926 H GLU 631 H GLU 631 -7.351 8.535 -7.157 927 HA GLU 631 HA GLU 631 -6.436 10.557 -5.408 928 1HB GLU 631 1HB GLU 631 -5.290 8.565 -7.221 929 2HB GLU 631 2HB GLU 631 -4.453 10.098 -7.372 930 1HG GLU 631 1HG GLU 631 -4.880 8.474 -4.828 931 2HG GLU 631 2HG GLU 631 -3.355 8.829 -5.615 932 HE2 GLU 631 HE GLU 631 -3.496 11.372 -6.078 933 H GLY 632 H GLY 632 -7.000 10.285 -8.973 934 1HA GLY 632 2HA GLY 632 -7.049 11.850 -10.597 935 2HA GLY 632 1HA GLY 632 -6.124 12.924 -9.566 936 H LYS 633 H LYS 633 -9.273 11.410 -8.702 937 HA LYS 633 HA LYS 633 -10.929 13.487 -9.479 938 1HB LYS 633 1HB LYS 633 -11.471 11.096 -8.668 939 2HB LYS 633 2HB LYS 633 -11.414 11.763 -7.049 940 1HG LYS 633 1HG LYS 633 -13.719 11.868 -7.799 941 2HG LYS 633 2HG LYS 633 -13.107 13.509 -7.754 942 1HD LYS 633 1HD LYS 633 -12.443 12.741 -10.338 943 2HD LYS 633 2HD LYS 633 -13.941 11.866 -10.088 944 1HE LYS 633 1HE LYS 633 -15.086 13.975 -9.422 945 2HE LYS 633 2HE LYS 633 -13.586 14.863 -9.601 946 H GLN 634 H GLN 634 -8.772 13.119 -6.675 947 HA GLN 634 HA GLN 634 -9.941 15.236 -5.232 948 1HB GLN 634 1HB GLN 634 -7.317 13.724 -5.034 949 2HB GLN 634 2HB GLN 634 -7.642 15.096 -3.993 950 1HG GLN 634 1HG GLN 634 -9.998 13.471 -3.933 951 2HG GLN 634 2HG GLN 634 -8.641 12.372 -3.780 952 1HE2 GLN 634 1HE2 GLN 634 -10.498 12.849 -1.765 953 2HE2 GLN 634 2HE2 GLN 634 -9.725 13.611 -0.415 954 H SER 635 H SER 635 -7.753 15.014 -7.943 955 HA SER 635 HA SER 635 -6.703 17.652 -7.439 956 1HB SER 635 1HB SER 635 -5.848 15.311 -8.916 957 2HB SER 635 2HB SER 635 -5.912 16.675 -10.015 958 HG SER 635 HG SER 635 -4.023 17.219 -9.174 959 H LEU 636 H LEU 636 -9.235 15.997 -9.202 960 HA LEU 636 HA LEU 636 -9.551 17.689 -11.377 961 1HB LEU 636 1HB LEU 636 -11.013 15.588 -10.028 962 2HB LEU 636 2HB LEU 636 -12.101 16.844 -10.586 963 HG LEU 636 HG LEU 636 -11.733 14.929 -12.173 964 1HD1 LEU 636 1HD1 LEU 636 -11.678 17.790 -12.742 965 2HD1 LEU 636 2HD1 LEU 636 -10.980 16.813 -14.057 966 3HD1 LEU 636 3HD1 LEU 636 -12.635 16.486 -13.486 967 1HD2 LEU 636 1HD2 LEU 636 -9.228 14.831 -11.654 968 2HD2 LEU 636 2HD2 LEU 636 -9.729 14.630 -13.350 969 3HD2 LEU 636 3HD2 LEU 636 -9.063 16.186 -12.797 970 H THR 637 H THR 637 -11.033 17.834 -8.069 971 HA THR 637 HA THR 637 -12.372 20.279 -8.603 972 HB THR 637 HB THR 637 -13.312 18.943 -6.884 973 HG1 THR 637 1HG THR 637 -12.949 20.333 -5.048 974 1HG2 THR 637 1HG2 THR 637 -10.424 18.465 -6.129 975 2HG2 THR 637 2HG2 THR 637 -11.645 18.423 -4.835 976 3HG2 THR 637 3HG2 THR 637 -11.770 17.303 -6.212 977 H LYS 638 H LYS 638 -9.067 19.466 -7.871 978 HA LYS 638 HA LYS 638 -8.517 22.095 -6.798 979 1HB LYS 638 1HB LYS 638 -6.816 19.648 -7.326 980 2HB LYS 638 2HB LYS 638 -6.141 21.175 -6.793 981 1HG LYS 638 1HG LYS 638 -7.869 21.093 -4.858 982 2HG LYS 638 2HG LYS 638 -8.160 19.429 -5.325 983 1HD LYS 638 1HD LYS 638 -5.486 20.620 -4.453 984 2HD LYS 638 2HD LYS 638 -6.477 19.508 -3.529 985 1HE LYS 638 1HE LYS 638 -6.188 17.776 -5.330 986 2HE LYS 638 2HE LYS 638 -5.165 18.887 -6.220 987 H LEU 639 H LEU 639 -8.389 20.299 -9.854 988 HA LEU 639 HA LEU 639 -6.872 22.457 -11.085 989 1HB LEU 639 1HB LEU 639 -7.704 19.702 -11.961 990 2HB LEU 639 2HB LEU 639 -7.088 20.883 -13.099 991 HG LEU 639 HG LEU 639 -5.090 19.988 -12.646 992 1HD1 LEU 639 3HD1 LEU 639 -4.906 22.182 -11.565 993 2HD1 LEU 639 1HD1 LEU 639 -5.391 21.458 -10.013 994 3HD1 LEU 639 2HD1 LEU 639 -3.863 20.970 -10.783 995 1HD2 LEU 639 1HD2 LEU 639 -6.492 18.252 -11.200 996 2HD2 LEU 639 2HD2 LEU 639 -4.712 18.279 -11.192 997 3HD2 LEU 639 3HD2 LEU 639 -5.620 19.047 -9.867 998 H ALA 640 H ALA 640 -10.094 21.614 -10.349 999 HA ALA 640 HA ALA 640 -11.568 22.165 -12.546 1000 1HB ALA 640 1HB ALA 640 -12.245 21.604 -10.110 1001 2HB ALA 640 3HB ALA 640 -13.326 22.664 -11.046 1002 3HB ALA 640 2HB ALA 640 -12.219 23.363 -9.841 1003 H ALA 641 H ALA 641 -9.965 24.535 -10.334 1004 HA ALA 641 HA ALA 641 -10.980 26.843 -11.450 1005 1HB ALA 641 3HB ALA 641 -9.525 27.839 -10.016 1006 2HB ALA 641 1HB ALA 641 -9.234 26.180 -9.440 1007 3HB ALA 641 2HB ALA 641 -8.133 26.915 -10.630 1008 H ALA 642 H ALA 642 -8.501 24.581 -12.623 1009 HA ALA 642 HA ALA 642 -7.241 26.254 -14.454 1010 1HB ALA 642 2HB ALA 642 -6.774 23.795 -13.591 1011 2HB ALA 642 1HB ALA 642 -6.238 24.300 -15.211 1012 3HB ALA 642 3HB ALA 642 -7.724 23.338 -15.025 1013 H TRP 643 H TRP 643 -10.446 24.813 -14.403 1014 HA TRP 643 HA TRP 643 -10.788 25.198 -17.261 1015 1HB TRP 643 1HB TRP 643 -12.446 23.980 -15.070 1016 2HB TRP 643 2HB TRP 643 -13.162 24.399 -16.613 1017 HD1 TRP 643 HD TRP 643 -12.617 22.772 -18.674 1018 HE1 TRP 643 1HE TRP 643 -11.407 20.449 -18.995 1019 HE3 TRP 643 3HE TRP 643 -10.432 22.682 -14.084 1020 HZ2 TRP 643 2HZ TRP 643 -9.710 18.870 -17.330 1021 HZ3 TRP 643 3HZ TRP 643 -9.015 20.714 -13.510 1022 HH2 TRP 643 HH TRP 643 -8.639 18.850 -15.047 1023 H GLY 644 H GLY 644 -10.646 27.130 -14.550 1024 1HA GLY 644 2HA GLY 644 -12.588 29.038 -15.698 1025 2HA GLY 644 1HA GLY 644 -11.110 29.461 -14.857 1026 H GLY 645 H GLY 645 -12.083 26.857 -13.110 1027 1HA GLY 645 2HA GLY 645 -14.080 28.292 -11.497 1028 2HA GLY 645 1HA GLY 645 -12.578 27.785 -10.749 1029 H SER 646 H SER 646 -14.584 26.666 -9.500 1030 HA SER 646 HA SER 646 -14.680 23.981 -10.620 1031 1HB SER 646 1HB SER 646 -15.330 23.423 -8.146 1032 2HB SER 646 2HB SER 646 -13.657 23.789 -8.520 1033 HG SER 646 HG SER 646 -14.681 24.919 -6.606 1034 H GLY 647 H GLY 647 -16.539 26.811 -9.765 1035 1HA GLY 647 2HA GLY 647 -18.808 27.017 -9.277 1036 2HA GLY 647 1HA GLY 647 -19.063 25.326 -9.658 1037 H SER 648 H SER 648 -17.242 25.745 -12.167 1038 HA SER 648 HA SER 648 -19.166 27.270 -13.727 1039 1HB SER 648 1HB SER 648 -16.228 26.746 -13.944 1040 2HB SER 648 2HB SER 648 -17.103 26.827 -15.460 1041 HG SER 648 HG SER 648 -16.746 28.944 -15.186 1042 H GLU 649 H GLU 649 -20.254 26.305 -15.491 1043 HA GLU 649 HA GLU 649 -20.745 23.625 -15.346 1044 1HB GLU 649 1HB GLU 649 -21.900 23.895 -17.499 1045 2HB GLU 649 2HB GLU 649 -22.215 25.277 -16.469 1046 1HG GLU 649 1HG GLU 649 -20.144 26.366 -17.679 1047 2HG GLU 649 2HG GLU 649 -20.377 25.111 -18.880 1048 HE2 GLU 649 HE GLU 649 -21.880 27.913 -17.497 1049 H ALA 650 H ALA 650 -18.146 25.382 -16.985 1050 HA ALA 650 HA ALA 650 -17.410 23.528 -18.896 1051 1HB ALA 650 2HB ALA 650 -16.300 25.868 -17.552 1052 2HB ALA 650 1HB ALA 650 -16.051 25.294 -19.218 1053 3HB ALA 650 3HB ALA 650 -15.040 24.660 -17.898 1054 H TYR 651 H TYR 651 -15.795 23.966 -15.664 1055 HA TYR 651 HA TYR 651 -14.384 21.611 -15.718 1056 1HB TYR 651 1HB TYR 651 -13.916 23.229 -14.001 1057 2HB TYR 651 2HB TYR 651 -15.616 23.485 -13.658 1058 HD1 TYR 651 1HD TYR 651 -12.943 20.879 -13.339 1059 HD2 TYR 651 2HD TYR 651 -16.579 22.498 -11.770 1060 HE1 TYR 651 1HE TYR 651 -12.782 19.319 -11.338 1061 HE2 TYR 651 2HE TYR 651 -16.406 20.932 -9.774 1062 HH TYR 651 HH TYR 651 -14.751 19.720 -8.578 1063 H GLN 652 H GLN 652 -17.805 22.202 -14.858 1064 HA GLN 652 HA GLN 652 -18.281 19.871 -13.501 1065 1HB GLN 652 1HB GLN 652 -20.011 21.676 -15.211 1066 2HB GLN 652 2HB GLN 652 -20.688 20.219 -14.512 1067 1HG GLN 652 1HG GLN 652 -19.198 21.523 -12.432 1068 2HG GLN 652 2HG GLN 652 -20.152 22.761 -13.225 1069 1HE2 GLN 652 1HE2 GLN 652 -21.047 22.658 -10.954 1070 2HE2 GLN 652 2HE2 GLN 652 -22.423 21.641 -10.682 1071 H GLY 653 H GLY 653 -18.652 20.565 -17.049 1072 1HA GLY 653 2HA GLY 653 -18.657 19.204 -18.836 1073 2HA GLY 653 1HA GLY 653 -19.501 18.037 -17.837 1074 H VAL 654 H VAL 654 -16.315 19.205 -16.817 1075 HA VAL 654 HA VAL 654 -14.907 17.053 -18.092 1076 HB VAL 654 HB VAL 654 -14.172 19.238 -16.149 1077 1HG1 VAL 654 2HG1 VAL 654 -12.837 17.186 -15.674 1078 2HG1 VAL 654 3HG1 VAL 654 -12.276 17.201 -17.364 1079 3HG1 VAL 654 1HG1 VAL 654 -11.857 18.546 -16.275 1080 1HG2 VAL 654 2HG2 VAL 654 -14.519 19.270 -18.890 1081 2HG2 VAL 654 3HG2 VAL 654 -13.557 20.434 -17.948 1082 3HG2 VAL 654 1HG2 VAL 654 -12.762 19.039 -18.716 1083 H GLN 655 H GLN 655 -16.057 17.915 -14.779 1084 HA GLN 655 HA GLN 655 -14.872 15.882 -13.419 1085 1HB GLN 655 1HB GLN 655 -17.097 17.730 -13.015 1086 2HB GLN 655 2HB GLN 655 -17.447 16.182 -12.272 1087 1HG GLN 655 1HG GLN 655 -14.666 17.137 -11.818 1088 2HG GLN 655 2HG GLN 655 -15.896 18.180 -11.131 1089 1HE2 GLN 655 1HE2 GLN 655 -14.602 17.315 -9.221 1090 2HE2 GLN 655 2HE2 GLN 655 -15.232 15.920 -8.411 1091 H GLN 656 H GLN 656 -18.102 15.887 -15.076 1092 HA GLN 656 HA GLN 656 -18.663 13.239 -14.408 1093 1HB GLN 656 1HB GLN 656 -20.564 13.470 -15.816 1094 2HB GLN 656 2HB GLN 656 -20.278 15.083 -15.193 1095 1HG GLN 656 1HG GLN 656 -18.798 15.381 -17.372 1096 2HG GLN 656 2HG GLN 656 -19.699 14.000 -17.965 1097 1HE2 GLN 656 1HE2 GLN 656 -20.486 16.849 -15.970 1098 2HE2 GLN 656 2HE2 GLN 656 -21.833 17.406 -16.906 1099 H LYS 657 H LYS 657 -16.906 14.789 -17.104 1100 HA LYS 657 HA LYS 657 -16.840 12.488 -18.746 1101 1HB LYS 657 1HB LYS 657 -15.361 15.111 -18.673 1102 2HB LYS 657 2HB LYS 657 -14.856 13.839 -19.767 1103 1HG LYS 657 1HG LYS 657 -17.057 13.771 -20.827 1104 2HG LYS 657 2HG LYS 657 -17.735 14.838 -19.614 1105 1HD LYS 657 1HD LYS 657 -15.745 16.458 -20.452 1106 2HD LYS 657 2HD LYS 657 -15.894 15.494 -21.908 1107 1HE LYS 657 1HE LYS 657 -18.084 16.225 -22.345 1108 2HE LYS 657 2HE LYS 657 -18.428 16.558 -20.659 1109 H TRP 658 H TRP 658 -15.004 13.625 -15.944 1110 HA TRP 658 HA TRP 658 -12.779 11.898 -16.406 1111 1HB TRP 658 1HB TRP 658 -12.276 13.795 -15.170 1112 2HB TRP 658 2HB TRP 658 -13.707 13.662 -14.167 1113 HD1 TRP 658 HD TRP 658 -13.567 11.887 -12.079 1114 HE1 TRP 658 1HE TRP 658 -11.580 10.786 -10.736 1115 HE3 TRP 658 3HE TRP 658 -9.970 12.928 -15.519 1116 HZ2 TRP 658 2HZ TRP 658 -8.790 10.481 -11.251 1117 HZ3 TRP 658 3HZ TRP 658 -7.640 12.194 -15.021 1118 HH2 TRP 658 HH TRP 658 -7.026 11.010 -12.974 1119 H ASP 659 H ASP 659 -15.578 11.949 -14.075 1120 HA ASP 659 HA ASP 659 -15.019 9.418 -13.075 1121 1HB ASP 659 1HB ASP 659 -16.573 11.343 -12.187 1122 2HB ASP 659 2HB ASP 659 -17.803 10.632 -13.213 1123 HD2 ASP 659 HD ASP 659 -17.330 9.923 -9.719 1124 H ALA 660 H ALA 660 -16.628 10.625 -15.974 1125 HA ALA 660 HA ALA 660 -18.410 8.594 -16.532 1126 1HB ALA 660 1HB ALA 660 -18.580 10.420 -17.944 1127 2HB ALA 660 2HB ALA 660 -16.817 10.588 -18.118 1128 3HB ALA 660 3HB ALA 660 -17.679 9.300 -18.993 1129 H THR 661 H THR 661 -15.444 8.844 -18.539 1130 HA THR 661 HA THR 661 -15.326 6.157 -19.128 1131 HB THR 661 HB THR 661 -13.065 6.725 -19.947 1132 HG1 THR 661 1HG THR 661 -12.252 8.865 -19.167 1133 1HG2 THR 661 1HG2 THR 661 -15.218 7.977 -20.919 1134 2HG2 THR 661 2HG2 THR 661 -14.494 9.392 -20.117 1135 3HG2 THR 661 3HG2 THR 661 -13.589 8.525 -21.381 1136 H ALA 662 H ALA 662 -14.266 7.855 -16.213 1137 HA ALA 662 HA ALA 662 -12.420 6.055 -15.250 1138 1HB ALA 662 3HB ALA 662 -12.754 8.158 -14.161 1139 2HB ALA 662 1HB ALA 662 -14.481 7.825 -13.890 1140 3HB ALA 662 2HB ALA 662 -13.247 6.912 -12.989 1141 H THR 663 H THR 663 -15.676 6.188 -13.721 1142 HA THR 663 HA THR 663 -15.699 3.659 -12.746 1143 HB THR 663 HB THR 663 -17.402 5.243 -12.109 1144 HG1 THR 663 1HG THR 663 -19.325 3.931 -12.798 1145 1HG2 THR 663 3HG2 THR 663 -17.478 5.846 -14.936 1146 2HG2 THR 663 1HG2 THR 663 -19.098 5.291 -14.447 1147 3HG2 THR 663 2HG2 THR 663 -18.343 6.674 -13.619 1148 H GLU 664 H GLU 664 -16.333 4.669 -16.108 1149 HA GLU 664 HA GLU 664 -17.522 2.368 -16.984 1150 1HB GLU 664 1HB GLU 664 -17.406 4.352 -18.379 1151 2HB GLU 664 2HB GLU 664 -15.654 4.313 -18.398 1152 1HG GLU 664 1HG GLU 664 -16.528 3.405 -20.512 1153 2HG GLU 664 2HG GLU 664 -15.700 2.143 -19.624 1154 HE2 GLU 664 HE GLU 664 -18.372 0.136 -19.808 1155 H LEU 665 H LEU 665 -13.999 3.211 -16.811 1156 HA LEU 665 HA LEU 665 -13.244 0.613 -17.750 1157 1HB LEU 665 1HB LEU 665 -12.009 2.739 -18.197 1158 2HB LEU 665 2HB LEU 665 -11.555 2.785 -16.505 1159 HG LEU 665 HG LEU 665 -10.693 0.293 -17.143 1160 1HD1 LEU 665 2HD1 LEU 665 -11.017 1.738 -19.688 1161 2HD1 LEU 665 3HD1 LEU 665 -9.403 1.032 -19.433 1162 3HD1 LEU 665 1HD1 LEU 665 -10.849 -0.003 -19.360 1163 1HD2 LEU 665 2HD2 LEU 665 -9.547 2.863 -16.627 1164 2HD2 LEU 665 3HD2 LEU 665 -8.879 1.245 -16.301 1165 3HD2 LEU 665 1HD2 LEU 665 -8.574 2.035 -17.867 1166 H ASN 666 H ASN 666 -13.778 2.248 -14.638 1167 HA ASN 666 HA ASN 666 -12.354 0.537 -13.036 1168 1HB ASN 666 1HB ASN 666 -13.926 2.745 -12.618 1169 2HB ASN 666 2HB ASN 666 -15.021 1.507 -12.035 1170 1HD2 ASN 666 1HD2 ASN 666 -13.491 3.652 -10.676 1171 2HD2 ASN 666 2HD2 ASN 666 -12.590 2.889 -9.409 1172 H ASN 667 H ASN 667 -15.707 0.395 -14.376 1173 HA ASN 667 HA ASN 667 -16.423 -1.897 -12.917 1174 1HB ASN 667 1HB ASN 667 -17.563 -0.611 -15.450 1175 2HB ASN 667 2HB ASN 667 -18.316 -1.986 -14.667 1176 1HD2 ASN 667 1HD2 ASN 667 -18.436 1.239 -14.969 1177 2HD2 ASN 667 2HD2 ASN 667 -19.146 1.715 -13.462 1178 H ALA 668 H ALA 668 -15.206 -1.181 -16.250 1179 HA ALA 668 HA ALA 668 -15.443 -3.764 -17.281 1180 1HB ALA 668 3HB ALA 668 -14.850 -1.351 -18.301 1181 2HB ALA 668 1HB ALA 668 -13.195 -1.986 -18.146 1182 3HB ALA 668 2HB ALA 668 -14.397 -2.864 -19.121 1183 H LEU 669 H LEU 669 -12.720 -2.069 -15.596 1184 HA LEU 669 HA LEU 669 -10.899 -4.160 -15.812 1185 1HB LEU 669 1HB LEU 669 -11.182 -1.653 -14.329 1186 2HB LEU 669 2HB LEU 669 -10.272 -2.871 -13.458 1187 HG LEU 669 HG LEU 669 -9.571 -2.315 -16.321 1188 1HD1 LEU 669 1HD1 LEU 669 -9.792 -0.097 -15.245 1189 2HD1 LEU 669 2HD1 LEU 669 -8.615 -0.604 -14.010 1190 3HD1 LEU 669 3HD1 LEU 669 -8.119 -0.483 -15.716 1191 1HD2 LEU 669 2HD2 LEU 669 -8.572 -4.182 -14.897 1192 2HD2 LEU 669 3HD2 LEU 669 -7.435 -3.099 -15.734 1193 3HD2 LEU 669 1HD2 LEU 669 -7.740 -2.894 -13.993 1194 H GLN 670 H GLN 670 -13.391 -3.397 -13.313 1195 HA GLN 670 HA GLN 670 -12.658 -5.426 -11.584 1196 1HB GLN 670 1HB GLN 670 -14.993 -3.637 -11.983 1197 2HB GLN 670 2HB GLN 670 -15.385 -5.146 -11.184 1198 1HG GLN 670 1HG GLN 670 -12.926 -4.174 -10.036 1199 2HG GLN 670 2HG GLN 670 -14.049 -2.830 -10.088 1200 1HE2 GLN 670 1HE2 GLN 670 -13.361 -3.594 -7.689 1201 2HE2 GLN 670 2HE2 GLN 670 -14.593 -4.491 -6.867 1202 H ASN 671 H ASN 671 -15.219 -5.335 -14.162 1203 HA ASN 671 HA ASN 671 -16.047 -7.938 -13.775 1204 1HB ASN 671 1HB ASN 671 -17.117 -6.023 -15.190 1205 2HB ASN 671 2HB ASN 671 -16.020 -6.501 -16.471 1206 1HD2 ASN 671 1HD2 ASN 671 -15.973 -8.900 -16.941 1207 2HD2 ASN 671 2HD2 ASN 671 -17.493 -9.727 -17.027 1208 H LEU 672 H LEU 672 -13.277 -6.482 -15.442 1209 HA LEU 672 HA LEU 672 -12.707 -8.713 -17.109 1210 1HB LEU 672 1HB LEU 672 -11.955 -6.636 -17.860 1211 2HB LEU 672 2HB LEU 672 -11.265 -6.207 -16.307 1212 HG LEU 672 HG LEU 672 -9.971 -8.583 -17.318 1213 1HD1 LEU 672 1HD1 LEU 672 -10.849 -7.238 -19.460 1214 2HD1 LEU 672 2HD1 LEU 672 -9.356 -6.320 -19.146 1215 3HD1 LEU 672 3HD1 LEU 672 -9.280 -8.078 -19.417 1216 1HD2 LEU 672 3HD2 LEU 672 -9.253 -6.705 -15.643 1217 2HD2 LEU 672 1HD2 LEU 672 -8.041 -7.505 -16.672 1218 3HD2 LEU 672 2HD2 LEU 672 -8.658 -5.894 -17.112 1219 H ALA 673 H ALA 673 -11.462 -7.485 -13.940 1220 HA ALA 673 HA ALA 673 -9.638 -9.635 -13.643 1221 1HB ALA 673 1HB ALA 673 -10.217 -7.163 -12.401 1222 2HB ALA 673 2HB ALA 673 -10.466 -8.403 -11.148 1223 3HB ALA 673 3HB ALA 673 -8.904 -8.294 -11.995 1224 H ARG 674 H ARG 674 -13.082 -9.252 -13.244 1225 HA ARG 674 HA ARG 674 -13.385 -11.171 -11.225 1226 1HB ARG 674 1HB ARG 674 -15.198 -9.775 -13.198 1227 2HB ARG 674 2HB ARG 674 -15.823 -11.201 -12.394 1228 1HG ARG 674 1HG ARG 674 -14.645 -9.787 -10.289 1229 2HG ARG 674 2HG ARG 674 -15.289 -8.504 -11.295 1230 1HD ARG 674 1HD ARG 674 -16.873 -10.901 -10.247 1231 2HD ARG 674 2HD ARG 674 -16.969 -9.267 -9.623 1232 HE ARG 674 HE ARG 674 -18.067 -8.559 -11.654 1233 2HH1 ARG 674 1HH ARG 674 -19.748 -10.623 -13.886 1234 1HH2 ARG 674 2HH2 ARG 674 -17.381 -12.035 -11.602 1235 2HH2 ARG 674 1HH2 ARG 674 -18.493 -12.400 -12.879 1236 H THR 675 H THR 675 -13.118 -11.236 -14.775 1237 HA THR 675 HA THR 675 -13.691 -14.121 -14.754 1238 HB THR 675 HB THR 675 -13.555 -12.180 -17.116 1239 HG1 THR 675 1HG THR 675 -15.190 -11.762 -15.330 1240 1HG2 THR 675 1HG2 THR 675 -13.574 -14.873 -17.286 1241 2HG2 THR 675 2HG2 THR 675 -15.303 -14.637 -16.932 1242 3HG2 THR 675 3HG2 THR 675 -14.577 -13.879 -18.370 1243 H ILE 676 H ILE 676 -11.143 -11.889 -14.630 1244 HA ILE 676 HA ILE 676 -9.373 -13.629 -16.163 1245 HB ILE 676 HB ILE 676 -9.228 -10.815 -15.149 1246 1HG1 ILE 676 1HG1 ILE 676 -8.978 -12.186 -17.827 1247 2HG1 ILE 676 2HG1 ILE 676 -10.156 -10.993 -17.316 1248 1HG2 ILE 676 1HG2 ILE 676 -7.012 -12.681 -15.219 1249 2HG2 ILE 676 2HG2 ILE 676 -6.763 -11.338 -16.361 1250 3HG2 ILE 676 3HG2 ILE 676 -7.073 -10.998 -14.641 1251 1HD1 ILE 676 3HD1 ILE 676 -7.973 -9.492 -16.910 1252 2HD1 ILE 676 1HD1 ILE 676 -7.278 -10.607 -18.111 1253 3HD1 ILE 676 2HD1 ILE 676 -8.708 -9.632 -18.525 1254 H SER 677 H SER 677 -9.654 -12.081 -12.891 1255 HA SER 677 HA SER 677 -7.528 -13.167 -11.699 1256 1HB SER 677 1HB SER 677 -9.144 -11.618 -10.620 1257 2HB SER 677 2HB SER 677 -10.328 -12.905 -10.514 1258 HG SER 677 HG SER 677 -9.175 -13.919 -8.923 1259 H GLU 678 H GLU 678 -10.468 -14.817 -12.783 1260 HA GLU 678 HA GLU 678 -10.212 -17.083 -11.183 1261 1HB GLU 678 1HB GLU 678 -11.574 -18.092 -13.241 1262 2HB GLU 678 2HB GLU 678 -12.316 -16.949 -12.139 1263 1HG GLU 678 1HG GLU 678 -12.301 -15.217 -13.687 1264 2HG GLU 678 2HG GLU 678 -10.820 -15.761 -14.450 1265 HE2 GLU 678 HE GLU 678 -11.758 -16.153 -16.722 1266 H ALA 679 H ALA 679 -8.468 -15.937 -13.991 1267 HA ALA 679 HA ALA 679 -7.690 -18.278 -15.202 1268 1HB ALA 679 1HB ALA 679 -6.131 -15.706 -14.724 1269 2HB ALA 679 2HB ALA 679 -5.708 -16.954 -15.921 1270 3HB ALA 679 3HB ALA 679 -7.228 -16.042 -16.085 1271 H GLY 680 H GLY 680 -6.841 -16.948 -12.045 1272 1HA GLY 680 2HA GLY 680 -5.660 -17.822 -10.342 1273 2HA GLY 680 1HA GLY 680 -4.402 -18.109 -11.527 1274 H GLN 681 H GLN 681 -7.306 -19.513 -9.952 1275 HA GLN 681 HA GLN 681 -6.314 -22.124 -10.798 1276 1HB GLN 681 1HB GLN 681 -7.148 -21.095 -8.107 1277 2HB GLN 681 2HB GLN 681 -7.604 -22.742 -8.494 1278 1HG GLN 681 1HG GLN 681 -5.403 -23.494 -8.561 1279 2HG GLN 681 2HG GLN 681 -4.777 -21.960 -9.133 1280 1HE2 GLN 681 1HE2 GLN 681 -3.242 -22.831 -7.357 1281 2HE2 GLN 681 2HE2 GLN 681 -3.470 -22.179 -5.768 1282 H ALA 682 H ALA 682 -9.103 -19.998 -10.098 1283 HA ALA 682 HA ALA 682 -11.223 -21.632 -10.238 1284 1HB ALA 682 3HB ALA 682 -10.786 -18.953 -11.615 1285 2HB ALA 682 1HB ALA 682 -12.379 -19.718 -11.397 1286 3HB ALA 682 2HB ALA 682 -11.423 -19.231 -9.976 1287 H MET 683 H MET 683 -9.639 -20.179 -13.177 1288 HA MET 683 HA MET 683 -11.037 -21.362 -15.089 1289 1HB MET 683 1HB MET 683 -8.620 -20.010 -14.912 1290 2HB MET 683 2HB MET 683 -8.067 -21.579 -15.462 1291 1HG MET 683 1HG MET 683 -10.104 -19.765 -16.831 1292 2HG MET 683 2HG MET 683 -8.521 -20.219 -17.431 1293 1HE MET 683 1HE MET 683 -11.947 -20.576 -17.279 1294 2HE MET 683 2HE MET 683 -11.824 -21.097 -18.976 1295 3HE MET 683 3HE MET 683 -12.453 -22.218 -17.744 1296 H ALA 684 H ALA 684 -8.786 -22.969 -12.869 1297 HA ALA 684 HA ALA 684 -8.471 -25.331 -14.396 1298 1HB ALA 684 3HB ALA 684 -7.092 -25.932 -12.686 1299 2HB ALA 684 2HB ALA 684 -8.272 -25.471 -11.436 1300 3HB ALA 684 1HB ALA 684 -7.263 -24.226 -12.210 1301 H SER 685 H SER 685 -10.692 -24.289 -11.740 1302 HA SER 685 HA SER 685 -11.914 -26.544 -11.111 1303 1HB SER 685 1HB SER 685 -13.073 -23.789 -11.633 1304 2HB SER 685 2HB SER 685 -14.096 -25.090 -11.056 1305 HG SER 685 HG SER 685 -11.699 -24.105 -9.756 1306 H THR 686 H THR 686 -13.933 -24.539 -13.284 1307 HA THR 686 HA THR 686 -13.822 -26.142 -15.562 1308 HB THR 686 HB THR 686 -15.653 -27.059 -13.345 1309 HG1 THR 686 1HG THR 686 -14.166 -28.620 -13.893 1310 1HG2 THR 686 1HG2 THR 686 -17.145 -26.331 -15.330 1311 2HG2 THR 686 2HG2 THR 686 -16.263 -27.533 -16.301 1312 3HG2 THR 686 3HG2 THR 686 -17.224 -28.055 -14.897 1313 H GLU 687 H GLU 687 -14.032 -24.384 -16.836 1314 HA GLU 687 HA GLU 687 -15.151 -22.095 -16.494 1315 1HB GLU 687 1HB GLU 687 -15.682 -21.976 -18.884 1316 2HB GLU 687 2HB GLU 687 -14.205 -22.890 -18.652 1317 1HG GLU 687 1HG GLU 687 -15.157 -24.558 -19.861 1318 2HG GLU 687 2HG GLU 687 -16.211 -24.852 -18.492 1319 HE2 GLU 687 HE GLU 687 -18.458 -23.170 -18.829 1320 H GLY 688 H GLY 688 -17.075 -21.178 -15.889 1321 1HA GLY 688 2HA GLY 688 -19.569 -22.570 -16.511 1322 2HA GLY 688 1HA GLY 688 -19.378 -20.921 -15.952 1323 H ASN 689 H ASN 689 -17.741 -23.767 -14.493 1324 HA ASN 689 HA ASN 689 -19.572 -23.539 -12.248 1325 1HB ASN 689 1HB ASN 689 -18.632 -25.784 -13.626 1326 2HB ASN 689 2HB ASN 689 -17.576 -25.749 -12.228 1327 1HD2 ASN 689 1HD2 ASN 689 -18.265 -27.091 -10.756 1328 2HD2 ASN 689 2HD2 ASN 689 -19.896 -27.321 -10.220 1329 H VAL 690 H VAL 690 -16.867 -22.063 -13.216 1330 HA VAL 690 HA VAL 690 -15.040 -22.661 -11.104 1331 HB VAL 690 HB VAL 690 -13.673 -21.011 -12.085 1332 1HG1 VAL 690 3HG1 VAL 690 -15.209 -22.761 -13.945 1333 2HG1 VAL 690 1HG1 VAL 690 -14.170 -21.513 -14.676 1334 3HG1 VAL 690 2HG1 VAL 690 -13.468 -22.723 -13.576 1335 1HG2 VAL 690 2HG2 VAL 690 -16.204 -19.740 -12.756 1336 2HG2 VAL 690 3HG2 VAL 690 -14.575 -19.036 -12.616 1337 3HG2 VAL 690 1HG2 VAL 690 -15.097 -19.777 -14.149 1338 H THR 691 H THR 691 -14.757 -21.626 -9.147 1339 HA THR 691 HA THR 691 -16.961 -20.114 -8.173 1340 HB THR 691 HB THR 691 -14.191 -20.709 -7.002 1341 HG1 THR 691 1HG THR 691 -15.565 -22.564 -7.647 1342 1HG2 THR 691 3HG2 THR 691 -16.233 -19.039 -5.983 1343 2HG2 THR 691 1HG2 THR 691 -16.516 -20.612 -5.199 1344 3HG2 THR 691 2HG2 THR 691 -14.938 -19.806 -5.034 1345 H GLY 692 H GLY 692 -14.437 -19.247 -10.217 1346 1HA GLY 692 2HA GLY 692 -13.848 -17.214 -11.002 1347 2HA GLY 692 1HA GLY 692 -13.372 -16.914 -9.342 1348 H MET 693 H MET 693 -16.776 -17.583 -10.050 1349 HA MET 693 HA MET 693 -17.484 -14.886 -10.465 1350 1HB MET 693 1HB MET 693 -18.691 -17.465 -10.642 1351 2HB MET 693 2HB MET 693 -19.634 -16.619 -9.431 1352 1HG MET 693 1HG MET 693 -19.132 -14.786 -11.615 1353 2HG MET 693 2HG MET 693 -19.717 -16.293 -12.293 1354 1HE MET 693 2HE MET 693 -19.985 -13.618 -9.837 1355 2HE MET 693 3HE MET 693 -21.317 -12.909 -10.782 1356 3HE MET 693 1HE MET 693 -21.641 -13.622 -9.184 1357 H PHE 694 H PHE 694 -16.233 -16.294 -7.759 1358 HA PHE 694 HA PHE 694 -17.990 -15.691 -5.713 1359 1HB PHE 694 1HB PHE 694 -15.658 -15.420 -4.480 1360 2HB PHE 694 2HB PHE 694 -16.019 -16.969 -5.216 1361 HD1 PHE 694 1HD PHE 694 -14.103 -17.897 -6.088 1362 HD2 PHE 694 2HD PHE 694 -14.747 -13.733 -6.593 1363 HE1 PHE 694 1HE PHE 694 -12.003 -17.737 -7.453 1364 HE2 PHE 694 2HE PHE 694 -12.647 -13.574 -7.958 1365 HZ PHE 694 HZ PHE 694 -11.300 -15.578 -8.372 1366 H ALA 695 H ALA 695 -17.586 -13.937 -3.983 1367 HA ALA 695 HA ALA 695 -16.407 -11.501 -4.848 1368 1HB ALA 695 1HB ALA 695 -18.784 -11.830 -6.039 1369 2HB ALA 695 2HB ALA 695 -19.369 -11.226 -4.470 1370 3HB ALA 695 3HB ALA 695 -18.246 -10.243 -5.440 No H/Q in entry = 1370 Start of MODEL 5 1 H ALA 1 H ALA 1 -0.172 31.356 -1.277 2 HA ALA 1 HA ALA 1 -0.710 30.111 -3.496 3 1HB ALA 1 2HB ALA 1 -2.372 28.614 -3.313 4 2HB ALA 1 3HB ALA 1 -2.448 28.934 -1.564 5 3HB ALA 1 1HB ALA 1 -3.463 29.873 -2.685 6 H GLU 2 H GLU 2 -1.061 31.775 -4.884 7 HA GLU 2 HA GLU 2 -1.917 34.246 -3.791 8 1HB GLU 2 1HB GLU 2 -0.475 33.338 -6.104 9 2HB GLU 2 2HB GLU 2 -1.819 34.305 -6.676 10 1HG GLU 2 1HG GLU 2 -0.860 35.779 -4.488 11 2HG GLU 2 2HG GLU 2 0.604 35.146 -5.213 12 HE2 GLU 2 HE GLU 2 -2.232 37.177 -6.844 13 H MET 3 H MET 3 -3.080 32.545 -6.788 14 HA MET 3 HA MET 3 -5.737 33.509 -6.088 15 1HB MET 3 1HB MET 3 -4.163 33.295 -8.567 16 2HB MET 3 2HB MET 3 -5.700 32.474 -8.753 17 1HG MET 3 1HG MET 3 -6.548 34.773 -7.517 18 2HG MET 3 2HG MET 3 -5.140 35.390 -8.360 19 1HE MET 3 2HE MET 3 -4.881 35.924 -10.374 20 2HE MET 3 3HE MET 3 -5.064 34.573 -11.517 21 3HE MET 3 1HE MET 3 -6.099 36.013 -11.669 22 H LYS 4 H LYS 4 -7.391 31.875 -7.561 23 HA LYS 4 HA LYS 4 -6.966 29.307 -6.231 24 1HB LYS 4 1HB LYS 4 -9.040 29.874 -5.543 25 2HB LYS 4 2HB LYS 4 -9.311 30.978 -6.877 26 1HG LYS 4 1HG LYS 4 -9.884 29.174 -8.386 27 2HG LYS 4 2HG LYS 4 -9.287 27.957 -7.275 28 1HD LYS 4 1HD LYS 4 -11.527 29.813 -6.415 29 2HD LYS 4 2HD LYS 4 -11.885 28.427 -7.426 30 1HE LYS 4 1HE LYS 4 -10.938 26.888 -5.764 31 2HE LYS 4 2HE LYS 4 -10.349 28.224 -4.794 32 H THR 5 H THR 5 -6.828 30.907 -9.306 33 HA THR 5 HA THR 5 -6.830 28.277 -10.638 34 HB THR 5 HB THR 5 -7.652 29.488 -12.631 35 HG1 THR 5 1HG THR 5 -7.341 31.683 -12.604 36 1HG2 THR 5 2HG2 THR 5 -9.108 29.982 -10.013 37 2HG2 THR 5 3HG2 THR 5 -9.715 30.735 -11.507 38 3HG2 THR 5 1HG2 THR 5 -9.600 28.963 -11.387 39 H ASP 6 H ASP 6 -4.901 30.782 -9.466 40 HA ASP 6 HA ASP 6 -3.173 31.498 -11.304 41 1HB ASP 6 1HB ASP 6 -3.131 31.167 -8.491 42 2HB ASP 6 2HB ASP 6 -1.683 30.351 -9.047 43 HD2 ASP 6 HD ASP 6 -0.089 31.794 -10.136 44 H ALA 7 H ALA 7 -1.202 30.593 -12.294 45 HA ALA 7 HA ALA 7 -1.443 27.880 -13.014 46 1HB ALA 7 1HB ALA 7 0.322 30.196 -13.579 47 2HB ALA 7 2HB ALA 7 1.093 28.601 -13.755 48 3HB ALA 7 3HB ALA 7 -0.373 28.988 -14.687 49 H ALA 8 H ALA 8 0.276 29.639 -10.453 50 HA ALA 8 HA ALA 8 2.116 27.577 -9.856 51 1HB ALA 8 1HB ALA 8 1.977 28.962 -7.561 52 2HB ALA 8 3HB ALA 8 1.147 30.127 -8.620 53 3HB ALA 8 2HB ALA 8 2.804 29.601 -9.002 54 H THR 9 H THR 9 -1.128 28.533 -8.565 55 HA THR 9 HA THR 9 -1.188 26.485 -6.612 56 HB THR 9 HB THR 9 -2.516 28.688 -6.700 57 HG1 THR 9 1HG THR 9 -3.821 26.063 -6.530 58 1HG2 THR 9 1HG2 THR 9 -3.867 27.090 -8.891 59 2HG2 THR 9 2HG2 THR 9 -4.876 28.082 -7.811 60 3HG2 THR 9 3HG2 THR 9 -3.600 28.846 -8.788 61 H LEU 10 H LEU 10 -1.891 26.590 -10.076 62 HA LEU 10 HA LEU 10 -3.394 24.157 -10.020 63 1HB LEU 10 1HB LEU 10 -2.319 25.984 -12.139 64 2HB LEU 10 2HB LEU 10 -2.900 24.388 -12.572 65 HG LEU 10 HG LEU 10 -4.475 26.640 -11.305 66 1HD1 LEU 10 2HD1 LEU 10 -4.059 26.746 -13.755 67 2HD1 LEU 10 3HD1 LEU 10 -4.894 25.184 -13.928 68 3HD1 LEU 10 1HD1 LEU 10 -5.780 26.605 -13.324 69 1HD2 LEU 10 1HD2 LEU 10 -5.168 23.723 -11.597 70 2HD2 LEU 10 2HD2 LEU 10 -5.345 24.791 -10.183 71 3HD2 LEU 10 3HD2 LEU 10 -6.427 24.982 -11.583 72 H ALA 11 H ALA 11 -0.095 25.110 -11.213 73 HA ALA 11 HA ALA 11 0.741 22.577 -11.898 74 1HB ALA 11 2HB ALA 11 2.128 25.101 -10.977 75 2HB ALA 11 3HB ALA 11 3.063 23.627 -11.326 76 3HB ALA 11 1HB ALA 11 2.074 24.378 -12.602 77 H GLN 12 H GLN 12 0.322 24.096 -8.725 78 HA GLN 12 HA GLN 12 2.011 22.444 -7.288 79 1HB GLN 12 1HB GLN 12 0.569 24.615 -6.661 80 2HB GLN 12 2HB GLN 12 -0.571 23.419 -6.076 81 1HG GLN 12 1HG GLN 12 2.338 23.149 -5.294 82 2HG GLN 12 2HG GLN 12 1.362 24.363 -4.490 83 1HE2 GLN 12 1HE2 GLN 12 2.459 21.316 -4.273 84 2HE2 GLN 12 2HE2 GLN 12 1.241 20.567 -3.295 85 H GLU 13 H GLU 13 -1.414 22.075 -8.329 86 HA GLU 13 HA GLU 13 -1.456 19.482 -7.036 87 1HB GLU 13 1HB GLU 13 -3.650 21.179 -8.297 88 2HB GLU 13 2HB GLU 13 -3.924 19.557 -7.694 89 1HG GLU 13 1HG GLU 13 -3.097 22.023 -6.116 90 2HG GLU 13 2HG GLU 13 -4.528 21.035 -5.898 91 HE2 GLU 13 HE GLU 13 -2.797 21.179 -3.569 92 H ALA 14 H ALA 14 -1.648 21.103 -10.232 93 HA ALA 14 HA ALA 14 -2.395 18.948 -11.781 94 1HB ALA 14 1HB ALA 14 -1.894 21.525 -12.259 95 2HB ALA 14 2HB ALA 14 -0.319 20.875 -12.776 96 3HB ALA 14 3HB ALA 14 -1.816 20.309 -13.556 97 H GLY 15 H GLY 15 0.950 20.067 -10.899 98 1HA GLY 15 2HA GLY 15 2.861 18.901 -10.653 99 2HA GLY 15 1HA GLY 15 2.429 18.156 -12.179 100 H ASN 16 H ASN 16 0.370 17.817 -9.286 101 HA ASN 16 HA ASN 16 1.554 15.318 -8.597 102 1HB ASN 16 1HB ASN 16 0.695 16.447 -6.702 103 2HB ASN 16 2HB ASN 16 -0.717 17.030 -7.560 104 1HD2 ASN 16 1HD2 ASN 16 -2.367 16.280 -6.434 105 2HD2 ASN 16 2HD2 ASN 16 -2.682 14.621 -6.045 106 H PHE 17 H PHE 17 -1.224 16.622 -10.419 107 HA PHE 17 HA PHE 17 -2.716 14.228 -10.514 108 1HB PHE 17 1HB PHE 17 -3.653 16.495 -10.938 109 2HB PHE 17 2HB PHE 17 -2.507 16.767 -12.235 110 HD1 PHE 17 1HD PHE 17 -3.106 16.282 -14.433 111 HD2 PHE 17 2HD PHE 17 -5.336 14.551 -11.265 112 HE1 PHE 17 1HE PHE 17 -4.771 15.396 -16.089 113 HE2 PHE 17 2HE PHE 17 -7.001 13.664 -12.921 114 HZ PHE 17 HZ PHE 17 -6.698 14.098 -15.313 115 H GLU 18 H GLU 18 -0.559 15.882 -12.932 116 HA GLU 18 HA GLU 18 -0.752 14.244 -14.993 117 1HB GLU 18 1HB GLU 18 1.620 15.658 -13.780 118 2HB GLU 18 2HB GLU 18 1.888 14.613 -15.160 119 1HG GLU 18 1HG GLU 18 -0.418 16.152 -15.813 120 2HG GLU 18 2HG GLU 18 0.703 17.281 -15.080 121 HE2 GLU 18 HE GLU 18 1.547 15.721 -18.650 122 H ARG 19 H ARG 19 0.937 13.532 -11.914 123 HA ARG 19 HA ARG 19 2.199 11.228 -12.820 124 1HB ARG 19 1HB ARG 19 2.165 12.726 -10.464 125 2HB ARG 19 2HB ARG 19 1.388 11.239 -9.958 126 1HG ARG 19 1HG ARG 19 3.321 10.021 -10.125 127 2HG ARG 19 2HG ARG 19 3.777 10.770 -11.642 128 1HD ARG 19 1HD ARG 19 5.316 12.008 -10.522 129 2HD ARG 19 2HD ARG 19 4.009 12.835 -9.699 130 HE ARG 19 HE ARG 19 4.642 10.230 -8.517 131 2HH1 ARG 19 1HH ARG 19 6.175 11.580 -5.708 132 1HH2 ARG 19 2HH2 ARG 19 5.466 13.676 -8.521 133 2HH2 ARG 19 1HH2 ARG 19 6.144 13.643 -6.927 134 H ILE 20 H ILE 20 -1.000 11.884 -11.291 135 HA ILE 20 HA ILE 20 -1.695 9.185 -10.909 136 HB ILE 20 HB ILE 20 -3.474 11.603 -11.244 137 1HG1 ILE 20 1HG1 ILE 20 -2.499 10.478 -8.620 138 2HG1 ILE 20 2HG1 ILE 20 -1.575 11.690 -9.486 139 1HG2 ILE 20 3HG2 ILE 20 -4.190 8.937 -11.114 140 2HG2 ILE 20 1HG2 ILE 20 -4.338 9.485 -9.428 141 3HG2 ILE 20 2HG2 ILE 20 -5.226 10.329 -10.719 142 1HD1 ILE 20 1HD1 ILE 20 -3.957 12.924 -9.614 143 2HD1 ILE 20 2HD1 ILE 20 -4.270 11.931 -8.171 144 3HD1 ILE 20 3HD1 ILE 20 -2.908 13.077 -8.184 145 H SER 21 H SER 21 -2.280 11.549 -13.579 146 HA SER 21 HA SER 21 -3.904 9.909 -15.073 147 1HB SER 21 1HB SER 21 -3.044 11.340 -17.029 148 2HB SER 21 2HB SER 21 -3.776 12.202 -15.690 149 HG SER 21 HG SER 21 -1.751 13.165 -16.408 150 H GLY 22 H GLY 22 -0.311 10.453 -15.298 151 1HA GLY 22 2HA GLY 22 1.345 9.141 -16.061 152 2HA GLY 22 1HA GLY 22 0.247 8.682 -17.347 153 H ASP 23 H ASP 23 0.204 8.089 -13.758 154 HA ASP 23 HA ASP 23 0.969 5.453 -13.929 155 1HB ASP 23 1HB ASP 23 -0.637 7.060 -11.917 156 2HB ASP 23 2HB ASP 23 -0.415 5.339 -11.671 157 HD2 ASP 23 HD ASP 23 2.078 6.783 -9.746 158 H LEU 24 H LEU 24 -2.212 7.105 -14.177 159 HA LEU 24 HA LEU 24 -3.837 4.845 -13.937 160 1HB LEU 24 1HB LEU 24 -4.088 7.647 -14.741 161 2HB LEU 24 2HB LEU 24 -5.197 6.586 -15.586 162 HG LEU 24 HG LEU 24 -4.933 6.734 -12.571 163 1HD1 LEU 24 1HD1 LEU 24 -5.813 8.811 -13.857 164 2HD1 LEU 24 2HD1 LEU 24 -7.268 7.820 -14.121 165 3HD1 LEU 24 3HD1 LEU 24 -6.731 8.189 -12.464 166 1HD2 LEU 24 3HD2 LEU 24 -6.063 4.748 -14.199 167 2HD2 LEU 24 1HD2 LEU 24 -6.266 4.964 -12.444 168 3HD2 LEU 24 2HD2 LEU 24 -7.435 5.693 -13.571 169 H LYS 25 H LYS 25 -2.351 6.467 -16.811 170 HA LYS 25 HA LYS 25 -3.480 4.640 -18.646 171 1HB LYS 25 1HB LYS 25 -2.921 6.575 -19.706 172 2HB LYS 25 2HB LYS 25 -1.519 6.869 -18.698 173 1HG LYS 25 1HG LYS 25 -0.125 5.464 -19.974 174 2HG LYS 25 2HG LYS 25 -1.461 4.499 -20.570 175 1HD LYS 25 1HD LYS 25 -0.608 5.905 -22.390 176 2HD LYS 25 2HD LYS 25 -2.228 6.426 -21.972 177 1HE LYS 25 1HE LYS 25 -1.372 8.521 -21.745 178 2HE LYS 25 2HE LYS 25 -0.626 7.960 -20.262 179 H THR 26 H THR 26 -0.529 4.716 -16.648 180 HA THR 26 HA THR 26 0.871 2.696 -18.001 181 HB THR 26 HB THR 26 0.876 3.937 -15.231 182 HG1 THR 26 1HG THR 26 2.670 3.568 -17.526 183 1HG2 THR 26 1HG2 THR 26 1.968 1.299 -15.943 184 2HG2 THR 26 2HG2 THR 26 3.263 2.452 -15.541 185 3HG2 THR 26 3HG2 THR 26 1.969 2.120 -14.364 186 H GLN 27 H GLN 27 -1.317 2.506 -15.116 187 HA GLN 27 HA GLN 27 -1.104 -0.227 -14.861 188 1HB GLN 27 1HB GLN 27 -3.445 1.596 -14.153 189 2HB GLN 27 2HB GLN 27 -3.238 -0.038 -13.555 190 1HG GLN 27 1HG GLN 27 -1.117 2.117 -13.166 191 2HG GLN 27 2HG GLN 27 -2.417 1.867 -12.018 192 1HE2 GLN 27 1HE2 GLN 27 0.680 1.040 -12.883 193 2HE2 GLN 27 2HE2 GLN 27 0.900 -0.406 -11.954 194 H ILE 28 H ILE 28 -3.445 1.801 -16.729 195 HA ILE 28 HA ILE 28 -5.119 -0.230 -17.562 196 HB ILE 28 HB ILE 28 -4.454 2.514 -18.389 197 1HG1 ILE 28 1HG1 ILE 28 -7.187 1.284 -18.413 198 2HG1 ILE 28 2HG1 ILE 28 -6.376 1.501 -16.875 199 1HG2 ILE 28 2HG2 ILE 28 -5.536 0.497 -20.352 200 2HG2 ILE 28 3HG2 ILE 28 -5.933 2.229 -20.463 201 3HG2 ILE 28 1HG2 ILE 28 -4.238 1.695 -20.571 202 1HD1 ILE 28 1HD1 ILE 28 -5.997 3.924 -17.445 203 2HD1 ILE 28 2HD1 ILE 28 -6.927 3.678 -18.942 204 3HD1 ILE 28 3HD1 ILE 28 -7.721 3.489 -17.361 205 H ASP 29 H ASP 29 -2.093 1.049 -19.091 206 HA ASP 29 HA ASP 29 -2.189 -0.603 -21.287 207 1HB ASP 29 1HB ASP 29 -0.377 1.265 -20.098 208 2HB ASP 29 2HB ASP 29 0.550 -0.195 -20.377 209 HD2 ASP 29 HD ASP 29 -1.739 1.729 -22.465 210 H GLN 30 H GLN 30 -1.016 -1.058 -17.929 211 HA GLN 30 HA GLN 30 0.460 -3.368 -18.390 212 1HB GLN 30 1HB GLN 30 -0.557 -1.848 -16.076 213 2HB GLN 30 2HB GLN 30 -0.478 -3.570 -15.762 214 1HG GLN 30 1HG GLN 30 1.756 -3.373 -15.442 215 2HG GLN 30 2HG GLN 30 1.935 -2.957 -17.134 216 1HE2 GLN 30 1HE2 GLN 30 0.409 -1.285 -14.387 217 2HE2 GLN 30 2HE2 GLN 30 1.325 0.182 -14.484 218 H VAL 31 H VAL 31 -3.013 -2.756 -17.804 219 HA VAL 31 HA VAL 31 -3.628 -5.512 -17.382 220 HB VAL 31 HB VAL 31 -5.179 -2.970 -17.768 221 1HG1 VAL 31 1HG1 VAL 31 -6.377 -4.785 -18.984 222 2HG1 VAL 31 2HG1 VAL 31 -6.422 -5.724 -17.472 223 3HG1 VAL 31 3HG1 VAL 31 -7.275 -4.165 -17.578 224 1HG2 VAL 31 3HG2 VAL 31 -4.050 -4.118 -15.553 225 2HG2 VAL 31 1HG2 VAL 31 -5.430 -2.994 -15.528 226 3HG2 VAL 31 2HG2 VAL 31 -5.713 -4.750 -15.477 227 H GLU 32 H GLU 32 -4.046 -3.141 -20.096 228 HA GLU 32 HA GLU 32 -5.293 -4.750 -21.855 229 1HB GLU 32 1HB GLU 32 -3.582 -2.361 -21.990 230 2HB GLU 32 2HB GLU 32 -3.464 -3.331 -23.444 231 1HG GLU 32 1HG GLU 32 -6.173 -3.394 -23.090 232 2HG GLU 32 2HG GLU 32 -5.823 -1.854 -22.330 233 HE2 GLU 32 HE GLU 32 -5.421 -0.238 -23.601 234 H SER 33 H SER 33 -1.778 -4.629 -21.077 235 HA SER 33 HA SER 33 -1.117 -6.480 -23.105 236 1HB SER 33 1HB SER 33 0.513 -4.833 -22.254 237 2HB SER 33 2HB SER 33 0.423 -5.531 -20.649 238 HG SER 33 HG SER 33 1.123 -7.226 -22.849 239 H THR 34 H THR 34 -1.310 -6.634 -19.473 240 HA THR 34 HA THR 34 -0.727 -9.318 -19.186 241 HB THR 34 HB THR 34 -2.207 -7.187 -17.644 242 HG1 THR 34 1HG THR 34 -0.096 -9.166 -17.139 243 1HG2 THR 34 1HG2 THR 34 -3.467 -9.426 -17.298 244 2HG2 THR 34 2HG2 THR 34 -1.938 -10.062 -16.646 245 3HG2 THR 34 3HG2 THR 34 -2.752 -8.701 -15.838 246 H ALA 35 H ALA 35 -3.858 -7.738 -19.978 247 HA ALA 35 HA ALA 35 -5.443 -10.003 -19.712 248 1HB ALA 35 1HB ALA 35 -5.990 -7.996 -21.874 249 2HB ALA 35 3HB ALA 35 -5.916 -7.417 -20.192 250 3HB ALA 35 2HB ALA 35 -7.086 -8.679 -20.648 251 H GLY 36 H GLY 36 -3.164 -8.968 -22.237 252 1HA GLY 36 2HA GLY 36 -2.300 -10.112 -23.974 253 2HA GLY 36 1HA GLY 36 -3.971 -10.373 -24.432 254 H SER 37 H SER 37 -1.928 -11.613 -21.687 255 HA SER 37 HA SER 37 -1.683 -14.159 -22.740 256 1HB SER 37 1HB SER 37 -1.570 -13.190 -19.850 257 2HB SER 37 2HB SER 37 -1.074 -14.791 -20.361 258 HG SER 37 HG SER 37 0.741 -13.341 -20.239 259 H LEU 38 H LEU 38 -4.205 -12.578 -20.771 260 HA LEU 38 HA LEU 38 -5.505 -14.942 -19.960 261 1HB LEU 38 1HB LEU 38 -6.161 -12.031 -20.056 262 2HB LEU 38 2HB LEU 38 -7.462 -13.176 -19.796 263 HG LEU 38 HG LEU 38 -6.888 -12.650 -17.638 264 1HD1 LEU 38 1HD1 LEU 38 -6.543 -15.169 -18.273 265 2HD1 LEU 38 2HD1 LEU 38 -4.844 -14.829 -17.868 266 3HD1 LEU 38 3HD1 LEU 38 -6.116 -14.577 -16.649 267 1HD2 LEU 38 1HD2 LEU 38 -4.664 -11.502 -18.690 268 2HD2 LEU 38 2HD2 LEU 38 -4.984 -11.673 -16.948 269 3HD2 LEU 38 3HD2 LEU 38 -3.946 -12.854 -17.782 270 H GLN 39 H GLN 39 -6.566 -12.482 -22.421 271 HA GLN 39 HA GLN 39 -8.517 -14.029 -23.508 272 1HB GLN 39 1HB GLN 39 -7.974 -12.592 -25.649 273 2HB GLN 39 2HB GLN 39 -8.555 -11.799 -24.198 274 1HG GLN 39 1HG GLN 39 -5.668 -12.054 -24.029 275 2HG GLN 39 2HG GLN 39 -6.082 -11.350 -25.580 276 1HE2 GLN 39 1HE2 GLN 39 -7.871 -11.135 -22.535 277 2HE2 GLN 39 2HE2 GLN 39 -7.736 -9.423 -22.309 278 H GLY 40 H GLY 40 -5.074 -14.446 -23.680 279 1HA GLY 40 2HA GLY 40 -3.733 -15.638 -25.101 280 2HA GLY 40 1HA GLY 40 -5.088 -15.919 -26.176 281 H GLN 41 H GLN 41 -6.317 -16.604 -23.153 282 HA GLN 41 HA GLN 41 -6.134 -19.393 -23.662 283 1HB GLN 41 1HB GLN 41 -4.052 -19.249 -22.469 284 2HB GLN 41 2HB GLN 41 -4.725 -18.173 -21.261 285 1HG GLN 41 1HG GLN 41 -6.325 -20.071 -20.606 286 2HG GLN 41 2HG GLN 41 -5.404 -21.120 -21.666 287 1HE2 GLN 41 1HE2 GLN 41 -5.524 -19.431 -18.670 288 2HE2 GLN 41 2HE2 GLN 41 -4.054 -20.019 -17.968 289 H TRP 42 H TRP 42 -8.192 -20.097 -23.314 290 HA TRP 42 HA TRP 42 -9.537 -19.499 -20.880 291 1HB TRP 42 1HB TRP 42 -10.455 -18.126 -23.405 292 2HB TRP 42 2HB TRP 42 -11.525 -18.440 -22.053 293 HD1 TRP 42 HD TRP 42 -9.496 -15.709 -23.303 294 HE1 TRP 42 1HE TRP 42 -8.831 -13.908 -21.493 295 HE3 TRP 42 3HE TRP 42 -10.642 -18.579 -19.266 296 HZ2 TRP 42 2HZ TRP 42 -8.858 -13.886 -18.639 297 HZ3 TRP 42 3HZ TRP 42 -10.293 -17.592 -17.003 298 HH2 TRP 42 HH TRP 42 -9.435 -15.331 -16.654 299 H ARG 43 H ARG 43 -11.275 -20.995 -20.583 300 HA ARG 43 HA ARG 43 -11.202 -23.115 -22.529 301 1HB ARG 43 1HB ARG 43 -12.091 -22.855 -19.649 302 2HB ARG 43 2HB ARG 43 -12.767 -24.158 -20.606 303 1HG ARG 43 1HG ARG 43 -9.848 -23.923 -20.963 304 2HG ARG 43 2HG ARG 43 -10.286 -24.183 -19.286 305 1HD ARG 43 1HD ARG 43 -11.618 -25.891 -21.397 306 2HD ARG 43 2HD ARG 43 -9.958 -26.248 -20.963 307 HE ARG 43 HE ARG 43 -11.644 -25.908 -18.611 308 2HH1 ARG 43 1HH ARG 43 -11.898 -29.302 -17.914 309 1HH2 ARG 43 2HH2 ARG 43 -10.676 -28.232 -21.104 310 2HH2 ARG 43 1HH2 ARG 43 -11.045 -29.618 -20.132 311 H GLY 44 H GLY 44 -13.953 -22.166 -20.388 312 1HA GLY 44 2HA GLY 44 -16.106 -22.767 -21.669 313 2HA GLY 44 1HA GLY 44 -15.566 -21.506 -22.759 314 H ALA 45 H ALA 45 -16.842 -19.731 -22.407 315 HA ALA 45 HA ALA 45 -18.051 -18.203 -21.328 316 1HB ALA 45 2HB ALA 45 -17.703 -19.035 -18.554 317 2HB ALA 45 1HB ALA 45 -18.193 -20.402 -19.583 318 3HB ALA 45 3HB ALA 45 -19.190 -18.928 -19.527 319 H ALA 46 H ALA 46 -15.287 -19.266 -19.212 320 HA ALA 46 HA ALA 46 -14.645 -16.813 -18.189 321 1HB ALA 46 3HB ALA 46 -12.570 -18.857 -19.023 322 2HB ALA 46 2HB ALA 46 -13.718 -19.179 -17.702 323 3HB ALA 46 1HB ALA 46 -12.587 -17.809 -17.584 324 H GLY 47 H GLY 47 -14.131 -18.117 -21.449 325 1HA GLY 47 2HA GLY 47 -13.126 -17.262 -23.281 326 2HA GLY 47 1HA GLY 47 -12.161 -16.222 -22.252 327 H THR 48 H THR 48 -15.561 -16.610 -23.468 328 HA THR 48 HA THR 48 -15.725 -14.095 -24.596 329 HB THR 48 HB THR 48 -18.131 -14.603 -24.685 330 HG1 THR 48 1HG THR 48 -17.279 -16.493 -22.605 331 1HG2 THR 48 3HG2 THR 48 -16.155 -16.491 -25.472 332 2HG2 THR 48 1HG2 THR 48 -17.391 -17.437 -24.610 333 3HG2 THR 48 2HG2 THR 48 -17.850 -16.443 -26.014 334 H ALA 49 H ALA 49 -16.003 -15.069 -21.210 335 HA ALA 49 HA ALA 49 -17.345 -12.728 -20.359 336 1HB ALA 49 3HB ALA 49 -15.771 -14.951 -19.050 337 2HB ALA 49 2HB ALA 49 -17.504 -14.568 -18.913 338 3HB ALA 49 1HB ALA 49 -16.299 -13.538 -18.104 339 H ALA 50 H ALA 50 -13.870 -13.775 -20.386 340 HA ALA 50 HA ALA 50 -13.022 -11.199 -19.455 341 1HB ALA 50 1HB ALA 50 -10.736 -12.333 -20.144 342 2HB ALA 50 3HB ALA 50 -11.735 -13.801 -20.259 343 3HB ALA 50 2HB ALA 50 -11.631 -12.914 -18.720 344 H GLN 51 H GLN 51 -12.493 -13.105 -22.512 345 HA GLN 51 HA GLN 51 -11.240 -11.305 -23.983 346 1HB GLN 51 1HB GLN 51 -11.706 -12.743 -25.674 347 2HB GLN 51 2HB GLN 51 -12.609 -13.663 -24.487 348 1HG GLN 51 1HG GLN 51 -14.144 -13.322 -26.284 349 2HG GLN 51 2HG GLN 51 -14.638 -12.175 -25.054 350 1HE2 GLN 51 1HE2 GLN 51 -15.365 -10.452 -26.051 351 2HE2 GLN 51 2HE2 GLN 51 -14.576 -9.565 -27.312 352 H ALA 52 H ALA 52 -14.694 -11.208 -23.058 353 HA ALA 52 HA ALA 52 -15.230 -8.965 -24.779 354 1HB ALA 52 1HB ALA 52 -16.900 -10.753 -24.240 355 2HB ALA 52 3HB ALA 52 -17.470 -9.116 -23.837 356 3HB ALA 52 2HB ALA 52 -16.893 -10.200 -22.549 357 H ALA 53 H ALA 53 -14.686 -9.624 -21.271 358 HA ALA 53 HA ALA 53 -15.235 -7.094 -20.317 359 1HB ALA 53 3HB ALA 53 -13.080 -9.004 -19.332 360 2HB ALA 53 2HB ALA 53 -14.818 -9.205 -19.004 361 3HB ALA 53 1HB ALA 53 -13.954 -7.779 -18.380 362 H VAL 54 H VAL 54 -12.014 -8.483 -21.287 363 HA VAL 54 HA VAL 54 -10.590 -6.133 -20.966 364 HB VAL 54 HB VAL 54 -9.192 -7.876 -21.200 365 1HG1 VAL 54 2HG1 VAL 54 -11.312 -9.025 -22.987 366 2HG1 VAL 54 3HG1 VAL 54 -9.662 -9.688 -23.062 367 3HG1 VAL 54 1HG1 VAL 54 -10.559 -9.705 -21.525 368 1HG2 VAL 54 1HG2 VAL 54 -8.788 -6.168 -23.115 369 2HG2 VAL 54 2HG2 VAL 54 -7.935 -7.729 -23.161 370 3HG2 VAL 54 3HG2 VAL 54 -9.370 -7.468 -24.182 371 H VAL 55 H VAL 55 -12.129 -7.513 -23.954 372 HA VAL 55 HA VAL 55 -11.435 -5.598 -25.737 373 HB VAL 55 HB VAL 55 -13.888 -7.279 -25.352 374 1HG1 VAL 55 1HG1 VAL 55 -13.579 -4.969 -27.205 375 2HG1 VAL 55 2HG1 VAL 55 -14.252 -6.466 -27.894 376 3HG1 VAL 55 3HG1 VAL 55 -15.046 -5.692 -26.501 377 1HG2 VAL 55 2HG2 VAL 55 -11.472 -7.971 -26.233 378 2HG2 VAL 55 3HG2 VAL 55 -12.958 -8.676 -26.913 379 3HG2 VAL 55 1HG2 VAL 55 -12.127 -7.354 -27.769 380 H ARG 56 H ARG 56 -14.364 -5.528 -23.582 381 HA ARG 56 HA ARG 56 -15.183 -3.037 -24.385 382 1HB ARG 56 1HB ARG 56 -15.572 -4.656 -21.842 383 2HB ARG 56 2HB ARG 56 -16.248 -3.044 -21.957 384 1HG ARG 56 1HG ARG 56 -17.151 -3.978 -24.319 385 2HG ARG 56 2HG ARG 56 -16.973 -5.523 -23.511 386 1HD ARG 56 1HD ARG 56 -18.229 -3.786 -21.617 387 2HD ARG 56 2HD ARG 56 -19.039 -3.501 -23.144 388 HE ARG 56 HE ARG 56 -19.891 -5.696 -23.099 389 2HH1 ARG 56 1HH ARG 56 -19.494 -8.237 -20.764 390 1HH2 ARG 56 2HH2 ARG 56 -17.389 -5.346 -20.615 391 2HH2 ARG 56 1HH2 ARG 56 -17.744 -6.868 -19.867 392 H PHE 57 H PHE 57 -13.149 -4.044 -21.545 393 HA PHE 57 HA PHE 57 -12.785 -1.554 -20.437 394 1HB PHE 57 1HB PHE 57 -11.904 -3.309 -19.143 395 2HB PHE 57 2HB PHE 57 -11.443 -4.236 -20.557 396 HD1 PHE 57 1HD PHE 57 -10.369 -1.739 -18.129 397 HD2 PHE 57 2HD PHE 57 -9.270 -3.878 -21.626 398 HE1 PHE 57 1HE PHE 57 -7.971 -1.087 -17.775 399 HE2 PHE 57 2HE PHE 57 -6.873 -3.226 -21.272 400 HZ PHE 57 HZ PHE 57 -6.251 -1.838 -19.351 401 H GLN 58 H GLN 58 -11.172 -3.098 -23.237 402 HA GLN 58 HA GLN 58 -9.029 -1.347 -23.373 403 1HB GLN 58 1HB GLN 58 -10.451 -3.052 -25.449 404 2HB GLN 58 2HB GLN 58 -9.058 -2.075 -25.869 405 1HG GLN 58 1HG GLN 58 -8.040 -3.287 -23.666 406 2HG GLN 58 2HG GLN 58 -9.214 -4.510 -24.109 407 1HE2 GLN 58 1HE2 GLN 58 -9.157 -3.916 -26.939 408 2HE2 GLN 58 2HE2 GLN 58 -7.675 -4.539 -27.584 409 H GLU 59 H GLU 59 -12.132 -1.367 -25.282 410 HA GLU 59 HA GLU 59 -11.703 0.947 -26.633 411 1HB GLU 59 1HB GLU 59 -14.272 -0.319 -25.607 412 2HB GLU 59 2HB GLU 59 -14.285 1.093 -26.645 413 1HG GLU 59 1HG GLU 59 -12.635 -1.295 -27.488 414 2HG GLU 59 2HG GLU 59 -14.375 -1.378 -27.672 415 HE2 GLU 59 HE GLU 59 -14.237 0.249 -30.583 416 H ALA 60 H ALA 60 -12.628 0.456 -23.241 417 HA ALA 60 HA ALA 60 -13.398 3.205 -22.877 418 1HB ALA 60 3HB ALA 60 -13.050 0.799 -21.059 419 2HB ALA 60 2HB ALA 60 -14.562 1.589 -21.564 420 3HB ALA 60 1HB ALA 60 -13.458 2.417 -20.439 421 H ALA 61 H ALA 61 -10.505 1.176 -22.648 422 HA ALA 61 HA ALA 61 -8.999 2.685 -20.887 423 1HB ALA 61 1HB ALA 61 -8.647 0.399 -22.298 424 2HB ALA 61 2HB ALA 61 -7.640 1.504 -23.265 425 3HB ALA 61 3HB ALA 61 -7.308 1.284 -21.530 426 H ASN 62 H ASN 62 -9.465 3.011 -24.461 427 HA ASN 62 HA ASN 62 -7.668 5.102 -24.739 428 1HB ASN 62 1HB ASN 62 -10.157 4.896 -26.464 429 2HB ASN 62 2HB ASN 62 -8.520 5.285 -26.954 430 1HD2 ASN 62 1HD2 ASN 62 -10.692 2.742 -25.892 431 2HD2 ASN 62 2HD2 ASN 62 -9.809 1.390 -26.519 432 H LYS 63 H LYS 63 -11.227 4.914 -24.114 433 HA LYS 63 HA LYS 63 -11.831 7.601 -24.374 434 1HB LYS 63 1HB LYS 63 -13.293 5.425 -23.997 435 2HB LYS 63 2HB LYS 63 -13.204 5.909 -22.315 436 1HG LYS 63 1HG LYS 63 -15.009 7.219 -22.844 437 2HG LYS 63 2HG LYS 63 -13.796 8.328 -23.452 438 1HD LYS 63 1HD LYS 63 -15.585 7.940 -25.134 439 2HD LYS 63 2HD LYS 63 -14.027 7.406 -25.730 440 1HE LYS 63 1HE LYS 63 -14.576 5.126 -25.553 441 2HE LYS 63 2HE LYS 63 -15.750 5.395 -24.280 442 H GLN 64 H GLN 64 -10.312 5.768 -21.711 443 HA GLN 64 HA GLN 64 -10.556 7.918 -19.888 444 1HB GLN 64 1HB GLN 64 -9.773 5.167 -19.811 445 2HB GLN 64 2HB GLN 64 -8.419 6.088 -19.188 446 1HG GLN 64 1HG GLN 64 -11.021 7.053 -18.163 447 2HG GLN 64 2HG GLN 64 -10.713 5.377 -17.753 448 1HE2 GLN 64 1HE2 GLN 64 -9.570 4.976 -16.022 449 2HE2 GLN 64 2HE2 GLN 64 -8.482 6.053 -15.211 450 H LYS 65 H LYS 65 -8.056 6.693 -22.157 451 HA LYS 65 HA LYS 65 -5.965 8.309 -21.237 452 1HB LYS 65 1HB LYS 65 -6.528 6.549 -23.517 453 2HB LYS 65 2HB LYS 65 -5.483 7.892 -23.933 454 1HG LYS 65 1HG LYS 65 -3.872 6.429 -23.137 455 2HG LYS 65 2HG LYS 65 -4.272 7.227 -21.628 456 1HD LYS 65 1HD LYS 65 -4.537 5.045 -20.916 457 2HD LYS 65 2HD LYS 65 -6.158 5.297 -21.531 458 1HE LYS 65 1HE LYS 65 -4.830 4.518 -23.834 459 2HE LYS 65 2HE LYS 65 -3.964 3.600 -22.618 460 H GLN 66 H GLN 66 -8.633 8.844 -23.581 461 HA GLN 66 HA GLN 66 -7.621 11.264 -24.532 462 1HB GLN 66 1HB GLN 66 -9.693 9.592 -25.222 463 2HB GLN 66 2HB GLN 66 -10.580 10.916 -24.495 464 1HG GLN 66 1HG GLN 66 -10.246 11.255 -26.946 465 2HG GLN 66 2HG GLN 66 -9.513 12.538 -26.004 466 1HE2 GLN 66 1HE2 GLN 66 -7.988 13.122 -27.452 467 2HE2 GLN 66 2HE2 GLN 66 -6.638 12.142 -27.921 468 H GLU 67 H GLU 67 -10.186 10.504 -22.069 469 HA GLU 67 HA GLU 67 -10.652 13.154 -21.412 470 1HB GLU 67 1HB GLU 67 -12.348 12.002 -20.451 471 2HB GLU 67 2HB GLU 67 -11.433 10.507 -20.454 472 1HG GLU 67 1HG GLU 67 -10.988 12.724 -18.403 473 2HG GLU 67 2HG GLU 67 -12.098 11.393 -18.143 474 HE2 GLU 67 HE GLU 67 -10.353 8.991 -17.814 475 H LEU 68 H LEU 68 -8.038 10.964 -20.614 476 HA LEU 68 HA LEU 68 -7.267 12.222 -18.192 477 1HB LEU 68 1HB LEU 68 -6.127 10.201 -20.061 478 2HB LEU 68 2HB LEU 68 -5.032 11.002 -18.952 479 HG LEU 68 HG LEU 68 -7.544 9.555 -18.074 480 1HD1 LEU 68 3HD1 LEU 68 -5.218 8.394 -19.129 481 2HD1 LEU 68 1HD1 LEU 68 -5.085 8.214 -17.363 482 3HD1 LEU 68 2HD1 LEU 68 -6.518 7.592 -18.216 483 1HD2 LEU 68 2HD2 LEU 68 -6.617 11.336 -16.567 484 2HD2 LEU 68 3HD2 LEU 68 -6.680 9.705 -15.857 485 3HD2 LEU 68 1HD2 LEU 68 -5.131 10.364 -16.436 486 H ASP 69 H ASP 69 -5.943 12.335 -21.577 487 HA ASP 69 HA ASP 69 -4.120 14.331 -20.995 488 1HB ASP 69 1HB ASP 69 -4.721 12.747 -23.173 489 2HB ASP 69 2HB ASP 69 -5.305 14.300 -23.736 490 HD2 ASP 69 HD ASP 69 -2.773 13.448 -25.115 491 H GLU 70 H GLU 70 -7.424 14.386 -22.524 492 HA GLU 70 HA GLU 70 -7.654 16.973 -23.143 493 1HB GLU 70 1HB GLU 70 -9.914 16.554 -23.331 494 2HB GLU 70 2HB GLU 70 -9.360 14.902 -23.154 495 1HG GLU 70 1HG GLU 70 -9.804 14.991 -20.707 496 2HG GLU 70 2HG GLU 70 -10.301 16.666 -20.843 497 HE2 GLU 70 HE GLU 70 -11.512 15.012 -23.569 498 H ILE 71 H ILE 71 -7.991 15.501 -19.871 499 HA ILE 71 HA ILE 71 -8.673 18.023 -18.686 500 HB ILE 71 HB ILE 71 -8.247 15.221 -17.740 501 1HG1 ILE 71 1HG1 ILE 71 -10.526 17.060 -17.055 502 2HG1 ILE 71 2HG1 ILE 71 -10.446 16.322 -18.642 503 1HG2 ILE 71 2HG2 ILE 71 -7.727 17.649 -16.165 504 2HG2 ILE 71 3HG2 ILE 71 -8.899 16.529 -15.428 505 3HG2 ILE 71 1HG2 ILE 71 -7.271 15.955 -15.863 506 1HD1 ILE 71 2HD1 ILE 71 -10.039 14.077 -17.330 507 2HD1 ILE 71 3HD1 ILE 71 -10.698 14.974 -15.941 508 3HD1 ILE 71 1HD1 ILE 71 -11.687 14.746 -17.404 509 H SER 72 H SER 72 -5.820 15.776 -18.598 510 HA SER 72 HA SER 72 -4.244 17.367 -17.037 511 1HB SER 72 1HB SER 72 -3.095 15.431 -17.303 512 2HB SER 72 2HB SER 72 -3.907 15.067 -18.813 513 HG SER 72 HG SER 72 -1.567 15.372 -19.031 514 H THR 73 H THR 73 -5.308 17.801 -20.337 515 HA THR 73 HA THR 73 -3.150 19.673 -20.935 516 HB THR 73 HB THR 73 -5.403 18.332 -22.489 517 HG1 THR 73 1HG THR 73 -2.495 18.655 -22.735 518 1HG2 THR 73 3HG2 THR 73 -4.168 20.929 -23.048 519 2HG2 THR 73 1HG2 THR 73 -3.674 19.728 -24.266 520 3HG2 THR 73 2HG2 THR 73 -5.401 20.057 -23.990 521 H ASN 74 H ASN 74 -6.572 19.574 -19.998 522 HA ASN 74 HA ASN 74 -7.395 22.009 -20.786 523 1HB ASN 74 1HB ASN 74 -8.098 20.086 -18.689 524 2HB ASN 74 2HB ASN 74 -8.339 21.719 -18.101 525 1HD2 ASN 74 1HD2 ASN 74 -9.732 19.201 -19.678 526 2HD2 ASN 74 2HD2 ASN 74 -11.000 20.001 -20.545 527 H ILE 75 H ILE 75 -5.760 21.139 -17.641 528 HA ILE 75 HA ILE 75 -5.577 23.733 -16.662 529 HB ILE 75 HB ILE 75 -3.714 21.420 -16.126 530 1HG1 ILE 75 1HG1 ILE 75 -5.666 21.546 -14.116 531 2HG1 ILE 75 2HG1 ILE 75 -6.562 21.703 -15.613 532 1HG2 ILE 75 2HG2 ILE 75 -3.556 24.019 -15.237 533 2HG2 ILE 75 3HG2 ILE 75 -4.451 23.211 -13.928 534 3HG2 ILE 75 1HG2 ILE 75 -2.858 22.594 -14.429 535 1HD1 ILE 75 1HD1 ILE 75 -5.099 19.698 -16.459 536 2HD1 ILE 75 2HD1 ILE 75 -4.740 19.445 -14.734 537 3HD1 ILE 75 3HD1 ILE 75 -6.420 19.362 -15.314 538 H ARG 76 H ARG 76 -3.336 21.789 -18.719 539 HA ARG 76 HA ARG 76 -1.219 23.464 -18.702 540 1HB ARG 76 1HB ARG 76 -2.167 21.267 -20.297 541 2HB ARG 76 2HB ARG 76 -1.636 22.506 -21.417 542 1HG ARG 76 1HG ARG 76 0.557 22.150 -20.924 543 2HG ARG 76 2HG ARG 76 0.261 22.237 -19.199 544 1HD ARG 76 1HD ARG 76 0.337 19.973 -18.996 545 2HD ARG 76 2HD ARG 76 -0.860 19.760 -20.257 546 HE ARG 76 HE ARG 76 2.045 19.592 -20.564 547 2HH1 ARG 76 1HH ARG 76 1.927 19.039 -23.991 548 1HH2 ARG 76 2HH2 ARG 76 -1.002 20.176 -22.277 549 2HH2 ARG 76 1HH2 ARG 76 -0.362 19.727 -23.823 550 H GLN 77 H GLN 77 -4.288 23.697 -20.557 551 HA GLN 77 HA GLN 77 -3.342 25.909 -22.079 552 1HB GLN 77 1HB GLN 77 -6.144 24.747 -21.754 553 2HB GLN 77 2HB GLN 77 -5.703 25.974 -22.925 554 1HG GLN 77 1HG GLN 77 -3.825 23.767 -23.125 555 2HG GLN 77 2HG GLN 77 -5.456 23.129 -23.182 556 1HE2 GLN 77 1HE2 GLN 77 -3.522 23.198 -25.286 557 2HE2 GLN 77 2HE2 GLN 77 -4.169 24.127 -26.597 558 H ALA 78 H ALA 78 -4.718 25.400 -18.932 559 HA ALA 78 HA ALA 78 -6.168 27.778 -18.642 560 1HB ALA 78 3HB ALA 78 -4.655 26.411 -16.408 561 2HB ALA 78 1HB ALA 78 -6.255 27.188 -16.367 562 3HB ALA 78 2HB ALA 78 -6.048 25.620 -17.183 563 H GLY 79 H GLY 79 -2.748 27.100 -18.882 564 1HA GLY 79 2HA GLY 79 -2.180 29.886 -18.062 565 2HA GLY 79 1HA GLY 79 -1.383 29.046 -19.378 566 H VAL 80 H VAL 80 -1.576 26.475 -17.540 567 HA VAL 80 HA VAL 80 0.522 27.214 -15.643 568 HB VAL 80 HB VAL 80 -0.782 24.527 -15.754 569 1HG1 VAL 80 2HG1 VAL 80 0.751 26.163 -13.843 570 2HG1 VAL 80 3HG1 VAL 80 -0.664 25.346 -13.136 571 3HG1 VAL 80 1HG1 VAL 80 0.587 24.395 -13.972 572 1HG2 VAL 80 1HG2 VAL 80 -2.100 27.077 -14.785 573 2HG2 VAL 80 2HG2 VAL 80 -2.727 25.881 -15.944 574 3HG2 VAL 80 3HG2 VAL 80 -2.584 25.459 -14.221 575 H GLN 81 H GLN 81 2.332 27.374 -17.021 576 HA GLN 81 HA GLN 81 3.237 24.785 -17.932 577 1HB GLN 81 1HB GLN 81 3.611 25.385 -20.152 578 2HB GLN 81 2HB GLN 81 2.119 26.244 -19.828 579 1HG GLN 81 1HG GLN 81 3.937 28.126 -19.000 580 2HG GLN 81 2HG GLN 81 4.881 27.320 -20.237 581 1HE2 GLN 81 1HE2 GLN 81 4.411 27.567 -22.345 582 2HE2 GLN 81 2HE2 GLN 81 3.163 28.588 -22.978 583 H TYR 82 H TYR 82 3.708 27.191 -15.881 584 HA TYR 82 HA TYR 82 6.542 26.815 -15.807 585 1HB TYR 82 1HB TYR 82 7.051 29.221 -16.143 586 2HB TYR 82 2HB TYR 82 6.123 28.677 -17.527 587 HD1 TYR 82 1HD TYR 82 3.439 28.914 -17.143 588 HD2 TYR 82 2HD TYR 82 6.457 31.261 -15.223 589 HE1 TYR 82 1HE TYR 82 1.745 30.764 -16.726 590 HE2 TYR 82 2HE TYR 82 4.754 33.103 -14.812 591 HH TYR 82 HH TYR 82 1.681 32.737 -14.772 592 H SER 83 H SER 83 5.946 25.923 -13.732 593 HA SER 83 HA SER 83 5.587 28.035 -11.793 594 1HB SER 83 1HB SER 83 3.361 27.406 -11.719 595 2HB SER 83 2HB SER 83 3.682 25.784 -12.300 596 HG SER 83 HG SER 83 4.222 26.786 -9.635 597 H ARG 84 H ARG 84 5.764 24.402 -12.075 598 HA ARG 84 HA ARG 84 7.548 24.385 -9.835 599 1HB ARG 84 1HB ARG 84 5.651 22.666 -10.324 600 2HB ARG 84 2HB ARG 84 6.719 21.992 -11.538 601 1HG ARG 84 1HG ARG 84 8.322 22.295 -9.202 602 2HG ARG 84 2HG ARG 84 6.791 21.654 -8.639 603 1HD ARG 84 1HD ARG 84 7.449 19.599 -9.346 604 2HD ARG 84 2HD ARG 84 7.366 20.181 -10.996 605 HE ARG 84 HE ARG 84 9.703 20.307 -11.047 606 2HH1 ARG 84 1HH ARG 84 12.107 19.936 -8.568 607 1HH2 ARG 84 2HH2 ARG 84 8.647 20.119 -7.670 608 2HH2 ARG 84 1HH2 ARG 84 10.254 19.952 -7.047 609 H ALA 85 H ALA 85 7.530 23.580 -13.361 610 HA ALA 85 HA ALA 85 10.345 22.922 -13.289 611 1HB ALA 85 1HB ALA 85 8.225 22.035 -14.774 612 2HB ALA 85 2HB ALA 85 8.936 23.232 -15.883 613 3HB ALA 85 3HB ALA 85 9.928 21.887 -15.272 614 H ASP 86 H ASP 86 10.212 25.418 -12.288 615 HA ASP 86 HA ASP 86 10.164 27.400 -14.276 616 1HB ASP 86 1HB ASP 86 10.054 27.397 -11.544 617 2HB ASP 86 2HB ASP 86 11.739 27.828 -11.757 618 HD2 ASP 86 HD ASP 86 11.975 29.589 -13.388 619 H GLU 87 H GLU 87 12.526 25.103 -13.028 620 HA GLU 87 HA GLU 87 14.702 26.620 -14.202 621 1HB GLU 87 1HB GLU 87 16.187 25.080 -12.993 622 2HB GLU 87 2HB GLU 87 15.011 25.769 -11.892 623 1HG GLU 87 1HG GLU 87 13.911 23.346 -13.069 624 2HG GLU 87 2HG GLU 87 15.502 22.999 -12.421 625 HE2 GLU 87 HE GLU 87 12.927 22.189 -11.035 626 H GLU 88 H GLU 88 12.396 24.749 -15.418 627 HA GLU 88 HA GLU 88 13.389 22.511 -16.476 628 1HB GLU 88 1HB GLU 88 11.084 23.331 -16.831 629 2HB GLU 88 2HB GLU 88 11.671 24.592 -17.898 630 1HG GLU 88 1HG GLU 88 11.576 23.159 -19.649 631 2HG GLU 88 2HG GLU 88 12.763 22.129 -18.874 632 HE2 GLU 88 HE GLU 88 10.522 20.076 -17.341 633 H GLN 89 H GLN 89 13.902 25.868 -17.723 634 HA GLN 89 HA GLN 89 15.156 25.339 -20.032 635 1HB GLN 89 1HB GLN 89 15.635 27.485 -17.942 636 2HB GLN 89 2HB GLN 89 16.562 27.469 -19.429 637 1HG GLN 89 1HG GLN 89 14.224 27.271 -20.623 638 2HG GLN 89 2HG GLN 89 13.562 27.800 -19.089 639 1HE2 GLN 89 1HE2 GLN 89 13.644 29.088 -21.727 640 2HE2 GLN 89 2HE2 GLN 89 14.388 30.638 -21.514 641 H GLN 90 H GLN 90 16.676 25.442 -16.739 642 HA GLN 90 HA GLN 90 19.238 24.894 -17.634 643 1HB GLN 90 1HB GLN 90 18.533 25.767 -15.349 644 2HB GLN 90 2HB GLN 90 18.047 24.135 -14.933 645 1HG GLN 90 1HG GLN 90 20.419 23.372 -15.512 646 2HG GLN 90 2HG GLN 90 20.856 25.060 -15.690 647 1HE2 GLN 90 1HE2 GLN 90 22.254 23.745 -13.921 648 2HE2 GLN 90 2HE2 GLN 90 21.820 24.109 -12.285 649 H GLN 91 H GLN 91 16.572 22.734 -16.490 650 HA GLN 91 HA GLN 91 18.062 20.400 -16.595 651 1HB GLN 91 1HB GLN 91 15.484 21.122 -15.838 652 2HB GLN 91 2HB GLN 91 15.187 20.108 -17.236 653 1HG GLN 91 1HG GLN 91 15.852 18.205 -16.154 654 2HG GLN 91 2HG GLN 91 17.251 18.985 -15.443 655 1HE2 GLN 91 1HE2 GLN 91 13.756 18.588 -15.209 656 2HE2 GLN 91 2HE2 GLN 91 13.599 18.881 -13.509 657 H ALA 92 H ALA 92 16.301 22.261 -19.078 658 HA ALA 92 HA ALA 92 16.225 20.240 -21.028 659 1HB ALA 92 2HB ALA 92 15.892 22.216 -22.568 660 2HB ALA 92 3HB ALA 92 14.790 22.179 -21.171 661 3HB ALA 92 1HB ALA 92 16.188 23.279 -21.171 662 H LEU 93 H LEU 93 18.478 23.062 -20.576 663 HA LEU 93 HA LEU 93 20.277 21.923 -22.515 664 1HB LEU 93 1HB LEU 93 19.686 24.405 -22.119 665 2HB LEU 93 2HB LEU 93 20.807 24.314 -20.775 666 HG LEU 93 HG LEU 93 21.480 23.748 -23.676 667 1HD1 LEU 93 3HD1 LEU 93 21.012 26.190 -22.667 668 2HD1 LEU 93 1HD1 LEU 93 22.721 26.009 -22.203 669 3HD1 LEU 93 2HD1 LEU 93 22.243 25.866 -23.911 670 1HD2 LEU 93 1HD2 LEU 93 22.820 22.386 -22.141 671 2HD2 LEU 93 2HD2 LEU 93 23.806 23.631 -22.946 672 3HD2 LEU 93 3HD2 LEU 93 23.300 23.853 -21.254 673 H SER 94 H SER 94 20.090 19.920 -20.835 674 HA SER 94 HA SER 94 22.580 20.106 -19.364 675 1HB SER 94 1HB SER 94 20.447 20.388 -17.871 676 2HB SER 94 2HB SER 94 20.190 18.678 -18.156 677 HG SER 94 HG SER 94 21.767 19.768 -16.309 678 H SER 95 H SER 95 21.414 18.901 -21.968 679 HA SER 95 HA SER 95 21.708 16.090 -21.366 680 1HB SER 95 1HB SER 95 20.621 17.691 -23.673 681 2HB SER 95 2HB SER 95 21.220 16.079 -24.010 682 HG SER 95 HG SER 95 19.786 15.493 -22.023 683 H GLN 96 H GLN 96 23.294 18.830 -23.012 684 HA GLN 96 HA GLN 96 25.310 17.049 -24.064 685 1HB GLN 96 1HB GLN 96 24.251 19.016 -25.371 686 2HB GLN 96 2HB GLN 96 25.209 20.075 -24.355 687 1HG GLN 96 1HG GLN 96 26.857 17.895 -25.415 688 2HG GLN 96 2HG GLN 96 26.054 18.750 -26.717 689 1HE2 GLN 96 1HE2 GLN 96 28.692 18.674 -24.722 690 2HE2 GLN 96 2HE2 GLN 96 29.269 20.300 -24.877 691 H MET 97 H MET 97 24.817 17.790 -21.088 692 HA MET 97 HA MET 97 27.411 19.007 -20.578 693 1HB MET 97 1HB MET 97 26.502 19.577 -18.379 694 2HB MET 97 2HB MET 97 25.278 19.997 -19.562 695 1HG MET 97 1HG MET 97 23.797 18.599 -18.558 696 2HG MET 97 2HG MET 97 24.862 17.236 -18.841 697 1HE MET 97 2HE MET 97 24.668 15.887 -17.163 698 2HE MET 97 3HE MET 97 25.130 16.104 -15.458 699 3HE MET 97 1HE MET 97 23.509 16.590 -16.010 700 H GLY 98 H GLY 98 28.620 18.120 -18.599 701 1HA GLY 98 2HA GLY 98 28.053 15.370 -17.893 702 2HA GLY 98 1HA GLY 98 29.332 16.397 -17.276 703 H PHE 99 H PHE 99 29.461 13.579 -18.287 704 HA PHE 99 HA PHE 99 31.526 14.059 -20.303 705 1HB PHE 99 1HB PHE 99 32.596 12.179 -19.303 706 2HB PHE 99 2HB PHE 99 31.764 12.859 -17.919 707 HD1 PHE 99 1HD PHE 99 31.307 10.342 -20.627 708 HD2 PHE 99 2HD PHE 99 30.336 11.520 -16.668 709 HE1 PHE 99 1HE PHE 99 30.119 8.160 -20.270 710 HE2 PHE 99 2HE PHE 99 29.148 9.338 -16.310 711 HZ PHE 99 HZ PHE 99 29.054 7.684 -18.115 712 H MET 601 H MET 601 9.576 -17.915 -19.053 713 HA MET 601 HA MET 601 7.850 -18.389 -20.892 714 1HB MET 601 1HB MET 601 10.893 -18.587 -21.161 715 2HB MET 601 2HB MET 601 9.855 -18.542 -22.573 716 1HG MET 601 1HG MET 601 8.822 -16.392 -21.342 717 2HG MET 601 2HG MET 601 10.375 -16.375 -20.530 718 1HE MET 601 2HE MET 601 8.432 -15.003 -22.941 719 2HE MET 601 3HE MET 601 9.423 -14.515 -24.338 720 3HE MET 601 1HE MET 601 8.696 -16.139 -24.286 721 H THR 602 H THR 602 7.387 -20.719 -19.553 722 HA THR 602 HA THR 602 8.654 -23.002 -20.549 723 HB THR 602 HB THR 602 7.218 -22.854 -18.491 724 HG1 THR 602 1HG THR 602 7.564 -24.881 -19.731 725 1HG2 THR 602 1HG2 THR 602 5.371 -21.438 -19.607 726 2HG2 THR 602 2HG2 THR 602 4.878 -22.921 -20.458 727 3HG2 THR 602 3HG2 THR 602 4.796 -22.846 -18.682 728 H GLU 603 H GLU 603 5.728 -21.231 -21.707 729 HA GLU 603 HA GLU 603 6.215 -22.478 -24.270 730 1HB GLU 603 1HB GLU 603 3.634 -22.672 -22.687 731 2HB GLU 603 2HB GLU 603 3.618 -22.763 -24.437 732 1HG GLU 603 1HG GLU 603 5.569 -24.503 -22.917 733 2HG GLU 603 2HG GLU 603 3.880 -24.969 -22.949 734 HE2 GLU 603 HE GLU 603 4.466 -26.521 -25.919 735 H GLN 604 H GLN 604 6.487 -20.781 -25.648 736 HA GLN 604 HA GLN 604 5.807 -18.205 -25.027 737 1HB GLN 604 1HB GLN 604 6.169 -17.773 -27.501 738 2HB GLN 604 2HB GLN 604 7.470 -18.640 -26.710 739 1HG GLN 604 1HG GLN 604 7.252 -20.247 -28.297 740 2HG GLN 604 2HG GLN 604 5.728 -20.686 -27.553 741 1HE2 GLN 604 1HE2 GLN 604 7.283 -19.438 -30.276 742 2HE2 GLN 604 2HE2 GLN 604 5.908 -18.951 -31.210 743 H GLN 605 H GLN 605 3.939 -20.770 -26.674 744 HA GLN 605 HA GLN 605 2.021 -19.336 -27.897 745 1HB GLN 605 1HB GLN 605 1.641 -21.897 -26.283 746 2HB GLN 605 2HB GLN 605 0.524 -21.302 -27.495 747 1HG GLN 605 1HG GLN 605 3.126 -21.309 -28.706 748 2HG GLN 605 2HG GLN 605 2.955 -22.841 -27.872 749 1HE2 GLN 605 1HE2 GLN 605 1.742 -24.398 -28.709 750 2HE2 GLN 605 2HE2 GLN 605 0.730 -24.267 -30.108 751 H TRP 606 H TRP 606 2.369 -20.025 -24.392 752 HA TRP 606 HA TRP 606 0.820 -17.768 -23.710 753 1HB TRP 606 1HB TRP 606 -1.122 -18.716 -22.790 754 2HB TRP 606 2HB TRP 606 -0.996 -19.328 -24.427 755 HD1 TRP 606 HD TRP 606 -0.558 -21.996 -24.699 756 HE1 TRP 606 1HE TRP 606 -0.765 -24.090 -23.106 757 HE3 TRP 606 3HE TRP 606 -0.769 -19.341 -20.368 758 HZ2 TRP 606 2HZ TRP 606 -0.989 -24.394 -20.278 759 HZ3 TRP 606 3HZ TRP 606 -0.982 -20.613 -18.235 760 HH2 TRP 606 HH TRP 606 -1.092 -23.053 -18.144 761 H ASN 607 H ASN 607 2.637 -17.273 -22.425 762 HA ASN 607 HA ASN 607 4.086 -19.023 -20.958 763 1HB ASN 607 1HB ASN 607 4.856 -16.743 -21.187 764 2HB ASN 607 2HB ASN 607 3.379 -16.090 -20.507 765 1HD2 ASN 607 1HD2 ASN 607 5.197 -14.982 -19.287 766 2HD2 ASN 607 2HD2 ASN 607 5.678 -15.680 -17.776 767 H PHE 608 H PHE 608 3.473 -20.367 -19.257 768 HA PHE 608 HA PHE 608 0.949 -20.134 -18.047 769 1HB PHE 608 1HB PHE 608 2.497 -22.189 -18.407 770 2HB PHE 608 2HB PHE 608 3.495 -21.578 -17.102 771 HD1 PHE 608 1HD PHE 608 2.221 -21.133 -14.838 772 HD2 PHE 608 2HD PHE 608 0.818 -23.701 -17.912 773 HE1 PHE 608 1HE PHE 608 0.783 -22.341 -13.173 774 HE2 PHE 608 2HE PHE 608 -0.620 -24.909 -16.246 775 HZ PHE 608 HZ PHE 608 -0.620 -24.215 -13.897 776 H ALA 609 H ALA 609 4.295 -19.271 -16.996 777 HA ALA 609 HA ALA 609 3.450 -18.496 -14.390 778 1HB ALA 609 2HB ALA 609 5.778 -17.613 -14.254 779 2HB ALA 609 1HB ALA 609 5.989 -17.966 -15.986 780 3HB ALA 609 3HB ALA 609 5.718 -19.295 -14.833 781 H GLY 610 H GLY 610 2.886 -17.191 -17.445 782 1HA GLY 610 2HA GLY 610 2.840 -14.960 -18.177 783 2HA GLY 610 1HA GLY 610 3.033 -14.402 -16.527 784 H ILE 611 H ILE 611 0.739 -16.499 -18.427 785 HA ILE 611 HA ILE 611 -1.451 -14.844 -18.057 786 HB ILE 611 HB ILE 611 -1.154 -16.664 -19.738 787 1HG1 ILE 611 1HG1 ILE 611 -3.367 -15.491 -18.985 788 2HG1 ILE 611 2HG1 ILE 611 -3.418 -16.863 -20.074 789 1HG2 ILE 611 2HG2 ILE 611 -1.619 -18.378 -17.307 790 2HG2 ILE 611 3HG2 ILE 611 -2.079 -18.936 -18.933 791 3HG2 ILE 611 1HG2 ILE 611 -0.383 -18.528 -18.578 792 1HD1 ILE 611 1HD1 ILE 611 -3.524 -18.222 -17.736 793 2HD1 ILE 611 2HD1 ILE 611 -4.241 -16.685 -17.197 794 3HD1 ILE 611 3HD1 ILE 611 -4.983 -17.591 -18.537 795 H GLU 612 H GLU 612 0.129 -17.124 -15.892 796 HA GLU 612 HA GLU 612 -2.100 -17.530 -14.234 797 1HB GLU 612 1HB GLU 612 -0.233 -19.103 -14.236 798 2HB GLU 612 2HB GLU 612 0.892 -17.848 -13.755 799 1HG GLU 612 1HG GLU 612 0.496 -18.563 -11.624 800 2HG GLU 612 2HG GLU 612 -0.997 -17.654 -11.747 801 HE2 GLU 612 HE GLU 612 -1.073 -21.495 -11.278 802 H ALA 613 H ALA 613 0.881 -15.469 -13.889 803 HA ALA 613 HA ALA 613 -0.209 -14.138 -11.605 804 1HB ALA 613 1HB ALA 613 1.874 -12.993 -11.564 805 2HB ALA 613 3HB ALA 613 2.156 -13.276 -13.299 806 3HB ALA 613 2HB ALA 613 2.256 -14.630 -12.148 807 H ALA 614 H ALA 614 -0.574 -13.900 -15.037 808 HA ALA 614 HA ALA 614 -0.782 -11.207 -15.484 809 1HB ALA 614 2HB ALA 614 -2.476 -13.485 -16.589 810 2HB ALA 614 3HB ALA 614 -2.323 -11.867 -17.314 811 3HB ALA 614 1HB ALA 614 -0.905 -12.939 -17.223 812 H ALA 615 H ALA 615 -3.346 -13.490 -14.300 813 HA ALA 615 HA ALA 615 -5.365 -11.613 -14.073 814 1HB ALA 615 1HB ALA 615 -6.518 -13.316 -13.020 815 2HB ALA 615 2HB ALA 615 -5.216 -14.262 -13.779 816 3HB ALA 615 3HB ALA 615 -5.110 -13.822 -12.057 817 H SER 616 H SER 616 -2.895 -12.692 -11.645 818 HA SER 616 HA SER 616 -3.779 -11.175 -9.565 819 1HB SER 616 1HB SER 616 -1.579 -12.814 -10.110 820 2HB SER 616 2HB SER 616 -0.836 -11.263 -9.773 821 HG SER 616 HG SER 616 -2.799 -12.523 -8.056 822 H ALA 617 H ALA 617 -2.013 -10.241 -12.499 823 HA ALA 617 HA ALA 617 -1.148 -7.717 -11.498 824 1HB ALA 617 1HB ALA 617 -0.527 -9.346 -13.641 825 2HB ALA 617 3HB ALA 617 -0.003 -7.656 -13.451 826 3HB ALA 617 2HB ALA 617 -1.449 -8.036 -14.417 827 H ILE 618 H ILE 618 -3.953 -8.970 -13.376 828 HA ILE 618 HA ILE 618 -5.028 -6.497 -14.061 829 HB ILE 618 HB ILE 618 -6.364 -9.160 -13.567 830 1HG1 ILE 618 1HG1 ILE 618 -4.565 -9.208 -15.259 831 2HG1 ILE 618 2HG1 ILE 618 -6.149 -9.523 -15.939 832 1HG2 ILE 618 3HG2 ILE 618 -7.988 -7.332 -13.475 833 2HG2 ILE 618 1HG2 ILE 618 -7.403 -6.725 -15.043 834 3HG2 ILE 618 2HG2 ILE 618 -8.197 -8.315 -14.944 835 1HD1 ILE 618 3HD1 ILE 618 -5.626 -6.657 -15.969 836 2HD1 ILE 618 1HD1 ILE 618 -4.298 -7.539 -16.762 837 3HD1 ILE 618 2HD1 ILE 618 -5.971 -7.747 -17.332 838 H GLN 619 H GLN 619 -5.507 -8.591 -11.152 839 HA GLN 619 HA GLN 619 -7.460 -7.067 -9.984 840 1HB GLN 619 1HB GLN 619 -5.652 -9.216 -9.216 841 2HB GLN 619 2HB GLN 619 -5.829 -8.087 -7.888 842 1HG GLN 619 1HG GLN 619 -8.180 -9.294 -9.420 843 2HG GLN 619 2HG GLN 619 -7.561 -9.941 -7.913 844 1HE2 GLN 619 1HE2 GLN 619 -10.049 -8.390 -9.000 845 2HE2 GLN 619 2HE2 GLN 619 -10.396 -7.240 -7.752 846 H GLY 620 H GLY 620 -3.893 -7.012 -9.240 847 1HA GLY 620 2HA GLY 620 -2.559 -5.365 -8.497 848 2HA GLY 620 1HA GLY 620 -3.929 -4.802 -7.561 849 H ASN 621 H ASN 621 -3.894 -5.043 -11.143 850 HA ASN 621 HA ASN 621 -3.218 -2.331 -11.495 851 1HB ASN 621 1HB ASN 621 -4.246 -4.572 -13.263 852 2HB ASN 621 2HB ASN 621 -4.286 -2.934 -13.886 853 1HD2 ASN 621 1HD2 ASN 621 -2.099 -1.743 -12.956 854 2HD2 ASN 621 2HD2 ASN 621 -0.644 -2.512 -13.497 855 H VAL 622 H VAL 622 -6.183 -4.264 -11.079 856 HA VAL 622 HA VAL 622 -7.996 -2.361 -12.103 857 HB VAL 622 HB VAL 622 -8.204 -4.752 -10.286 858 1HG1 VAL 622 3HG1 VAL 622 -10.347 -2.769 -11.046 859 2HG1 VAL 622 1HG1 VAL 622 -10.744 -4.476 -10.735 860 3HG1 VAL 622 2HG1 VAL 622 -9.990 -3.491 -9.458 861 1HG2 VAL 622 2HG2 VAL 622 -7.918 -4.580 -12.999 862 2HG2 VAL 622 3HG2 VAL 622 -8.697 -5.934 -12.145 863 3HG2 VAL 622 1HG2 VAL 622 -9.690 -4.628 -12.836 864 H THR 623 H THR 623 -7.013 -3.243 -8.716 865 HA THR 623 HA THR 623 -8.496 -1.196 -7.504 866 HB THR 623 HB THR 623 -7.007 -1.768 -5.552 867 HG1 THR 623 1HG THR 623 -5.000 -2.297 -6.360 868 1HG2 THR 623 1HG2 THR 623 -8.128 -3.989 -7.297 869 2HG2 THR 623 2HG2 THR 623 -7.200 -4.398 -5.834 870 3HG2 THR 623 3HG2 THR 623 -8.691 -3.436 -5.702 871 H SER 624 H SER 624 -5.220 -1.262 -8.935 872 HA SER 624 HA SER 624 -4.234 1.019 -7.851 873 1HB SER 624 1HB SER 624 -3.908 -0.190 -10.622 874 2HB SER 624 2HB SER 624 -3.003 1.227 -10.129 875 HG SER 624 HG SER 624 -3.017 -1.162 -8.515 876 H ILE 625 H ILE 625 -6.373 0.620 -10.747 877 HA ILE 625 HA ILE 625 -6.449 3.416 -11.273 878 HB ILE 625 HB ILE 625 -7.670 0.945 -12.360 879 1HG1 ILE 625 1HG1 ILE 625 -7.037 2.737 -14.397 880 2HG1 ILE 625 2HG1 ILE 625 -5.822 3.055 -13.176 881 1HG2 ILE 625 2HG2 ILE 625 -8.935 3.675 -12.648 882 2HG2 ILE 625 3HG2 ILE 625 -9.187 2.351 -13.811 883 3HG2 ILE 625 1HG2 ILE 625 -9.692 2.155 -12.116 884 1HD1 ILE 625 1HD1 ILE 625 -6.510 0.215 -14.019 885 2HD1 ILE 625 2HD1 ILE 625 -5.300 1.189 -14.887 886 3HD1 ILE 625 3HD1 ILE 625 -5.055 0.790 -13.170 887 H HIS 626 H HIS 626 -8.249 1.125 -9.254 888 HA HIS 626 HA HIS 626 -10.573 2.601 -8.942 889 1HB HIS 626 1HB HIS 626 -10.105 0.211 -8.254 890 2HB HIS 626 2HB HIS 626 -9.261 0.844 -6.855 891 HD1 HIS 626 1HD HIS 626 -11.149 -0.470 -5.453 892 HD2 HIS 626 2HD HIS 626 -12.473 2.833 -7.675 893 HE1 HIS 626 1HE HIS 626 -13.455 0.129 -4.539 894 H SER 627 H SER 627 -7.466 2.642 -7.083 895 HA SER 627 HA SER 627 -8.436 4.742 -5.429 896 1HB SER 627 1HB SER 627 -5.970 3.078 -5.641 897 2HB SER 627 2HB SER 627 -5.723 4.687 -4.992 898 HG SER 627 HG SER 627 -7.918 3.760 -3.768 899 H LEU 628 H LEU 628 -6.050 4.363 -8.128 900 HA LEU 628 HA LEU 628 -4.950 6.822 -8.219 901 1HB LEU 628 1HB LEU 628 -5.615 4.732 -10.192 902 2HB LEU 628 2HB LEU 628 -5.322 6.324 -10.863 903 HG LEU 628 HG LEU 628 -3.364 5.105 -8.928 904 1HD1 LEU 628 3HD1 LEU 628 -3.856 4.314 -11.760 905 2HD1 LEU 628 1HD1 LEU 628 -2.168 4.476 -11.218 906 3HD1 LEU 628 2HD1 LEU 628 -3.268 3.355 -10.381 907 1HD2 LEU 628 3HD2 LEU 628 -3.337 7.559 -9.709 908 2HD2 LEU 628 1HD2 LEU 628 -1.822 6.627 -9.787 909 3HD2 LEU 628 2HD2 LEU 628 -2.771 6.908 -11.266 910 H LEU 629 H LEU 629 -8.086 5.879 -9.795 911 HA LEU 629 HA LEU 629 -8.726 8.352 -10.791 912 1HB LEU 629 1HB LEU 629 -10.004 5.829 -10.331 913 2HB LEU 629 2HB LEU 629 -11.109 7.115 -9.889 914 HG LEU 629 HG LEU 629 -11.300 6.302 -12.251 915 1HD1 LEU 629 1HD1 LEU 629 -10.942 9.139 -11.437 916 2HD1 LEU 629 2HD1 LEU 629 -11.049 8.799 -13.181 917 3HD1 LEU 629 3HD1 LEU 629 -12.365 8.296 -12.094 918 1HD2 LEU 629 2HD2 LEU 629 -8.483 6.734 -12.237 919 2HD2 LEU 629 3HD2 LEU 629 -9.509 6.079 -13.535 920 3HD2 LEU 629 1HD2 LEU 629 -9.209 7.831 -13.436 921 H ASP 630 H ASP 630 -9.248 7.008 -7.486 922 HA ASP 630 HA ASP 630 -10.735 9.159 -6.572 923 1HB ASP 630 1HB ASP 630 -9.227 6.871 -5.407 924 2HB ASP 630 2HB ASP 630 -9.381 8.242 -4.328 925 HD2 ASP 630 HD ASP 630 -12.013 6.419 -6.288 926 H GLU 631 H GLU 631 -7.267 8.585 -7.076 927 HA GLU 631 HA GLU 631 -6.408 10.651 -5.346 928 1HB GLU 631 1HB GLU 631 -5.207 8.604 -7.043 929 2HB GLU 631 2HB GLU 631 -4.382 10.134 -7.267 930 1HG GLU 631 1HG GLU 631 -4.892 8.747 -4.593 931 2HG GLU 631 2HG GLU 631 -3.350 8.855 -5.418 932 HE2 GLU 631 HE GLU 631 -3.052 12.331 -4.672 933 H GLY 632 H GLY 632 -6.841 10.284 -8.923 934 1HA GLY 632 2HA GLY 632 -6.862 11.807 -10.585 935 2HA GLY 632 1HA GLY 632 -5.963 12.908 -9.559 936 H LYS 633 H LYS 633 -9.134 11.419 -8.733 937 HA LYS 633 HA LYS 633 -10.785 13.443 -9.614 938 1HB LYS 633 1HB LYS 633 -11.389 11.134 -8.743 939 2HB LYS 633 2HB LYS 633 -11.222 11.780 -7.123 940 1HG LYS 633 1HG LYS 633 -13.565 11.946 -7.748 941 2HG LYS 633 2HG LYS 633 -12.909 13.571 -7.700 942 1HD LYS 633 1HD LYS 633 -12.405 12.829 -10.335 943 2HD LYS 633 2HD LYS 633 -13.922 12.012 -10.015 944 1HE LYS 633 1HE LYS 633 -15.088 14.023 -9.620 945 2HE LYS 633 2HE LYS 633 -13.642 14.897 -9.157 946 H GLN 634 H GLN 634 -8.685 13.232 -6.744 947 HA GLN 634 HA GLN 634 -9.867 15.399 -5.419 948 1HB GLN 634 1HB GLN 634 -7.179 14.003 -5.194 949 2HB GLN 634 2HB GLN 634 -7.563 15.392 -4.198 950 1HG GLN 634 1HG GLN 634 -9.614 13.193 -4.319 951 2HG GLN 634 2HG GLN 634 -8.136 12.854 -3.440 952 1HE2 GLN 634 1HE2 GLN 634 -8.318 13.184 -1.371 953 2HE2 GLN 634 2HE2 GLN 634 -9.204 14.442 -0.574 954 H SER 635 H SER 635 -7.574 15.091 -8.074 955 HA SER 635 HA SER 635 -6.630 17.777 -7.732 956 1HB SER 635 1HB SER 635 -5.696 15.420 -9.036 957 2HB SER 635 2HB SER 635 -5.967 16.594 -10.307 958 HG SER 635 HG SER 635 -3.867 16.465 -8.678 959 H LEU 636 H LEU 636 -9.245 16.079 -9.271 960 HA LEU 636 HA LEU 636 -9.626 17.705 -11.517 961 1HB LEU 636 1HB LEU 636 -10.937 15.539 -10.168 962 2HB LEU 636 2HB LEU 636 -12.122 16.763 -10.576 963 HG LEU 636 HG LEU 636 -11.803 14.943 -12.278 964 1HD1 LEU 636 3HD1 LEU 636 -11.322 17.799 -13.169 965 2HD1 LEU 636 1HD1 LEU 636 -11.857 16.467 -14.223 966 3HD1 LEU 636 2HD1 LEU 636 -12.894 17.014 -12.884 967 1HD2 LEU 636 1HD2 LEU 636 -9.322 14.804 -12.025 968 2HD2 LEU 636 2HD2 LEU 636 -9.884 14.918 -13.710 969 3HD2 LEU 636 3HD2 LEU 636 -9.195 16.347 -12.903 970 H THR 637 H THR 637 -11.034 17.840 -8.176 971 HA THR 637 HA THR 637 -12.464 20.234 -8.701 972 HB THR 637 HB THR 637 -13.304 18.867 -6.946 973 HG1 THR 637 1HG THR 637 -13.166 20.425 -5.313 974 1HG2 THR 637 2HG2 THR 637 -10.381 18.636 -6.140 975 2HG2 THR 637 3HG2 THR 637 -11.661 18.396 -4.927 976 3HG2 THR 637 1HG2 THR 637 -11.579 17.338 -6.356 977 H LYS 638 H LYS 638 -9.187 19.494 -7.479 978 HA LYS 638 HA LYS 638 -8.705 22.188 -6.689 979 1HB LYS 638 1HB LYS 638 -6.903 19.785 -7.082 980 2HB LYS 638 2HB LYS 638 -6.323 21.344 -6.533 981 1HG LYS 638 1HG LYS 638 -8.131 21.212 -4.685 982 2HG LYS 638 2HG LYS 638 -8.352 19.538 -5.152 983 1HD LYS 638 1HD LYS 638 -5.751 20.806 -4.173 984 2HD LYS 638 2HD LYS 638 -6.761 19.693 -3.272 985 1HE LYS 638 1HE LYS 638 -6.391 18.072 -5.329 986 2HE LYS 638 2HE LYS 638 -5.043 19.126 -5.709 987 H LEU 639 H LEU 639 -8.582 20.345 -9.684 988 HA LEU 639 HA LEU 639 -6.988 22.433 -10.947 989 1HB LEU 639 1HB LEU 639 -7.930 19.725 -11.891 990 2HB LEU 639 2HB LEU 639 -7.066 20.868 -12.900 991 HG LEU 639 HG LEU 639 -5.901 19.911 -10.288 992 1HD1 LEU 639 3HD1 LEU 639 -6.585 17.975 -11.793 993 2HD1 LEU 639 1HD1 LEU 639 -5.356 18.568 -12.937 994 3HD1 LEU 639 2HD1 LEU 639 -4.875 18.051 -11.302 995 1HD2 LEU 639 2HD2 LEU 639 -5.095 21.819 -12.149 996 2HD2 LEU 639 3HD2 LEU 639 -4.105 21.090 -10.861 997 3HD2 LEU 639 1HD2 LEU 639 -4.082 20.398 -12.501 998 H ALA 640 H ALA 640 -10.239 21.630 -10.250 999 HA ALA 640 HA ALA 640 -11.643 22.200 -12.502 1000 1HB ALA 640 2HB ALA 640 -13.449 22.772 -11.028 1001 2HB ALA 640 3HB ALA 640 -12.473 21.543 -10.189 1002 3HB ALA 640 1HB ALA 640 -12.325 23.258 -9.736 1003 H ALA 641 H ALA 641 -10.098 24.515 -10.199 1004 HA ALA 641 HA ALA 641 -11.087 26.857 -11.228 1005 1HB ALA 641 3HB ALA 641 -9.586 27.796 -9.802 1006 2HB ALA 641 1HB ALA 641 -9.305 26.117 -9.282 1007 3HB ALA 641 2HB ALA 641 -8.220 26.873 -10.473 1008 H ALA 642 H ALA 642 -8.632 24.631 -12.526 1009 HA ALA 642 HA ALA 642 -7.423 26.363 -14.337 1010 1HB ALA 642 2HB ALA 642 -7.039 23.808 -13.549 1011 2HB ALA 642 1HB ALA 642 -6.357 24.465 -15.055 1012 3HB ALA 642 3HB ALA 642 -7.857 23.508 -15.101 1013 H TRP 643 H TRP 643 -10.645 25.040 -14.205 1014 HA TRP 643 HA TRP 643 -11.047 25.470 -17.060 1015 1HB TRP 643 1HB TRP 643 -12.638 24.146 -14.882 1016 2HB TRP 643 2HB TRP 643 -13.400 24.626 -16.385 1017 HD1 TRP 643 HD TRP 643 -12.917 23.087 -18.523 1018 HE1 TRP 643 1HE TRP 643 -11.694 20.794 -18.983 1019 HE3 TRP 643 3HE TRP 643 -10.565 22.836 -14.021 1020 HZ2 TRP 643 2HZ TRP 643 -9.921 19.169 -17.447 1021 HZ3 TRP 643 3HZ TRP 643 -9.107 20.863 -13.581 1022 HH2 TRP 643 HH TRP 643 -8.767 19.069 -15.207 1023 H GLY 644 H GLY 644 -11.259 27.039 -13.975 1024 1HA GLY 644 2HA GLY 644 -13.249 28.970 -14.983 1025 2HA GLY 644 1HA GLY 644 -11.669 29.513 -14.453 1026 H GLY 645 H GLY 645 -12.793 26.690 -12.767 1027 1HA GLY 645 2HA GLY 645 -14.294 28.086 -10.742 1028 2HA GLY 645 1HA GLY 645 -12.662 27.685 -10.246 1029 H SER 646 H SER 646 -14.653 26.512 -8.806 1030 HA SER 646 HA SER 646 -14.679 23.799 -9.880 1031 1HB SER 646 1HB SER 646 -14.878 23.224 -7.313 1032 2HB SER 646 2HB SER 646 -13.310 23.591 -8.004 1033 HG SER 646 HG SER 646 -13.567 24.796 -6.076 1034 H GLY 647 H GLY 647 -16.756 24.802 -10.910 1035 1HA GLY 647 2HA GLY 647 -18.965 25.444 -9.257 1036 2HA GLY 647 1HA GLY 647 -19.016 23.747 -9.689 1037 H SER 648 H SER 648 -17.543 26.274 -11.761 1038 HA SER 648 HA SER 648 -19.688 26.978 -13.253 1039 1HB SER 648 1HB SER 648 -16.748 26.897 -13.629 1040 2HB SER 648 2HB SER 648 -17.646 26.878 -15.134 1041 HG SER 648 HG SER 648 -18.902 28.739 -13.847 1042 H GLU 649 H GLU 649 -20.646 26.204 -15.239 1043 HA GLU 649 HA GLU 649 -21.074 23.527 -15.360 1044 1HB GLU 649 1HB GLU 649 -21.926 23.999 -17.708 1045 2HB GLU 649 2HB GLU 649 -22.585 25.037 -16.460 1046 1HG GLU 649 1HG GLU 649 -21.776 26.880 -17.501 1047 2HG GLU 649 2HG GLU 649 -20.144 26.245 -17.436 1048 HE2 GLU 649 HE GLU 649 -19.423 26.417 -19.383 1049 H ALA 650 H ALA 650 -18.476 25.474 -16.837 1050 HA ALA 650 HA ALA 650 -17.578 23.719 -18.758 1051 1HB ALA 650 3HB ALA 650 -16.630 26.055 -17.301 1052 2HB ALA 650 2HB ALA 650 -16.263 25.533 -18.963 1053 3HB ALA 650 1HB ALA 650 -15.301 24.910 -17.602 1054 H TYR 651 H TYR 651 -15.998 24.116 -15.509 1055 HA TYR 651 HA TYR 651 -14.551 21.794 -15.592 1056 1HB TYR 651 1HB TYR 651 -14.127 23.355 -13.823 1057 2HB TYR 651 2HB TYR 651 -15.833 23.607 -13.516 1058 HD1 TYR 651 1HD TYR 651 -13.412 20.730 -13.378 1059 HD2 TYR 651 2HD TYR 651 -16.601 22.851 -11.470 1060 HE1 TYR 651 1HE TYR 651 -13.299 19.136 -11.401 1061 HE2 TYR 651 2HE TYR 651 -16.477 21.250 -9.500 1062 HH TYR 651 HH TYR 651 -13.990 18.727 -9.381 1063 H GLN 652 H GLN 652 -18.000 22.275 -14.803 1064 HA GLN 652 HA GLN 652 -18.416 19.880 -13.506 1065 1HB GLN 652 1HB GLN 652 -20.198 21.721 -15.127 1066 2HB GLN 652 2HB GLN 652 -20.837 20.227 -14.470 1067 1HG GLN 652 1HG GLN 652 -19.329 21.522 -12.380 1068 2HG GLN 652 2HG GLN 652 -20.372 22.729 -13.105 1069 1HE2 GLN 652 1HE2 GLN 652 -20.154 19.866 -11.214 1070 2HE2 GLN 652 2HE2 GLN 652 -21.825 19.689 -10.793 1071 H GLY 653 H GLY 653 -18.815 20.733 -17.016 1072 1HA GLY 653 2HA GLY 653 -18.796 19.457 -18.865 1073 2HA GLY 653 1HA GLY 653 -19.636 18.240 -17.925 1074 H VAL 654 H VAL 654 -16.468 19.367 -16.818 1075 HA VAL 654 HA VAL 654 -15.045 17.280 -18.191 1076 HB VAL 654 HB VAL 654 -14.315 19.393 -16.166 1077 1HG1 VAL 654 1HG1 VAL 654 -12.961 17.346 -15.770 1078 2HG1 VAL 654 2HG1 VAL 654 -12.425 17.403 -17.467 1079 3HG1 VAL 654 3HG1 VAL 654 -11.991 18.720 -16.351 1080 1HG2 VAL 654 2HG2 VAL 654 -14.658 19.504 -18.920 1081 2HG2 VAL 654 3HG2 VAL 654 -13.757 20.670 -17.921 1082 3HG2 VAL 654 1HG2 VAL 654 -12.897 19.334 -18.723 1083 H GLN 655 H GLN 655 -16.251 17.997 -14.870 1084 HA GLN 655 HA GLN 655 -15.037 15.944 -13.562 1085 1HB GLN 655 1HB GLN 655 -17.402 17.663 -13.154 1086 2HB GLN 655 2HB GLN 655 -17.556 16.106 -12.364 1087 1HG GLN 655 1HG GLN 655 -14.870 17.022 -11.902 1088 2HG GLN 655 2HG GLN 655 -15.935 18.375 -11.579 1089 1HE2 GLN 655 1HE2 GLN 655 -14.353 16.845 -9.727 1090 2HE2 GLN 655 2HE2 GLN 655 -15.419 16.144 -8.556 1091 H GLN 656 H GLN 656 -18.266 15.940 -15.227 1092 HA GLN 656 HA GLN 656 -18.818 13.287 -14.663 1093 1HB GLN 656 1HB GLN 656 -20.623 13.509 -16.220 1094 2HB GLN 656 2HB GLN 656 -20.421 15.091 -15.493 1095 1HG GLN 656 1HG GLN 656 -18.788 15.516 -17.553 1096 2HG GLN 656 2HG GLN 656 -19.653 14.175 -18.276 1097 1HE2 GLN 656 1HE2 GLN 656 -20.593 16.874 -16.146 1098 2HE2 GLN 656 2HE2 GLN 656 -21.870 17.500 -17.135 1099 H LYS 657 H LYS 657 -16.989 14.867 -17.309 1100 HA LYS 657 HA LYS 657 -16.809 12.581 -18.942 1101 1HB LYS 657 1HB LYS 657 -15.377 15.217 -18.767 1102 2HB LYS 657 2HB LYS 657 -14.743 13.957 -19.806 1103 1HG LYS 657 1HG LYS 657 -17.147 13.759 -20.771 1104 2HG LYS 657 2HG LYS 657 -17.493 15.260 -19.935 1105 1HD LYS 657 1HD LYS 657 -15.256 14.874 -21.982 1106 2HD LYS 657 2HD LYS 657 -16.803 15.627 -22.317 1107 1HE LYS 657 1HE LYS 657 -16.181 17.219 -20.293 1108 2HE LYS 657 2HE LYS 657 -14.545 16.653 -20.569 1109 H TRP 658 H TRP 658 -15.102 13.695 -16.047 1110 HA TRP 658 HA TRP 658 -12.863 11.970 -16.407 1111 1HB TRP 658 1HB TRP 658 -12.521 13.911 -15.121 1112 2HB TRP 658 2HB TRP 658 -13.928 13.611 -14.119 1113 HD1 TRP 658 HD TRP 658 -13.577 12.002 -11.999 1114 HE1 TRP 658 1HE TRP 658 -11.519 10.877 -10.789 1115 HE3 TRP 658 3HE TRP 658 -10.238 12.868 -15.734 1116 HZ2 TRP 658 2HZ TRP 658 -8.787 10.485 -11.514 1117 HZ3 TRP 658 3HZ TRP 658 -7.895 12.082 -15.403 1118 HH2 TRP 658 HH TRP 658 -7.151 10.927 -13.382 1119 H ASP 659 H ASP 659 -15.818 11.967 -14.281 1120 HA ASP 659 HA ASP 659 -15.322 9.470 -13.211 1121 1HB ASP 659 1HB ASP 659 -17.153 11.446 -12.776 1122 2HB ASP 659 2HB ASP 659 -18.167 10.322 -13.660 1123 HD2 ASP 659 HD ASP 659 -15.746 9.375 -11.159 1124 H ALA 660 H ALA 660 -16.961 10.613 -16.190 1125 HA ALA 660 HA ALA 660 -18.423 8.425 -16.910 1126 1HB ALA 660 1HB ALA 660 -18.720 10.159 -18.375 1127 2HB ALA 660 2HB ALA 660 -17.010 10.650 -18.307 1128 3HB ALA 660 3HB ALA 660 -17.499 9.265 -19.313 1129 H THR 661 H THR 661 -15.381 8.987 -18.730 1130 HA THR 661 HA THR 661 -14.966 6.342 -19.351 1131 HB THR 661 HB THR 661 -12.730 7.131 -20.014 1132 HG1 THR 661 1HG THR 661 -13.522 9.344 -18.251 1133 1HG2 THR 661 1HG2 THR 661 -15.063 8.425 -20.839 1134 2HG2 THR 661 2HG2 THR 661 -14.057 9.776 -20.262 1135 3HG2 THR 661 3HG2 THR 661 -13.450 8.696 -21.540 1136 H ALA 662 H ALA 662 -14.235 8.066 -16.343 1137 HA ALA 662 HA ALA 662 -12.327 6.370 -15.298 1138 1HB ALA 662 3HB ALA 662 -12.710 8.332 -14.097 1139 2HB ALA 662 2HB ALA 662 -13.521 7.123 -13.073 1140 3HB ALA 662 1HB ALA 662 -14.480 8.152 -14.164 1141 H THR 663 H THR 663 -15.654 6.305 -13.930 1142 HA THR 663 HA THR 663 -15.563 3.743 -13.011 1143 HB THR 663 HB THR 663 -17.345 5.216 -12.342 1144 HG1 THR 663 1HG THR 663 -18.254 3.151 -12.499 1145 1HG2 THR 663 3HG2 THR 663 -17.451 5.843 -15.202 1146 2HG2 THR 663 1HG2 THR 663 -19.060 5.370 -14.606 1147 3HG2 THR 663 2HG2 THR 663 -18.190 6.722 -13.842 1148 H GLU 664 H GLU 664 -15.889 4.813 -16.349 1149 HA GLU 664 HA GLU 664 -17.056 2.483 -17.324 1150 1HB GLU 664 1HB GLU 664 -17.008 4.574 -18.611 1151 2HB GLU 664 2HB GLU 664 -15.257 4.541 -18.674 1152 1HG GLU 664 1HG GLU 664 -16.152 3.701 -20.796 1153 2HG GLU 664 2HG GLU 664 -15.343 2.392 -19.957 1154 HE2 GLU 664 HE GLU 664 -17.888 0.402 -19.768 1155 H LEU 665 H LEU 665 -13.598 3.553 -17.073 1156 HA LEU 665 HA LEU 665 -12.669 1.027 -18.063 1157 1HB LEU 665 1HB LEU 665 -11.603 3.294 -18.423 1158 2HB LEU 665 2HB LEU 665 -11.081 3.230 -16.752 1159 HG LEU 665 HG LEU 665 -9.282 2.568 -18.234 1160 1HD1 LEU 665 1HD1 LEU 665 -9.961 1.303 -15.956 1161 2HD1 LEU 665 2HD1 LEU 665 -9.952 -0.079 -17.079 1162 3HD1 LEU 665 3HD1 LEU 665 -8.496 0.928 -16.895 1163 1HD2 LEU 665 2HD2 LEU 665 -10.799 1.727 -20.063 1164 2HD2 LEU 665 3HD2 LEU 665 -9.360 0.731 -19.737 1165 3HD2 LEU 665 1HD2 LEU 665 -10.954 0.216 -19.136 1166 H ASN 666 H ASN 666 -13.549 2.451 -14.977 1167 HA ASN 666 HA ASN 666 -11.946 0.783 -13.400 1168 1HB ASN 666 1HB ASN 666 -13.642 2.964 -12.965 1169 2HB ASN 666 2HB ASN 666 -14.542 1.653 -12.229 1170 1HD2 ASN 666 1HD2 ASN 666 -13.515 3.764 -10.782 1171 2HD2 ASN 666 2HD2 ASN 666 -12.265 3.216 -9.715 1172 H ASN 667 H ASN 667 -15.439 0.767 -14.422 1173 HA ASN 667 HA ASN 667 -16.105 -1.560 -13.082 1174 1HB ASN 667 1HB ASN 667 -18.172 -1.390 -14.220 1175 2HB ASN 667 2HB ASN 667 -17.593 0.262 -14.300 1176 1HD2 ASN 667 1HD2 ASN 667 -17.774 1.183 -16.182 1177 2HD2 ASN 667 2HD2 ASN 667 -17.704 0.429 -17.740 1178 H ALA 668 H ALA 668 -14.857 -0.852 -16.396 1179 HA ALA 668 HA ALA 668 -15.167 -3.425 -17.450 1180 1HB ALA 668 3HB ALA 668 -14.587 -1.063 -18.509 1181 2HB ALA 668 1HB ALA 668 -12.910 -1.610 -18.270 1182 3HB ALA 668 2HB ALA 668 -14.023 -2.566 -19.278 1183 H LEU 669 H LEU 669 -12.665 -1.889 -15.408 1184 HA LEU 669 HA LEU 669 -10.768 -3.964 -15.751 1185 1HB LEU 669 1HB LEU 669 -11.060 -1.487 -14.228 1186 2HB LEU 669 2HB LEU 669 -10.215 -2.738 -13.338 1187 HG LEU 669 HG LEU 669 -9.412 -2.002 -16.153 1188 1HD1 LEU 669 1HD1 LEU 669 -9.479 0.015 -14.592 1189 2HD1 LEU 669 2HD1 LEU 669 -8.161 -0.776 -13.694 1190 3HD1 LEU 669 3HD1 LEU 669 -7.935 -0.335 -15.404 1191 1HD2 LEU 669 1HD2 LEU 669 -8.643 -4.121 -14.767 1192 2HD2 LEU 669 2HD2 LEU 669 -7.508 -3.212 -15.794 1193 3HD2 LEU 669 3HD2 LEU 669 -7.527 -2.944 -14.035 1194 H GLN 670 H GLN 670 -13.424 -3.288 -13.424 1195 HA GLN 670 HA GLN 670 -12.749 -5.349 -11.680 1196 1HB GLN 670 1HB GLN 670 -15.144 -3.620 -12.183 1197 2HB GLN 670 2HB GLN 670 -15.424 -5.091 -11.273 1198 1HG GLN 670 1HG GLN 670 -13.027 -3.940 -10.214 1199 2HG GLN 670 2HG GLN 670 -14.165 -2.619 -10.397 1200 1HE2 GLN 670 1HE2 GLN 670 -13.044 -4.310 -8.105 1201 2HE2 GLN 670 2HE2 GLN 670 -14.424 -4.736 -7.149 1202 H ASN 671 H ASN 671 -15.217 -5.164 -14.345 1203 HA ASN 671 HA ASN 671 -16.109 -7.744 -14.081 1204 1HB ASN 671 1HB ASN 671 -16.943 -5.731 -15.582 1205 2HB ASN 671 2HB ASN 671 -15.843 -6.369 -16.788 1206 1HD2 ASN 671 1HD2 ASN 671 -16.438 -8.015 -18.018 1207 2HD2 ASN 671 2HD2 ASN 671 -17.872 -8.969 -17.835 1208 H LEU 672 H LEU 672 -13.164 -6.369 -15.482 1209 HA LEU 672 HA LEU 672 -12.542 -8.604 -17.136 1210 1HB LEU 672 1HB LEU 672 -11.752 -6.406 -17.692 1211 2HB LEU 672 2HB LEU 672 -10.937 -6.247 -16.149 1212 HG LEU 672 HG LEU 672 -9.809 -8.549 -17.221 1213 1HD1 LEU 672 2HD1 LEU 672 -11.000 -7.167 -19.382 1214 2HD1 LEU 672 3HD1 LEU 672 -9.245 -6.887 -19.491 1215 3HD1 LEU 672 1HD1 LEU 672 -9.879 -8.550 -19.436 1216 1HD2 LEU 672 1HD2 LEU 672 -8.963 -6.181 -16.157 1217 2HD2 LEU 672 2HD2 LEU 672 -7.900 -7.444 -16.823 1218 3HD2 LEU 672 3HD2 LEU 672 -8.371 -6.054 -17.831 1219 H ALA 673 H ALA 673 -11.309 -7.365 -13.952 1220 HA ALA 673 HA ALA 673 -9.664 -9.614 -13.524 1221 1HB ALA 673 3HB ALA 673 -10.291 -7.104 -12.277 1222 2HB ALA 673 1HB ALA 673 -10.428 -8.389 -11.054 1223 3HB ALA 673 2HB ALA 673 -8.913 -8.185 -11.964 1224 H ARG 674 H ARG 674 -13.096 -9.063 -13.306 1225 HA ARG 674 HA ARG 674 -13.627 -10.868 -11.249 1226 1HB ARG 674 1HB ARG 674 -15.214 -9.541 -13.448 1227 2HB ARG 674 2HB ARG 674 -15.952 -10.910 -12.641 1228 1HG ARG 674 1HG ARG 674 -14.853 -9.322 -10.553 1229 2HG ARG 674 2HG ARG 674 -15.579 -8.178 -11.664 1230 1HD ARG 674 1HD ARG 674 -17.504 -10.209 -11.530 1231 2HD ARG 674 2HD ARG 674 -16.884 -10.158 -9.892 1232 HE ARG 674 HE ARG 674 -18.337 -7.998 -11.291 1233 2HH1 ARG 674 1HH ARG 674 -18.508 -6.017 -8.443 1234 1HH2 ARG 674 2HH2 ARG 674 -16.415 -8.920 -8.461 1235 2HH2 ARG 674 1HH2 ARG 674 -16.958 -7.583 -7.502 1236 H THR 675 H THR 675 -13.138 -11.155 -14.778 1237 HA THR 675 HA THR 675 -13.706 -14.037 -14.586 1238 HB THR 675 HB THR 675 -13.619 -12.148 -16.999 1239 HG1 THR 675 1HG THR 675 -15.497 -11.747 -15.764 1240 1HG2 THR 675 3HG2 THR 675 -13.337 -14.893 -17.065 1241 2HG2 THR 675 1HG2 THR 675 -15.110 -14.739 -17.039 1242 3HG2 THR 675 2HG2 THR 675 -14.167 -13.958 -18.332 1243 H ILE 676 H ILE 676 -11.189 -11.767 -14.549 1244 HA ILE 676 HA ILE 676 -9.361 -13.577 -15.925 1245 HB ILE 676 HB ILE 676 -9.250 -10.707 -15.062 1246 1HG1 ILE 676 1HG1 ILE 676 -9.063 -12.215 -17.664 1247 2HG1 ILE 676 2HG1 ILE 676 -10.173 -10.938 -17.208 1248 1HG2 ILE 676 3HG2 ILE 676 -7.037 -12.555 -15.009 1249 2HG2 ILE 676 1HG2 ILE 676 -6.789 -11.328 -16.274 1250 3HG2 ILE 676 2HG2 ILE 676 -7.085 -10.825 -14.592 1251 1HD1 ILE 676 2HD1 ILE 676 -7.900 -9.535 -16.917 1252 2HD1 ILE 676 3HD1 ILE 676 -7.301 -10.743 -18.080 1253 3HD1 ILE 676 1HD1 ILE 676 -8.688 -9.710 -18.503 1254 H SER 677 H SER 677 -9.727 -11.821 -12.768 1255 HA SER 677 HA SER 677 -7.622 -12.812 -11.462 1256 1HB SER 677 1HB SER 677 -9.305 -11.205 -10.546 1257 2HB SER 677 2HB SER 677 -10.439 -12.523 -10.327 1258 HG SER 677 HG SER 677 -8.163 -11.829 -8.812 1259 H GLU 678 H GLU 678 -10.529 -14.549 -12.496 1260 HA GLU 678 HA GLU 678 -10.211 -16.721 -10.745 1261 1HB GLU 678 1HB GLU 678 -11.730 -17.851 -12.558 1262 2HB GLU 678 2HB GLU 678 -12.378 -16.525 -11.613 1263 1HG GLU 678 1HG GLU 678 -12.544 -15.152 -13.432 1264 2HG GLU 678 2HG GLU 678 -10.950 -15.583 -14.019 1265 HE2 GLU 678 HE GLU 678 -11.945 -18.609 -15.207 1266 H ALA 679 H ALA 679 -8.895 -15.831 -13.931 1267 HA ALA 679 HA ALA 679 -8.119 -18.164 -15.009 1268 1HB ALA 679 1HB ALA 679 -6.468 -15.622 -14.710 1269 2HB ALA 679 2HB ALA 679 -6.176 -16.905 -15.908 1270 3HB ALA 679 3HB ALA 679 -7.676 -15.950 -15.975 1271 H GLY 680 H GLY 680 -6.957 -16.701 -11.993 1272 1HA GLY 680 2HA GLY 680 -5.747 -17.610 -10.320 1273 2HA GLY 680 1HA GLY 680 -4.542 -17.868 -11.566 1274 H GLN 681 H GLN 681 -7.392 -19.335 -9.926 1275 HA GLN 681 HA GLN 681 -6.347 -21.924 -10.777 1276 1HB GLN 681 1HB GLN 681 -6.154 -21.112 -8.247 1277 2HB GLN 681 2HB GLN 681 -7.837 -21.595 -8.171 1278 1HG GLN 681 1HG GLN 681 -7.110 -23.851 -9.189 1279 2HG GLN 681 2HG GLN 681 -5.454 -23.343 -8.924 1280 1HE2 GLN 681 1HE2 GLN 681 -7.277 -25.460 -7.764 1281 2HE2 GLN 681 2HE2 GLN 681 -7.125 -25.311 -6.045 1282 H ALA 682 H ALA 682 -9.180 -19.873 -10.013 1283 HA ALA 682 HA ALA 682 -11.261 -21.547 -10.121 1284 1HB ALA 682 2HB ALA 682 -10.735 -18.776 -11.111 1285 2HB ALA 682 3HB ALA 682 -12.242 -19.555 -11.652 1286 3HB ALA 682 1HB ALA 682 -11.916 -19.357 -9.913 1287 H MET 683 H MET 683 -9.635 -20.155 -13.064 1288 HA MET 683 HA MET 683 -11.023 -21.247 -15.008 1289 1HB MET 683 1HB MET 683 -8.243 -20.456 -14.572 1290 2HB MET 683 2HB MET 683 -8.275 -21.833 -15.655 1291 1HG MET 683 1HG MET 683 -9.930 -20.641 -17.116 1292 2HG MET 683 2HG MET 683 -9.888 -19.262 -16.035 1293 1HE MET 683 1HE MET 683 -8.390 -21.502 -18.390 1294 2HE MET 683 2HE MET 683 -8.089 -20.170 -19.531 1295 3HE MET 683 3HE MET 683 -6.722 -20.977 -18.725 1296 H ALA 684 H ALA 684 -8.679 -23.030 -12.933 1297 HA ALA 684 HA ALA 684 -8.889 -25.445 -14.411 1298 1HB ALA 684 3HB ALA 684 -6.928 -24.870 -13.044 1299 2HB ALA 684 1HB ALA 684 -7.936 -24.862 -11.577 1300 3HB ALA 684 2HB ALA 684 -7.669 -26.381 -12.466 1301 H SER 685 H SER 685 -10.369 -24.160 -11.365 1302 HA SER 685 HA SER 685 -11.836 -26.495 -10.898 1303 1HB SER 685 1HB SER 685 -12.113 -23.631 -9.907 1304 2HB SER 685 2HB SER 685 -13.185 -24.908 -9.366 1305 HG SER 685 HG SER 685 -10.518 -25.677 -9.211 1306 H THR 686 H THR 686 -13.429 -23.287 -11.303 1307 HA THR 686 HA THR 686 -14.826 -24.139 -13.676 1308 HB THR 686 HB THR 686 -15.889 -24.989 -11.261 1309 HG1 THR 686 1HG THR 686 -16.708 -25.650 -13.293 1310 1HG2 THR 686 2HG2 THR 686 -16.367 -22.333 -10.989 1311 2HG2 THR 686 3HG2 THR 686 -17.715 -22.734 -12.080 1312 3HG2 THR 686 1HG2 THR 686 -17.571 -23.552 -10.506 1313 H GLU 687 H GLU 687 -16.847 -22.322 -13.799 1314 HA GLU 687 HA GLU 687 -15.582 -19.791 -13.152 1315 1HB GLU 687 1HB GLU 687 -16.340 -19.003 -15.508 1316 2HB GLU 687 2HB GLU 687 -14.886 -19.976 -15.399 1317 1HG GLU 687 1HG GLU 687 -17.556 -21.350 -15.801 1318 2HG GLU 687 2HG GLU 687 -16.776 -20.582 -17.169 1319 HE2 GLU 687 HE GLU 687 -15.127 -21.636 -18.050 1320 H GLY 688 H GLY 688 -17.035 -18.625 -11.978 1321 1HA GLY 688 2HA GLY 688 -19.813 -18.531 -12.866 1322 2HA GLY 688 1HA GLY 688 -19.026 -17.485 -11.702 1323 H ASN 689 H ASN 689 -18.821 -21.073 -11.691 1324 HA ASN 689 HA ASN 689 -20.700 -21.128 -9.497 1325 1HB ASN 689 1HB ASN 689 -19.970 -22.936 -11.625 1326 2HB ASN 689 2HB ASN 689 -19.561 -23.730 -10.117 1327 1HD2 ASN 689 1HD2 ASN 689 -21.086 -24.832 -9.164 1328 2HD2 ASN 689 2HD2 ASN 689 -22.797 -24.629 -9.337 1329 H VAL 690 H VAL 690 -17.500 -20.448 -9.872 1330 HA VAL 690 HA VAL 690 -16.485 -22.211 -7.797 1331 HB VAL 690 HB VAL 690 -15.002 -22.000 -9.571 1332 1HG1 VAL 690 2HG1 VAL 690 -16.087 -19.268 -9.775 1333 2HG1 VAL 690 3HG1 VAL 690 -14.340 -19.387 -10.092 1334 3HG1 VAL 690 1HG1 VAL 690 -15.485 -20.365 -11.041 1335 1HG2 VAL 690 1HG2 VAL 690 -14.105 -21.440 -7.194 1336 2HG2 VAL 690 2HG2 VAL 690 -13.058 -21.152 -8.604 1337 3HG2 VAL 690 3HG2 VAL 690 -13.910 -19.791 -7.836 1338 H THR 691 H THR 691 -17.043 -21.657 -5.746 1339 HA THR 691 HA THR 691 -17.838 -19.092 -4.979 1340 HB THR 691 HB THR 691 -16.907 -21.617 -3.551 1341 HG1 THR 691 1HG THR 691 -19.253 -21.446 -3.037 1342 1HG2 THR 691 2HG2 THR 691 -16.407 -19.485 -2.153 1343 2HG2 THR 691 3HG2 THR 691 -18.160 -19.180 -2.202 1344 3HG2 THR 691 1HG2 THR 691 -17.534 -20.655 -1.426 1345 H GLY 692 H GLY 692 -14.699 -20.304 -5.724 1346 1HA GLY 692 2HA GLY 692 -12.618 -19.608 -4.929 1347 2HA GLY 692 1HA GLY 692 -13.375 -18.303 -4.037 1348 H MET 693 H MET 693 -15.135 -17.796 -6.589 1349 HA MET 693 HA MET 693 -13.300 -17.008 -8.566 1350 1HB MET 693 1HB MET 693 -15.308 -15.987 -9.613 1351 2HB MET 693 2HB MET 693 -15.727 -17.561 -8.966 1352 1HG MET 693 1HG MET 693 -17.079 -16.679 -7.302 1353 2HG MET 693 2HG MET 693 -16.062 -15.272 -7.067 1354 1HE MET 693 3HE MET 693 -18.895 -15.531 -6.933 1355 2HE MET 693 1HE MET 693 -19.489 -14.038 -7.698 1356 3HE MET 693 2HE MET 693 -19.857 -15.619 -8.428 1357 H PHE 694 H PHE 694 -12.490 -15.952 -6.008 1358 HA PHE 694 HA PHE 694 -13.144 -13.576 -5.152 1359 1HB PHE 694 1HB PHE 694 -10.416 -13.203 -5.552 1360 2HB PHE 694 2HB PHE 694 -11.076 -14.206 -4.276 1361 HD1 PHE 694 1HD PHE 694 -9.337 -15.796 -4.111 1362 HD2 PHE 694 2HD PHE 694 -11.133 -15.040 -7.881 1363 HE1 PHE 694 1HE PHE 694 -8.162 -17.795 -5.073 1364 HE2 PHE 694 2HE PHE 694 -9.958 -17.038 -8.842 1365 HZ PHE 694 HZ PHE 694 -8.486 -18.392 -7.427 1366 H ALA 695 H ALA 695 -13.125 -11.385 -5.713 1367 HA ALA 695 HA ALA 695 -13.263 -10.823 -8.484 1368 1HB ALA 695 2HB ALA 695 -14.233 -9.709 -6.160 1369 2HB ALA 695 3HB ALA 695 -12.951 -8.559 -6.609 1370 3HB ALA 695 1HB ALA 695 -14.263 -8.921 -7.756 No H/Q in entry = 1370 Start of MODEL 6 1 H ALA 1 H ALA 1 -8.832 33.965 0.584 2 HA ALA 1 HA ALA 1 -7.146 31.565 0.449 3 1HB ALA 1 3HB ALA 1 -8.991 30.465 -0.250 4 2HB ALA 1 2HB ALA 1 -8.845 31.416 -1.747 5 3HB ALA 1 1HB ALA 1 -9.917 31.973 -0.440 6 H GLU 2 H GLU 2 -5.608 31.561 -1.212 7 HA GLU 2 HA GLU 2 -5.642 33.941 -2.892 8 1HB GLU 2 1HB GLU 2 -3.583 33.044 -0.970 9 2HB GLU 2 2HB GLU 2 -2.935 33.357 -2.568 10 1HG GLU 2 1HG GLU 2 -3.037 35.587 -2.189 11 2HG GLU 2 2HG GLU 2 -4.774 35.485 -1.987 12 HE2 GLU 2 HE GLU 2 -4.851 36.766 0.337 13 H MET 3 H MET 3 -3.929 30.764 -2.395 14 HA MET 3 HA MET 3 -3.457 30.522 -5.172 15 1HB MET 3 1HB MET 3 -3.005 28.906 -2.663 16 2HB MET 3 2HB MET 3 -3.003 28.009 -4.168 17 1HG MET 3 1HG MET 3 -1.193 29.362 -5.076 18 2HG MET 3 2HG MET 3 -1.321 30.525 -3.771 19 1HE MET 3 2HE MET 3 1.048 30.174 -4.128 20 2HE MET 3 3HE MET 3 1.812 29.593 -2.629 21 3HE MET 3 1HE MET 3 1.868 28.594 -4.102 22 H LYS 4 H LYS 4 -5.670 30.737 -6.025 23 HA LYS 4 HA LYS 4 -7.375 28.430 -5.458 24 1HB LYS 4 1HB LYS 4 -8.439 30.576 -5.129 25 2HB LYS 4 2HB LYS 4 -7.954 31.123 -6.722 26 1HG LYS 4 1HG LYS 4 -9.819 30.207 -7.622 27 2HG LYS 4 2HG LYS 4 -9.315 28.618 -7.080 28 1HD LYS 4 1HD LYS 4 -10.300 29.181 -4.787 29 2HD LYS 4 2HD LYS 4 -10.950 30.648 -5.491 30 1HE LYS 4 1HE LYS 4 -11.514 27.958 -6.786 31 2HE LYS 4 2HE LYS 4 -12.456 28.484 -5.405 32 H THR 5 H THR 5 -6.558 30.467 -8.359 33 HA THR 5 HA THR 5 -6.324 27.938 -9.856 34 HB THR 5 HB THR 5 -8.213 28.852 -10.859 35 HG1 THR 5 1HG THR 5 -7.267 29.541 -12.751 36 1HG2 THR 5 3HG2 THR 5 -7.096 31.585 -10.047 37 2HG2 THR 5 1HG2 THR 5 -8.535 31.378 -11.075 38 3HG2 THR 5 2HG2 THR 5 -8.549 30.789 -9.395 39 H ASP 6 H ASP 6 -4.621 30.478 -8.506 40 HA ASP 6 HA ASP 6 -3.027 31.551 -10.296 41 1HB ASP 6 1HB ASP 6 -2.719 30.615 -7.526 42 2HB ASP 6 2HB ASP 6 -1.186 30.583 -8.374 43 HD2 ASP 6 HD ASP 6 -0.998 33.763 -7.101 44 H ALA 7 H ALA 7 -1.490 30.861 -11.828 45 HA ALA 7 HA ALA 7 -1.351 28.288 -12.693 46 1HB ALA 7 2HB ALA 7 0.271 30.764 -12.982 47 2HB ALA 7 3HB ALA 7 1.091 29.247 -13.426 48 3HB ALA 7 1HB ALA 7 -0.432 29.703 -14.227 49 H ALA 8 H ALA 8 0.164 29.736 -9.873 50 HA ALA 8 HA ALA 8 2.237 27.808 -9.619 51 1HB ALA 8 2HB ALA 8 2.807 29.642 -8.394 52 2HB ALA 8 1HB ALA 8 1.875 28.833 -7.111 53 3HB ALA 8 3HB ALA 8 1.112 30.100 -8.102 54 H THR 9 H THR 9 -1.040 28.272 -8.139 55 HA THR 9 HA THR 9 -0.866 25.881 -6.609 56 HB THR 9 HB THR 9 -2.289 28.005 -6.197 57 HG1 THR 9 1HG THR 9 -3.971 26.537 -5.348 58 1HG2 THR 9 3HG2 THR 9 -3.836 26.646 -8.444 59 2HG2 THR 9 1HG2 THR 9 -4.683 27.574 -7.183 60 3HG2 THR 9 2HG2 THR 9 -3.493 28.380 -8.232 61 H LEU 10 H LEU 10 -1.979 26.692 -9.895 62 HA LEU 10 HA LEU 10 -3.366 24.265 -10.289 63 1HB LEU 10 1HB LEU 10 -2.282 26.416 -12.083 64 2HB LEU 10 2HB LEU 10 -2.969 24.949 -12.752 65 HG LEU 10 HG LEU 10 -4.384 26.971 -10.994 66 1HD1 LEU 10 1HD1 LEU 10 -3.890 27.441 -13.492 67 2HD1 LEU 10 2HD1 LEU 10 -5.148 26.221 -13.805 68 3HD1 LEU 10 3HD1 LEU 10 -5.542 27.686 -12.874 69 1HD2 LEU 10 3HD2 LEU 10 -5.112 24.193 -11.782 70 2HD2 LEU 10 1HD2 LEU 10 -5.508 25.117 -10.313 71 3HD2 LEU 10 2HD2 LEU 10 -6.394 25.427 -11.826 72 H ALA 11 H ALA 11 -0.018 25.395 -11.082 73 HA ALA 11 HA ALA 11 0.754 22.990 -12.305 74 1HB ALA 11 1HB ALA 11 1.800 25.400 -12.295 75 2HB ALA 11 3HB ALA 11 2.868 23.980 -12.407 76 3HB ALA 11 2HB ALA 11 2.663 24.819 -10.850 77 H GLN 12 H GLN 12 0.433 24.036 -8.938 78 HA GLN 12 HA GLN 12 2.132 22.042 -7.904 79 1HB GLN 12 1HB GLN 12 0.896 24.322 -6.911 80 2HB GLN 12 2HB GLN 12 -0.012 23.047 -6.122 81 1HG GLN 12 1HG GLN 12 3.038 23.100 -6.162 82 2HG GLN 12 2HG GLN 12 2.101 23.871 -4.898 83 1HE2 GLN 12 1HE2 GLN 12 1.434 22.725 -3.229 84 2HE2 GLN 12 2HE2 GLN 12 1.478 21.000 -3.076 85 H GLU 13 H GLU 13 -1.311 22.255 -8.788 86 HA GLU 13 HA GLU 13 -1.814 19.708 -7.529 87 1HB GLU 13 1HB GLU 13 -3.714 21.492 -9.114 88 2HB GLU 13 2HB GLU 13 -4.168 20.117 -8.126 89 1HG GLU 13 1HG GLU 13 -3.977 21.293 -6.164 90 2HG GLU 13 2HG GLU 13 -2.517 22.114 -6.678 91 HE2 GLU 13 HE GLU 13 -5.918 23.607 -6.409 92 H ALA 14 H ALA 14 -1.841 21.259 -10.802 93 HA ALA 14 HA ALA 14 -2.650 19.073 -12.268 94 1HB ALA 14 3HB ALA 14 -2.097 21.600 -12.859 95 2HB ALA 14 1HB ALA 14 -0.515 20.920 -13.309 96 3HB ALA 14 2HB ALA 14 -1.996 20.332 -14.104 97 H GLY 15 H GLY 15 0.592 19.954 -10.978 98 1HA GLY 15 2HA GLY 15 2.495 18.773 -10.798 99 2HA GLY 15 1HA GLY 15 2.095 18.023 -12.331 100 H ASN 16 H ASN 16 0.326 17.912 -9.167 101 HA ASN 16 HA ASN 16 1.242 15.368 -8.512 102 1HB ASN 16 1HB ASN 16 0.340 16.504 -6.665 103 2HB ASN 16 2HB ASN 16 -0.969 17.202 -7.598 104 1HD2 ASN 16 1HD2 ASN 16 -2.804 16.567 -6.765 105 2HD2 ASN 16 2HD2 ASN 16 -3.255 14.952 -6.328 106 H PHE 17 H PHE 17 -1.364 16.647 -10.558 107 HA PHE 17 HA PHE 17 -2.899 14.252 -10.610 108 1HB PHE 17 1HB PHE 17 -3.807 16.541 -11.063 109 2HB PHE 17 2HB PHE 17 -2.671 16.759 -12.379 110 HD1 PHE 17 1HD PHE 17 -5.564 14.691 -11.308 111 HD2 PHE 17 2HD PHE 17 -3.244 16.126 -14.558 112 HE1 PHE 17 1HE PHE 17 -7.254 13.771 -12.920 113 HE2 PHE 17 2HE PHE 17 -4.933 15.206 -16.171 114 HZ PHE 17 HZ PHE 17 -6.918 14.040 -15.333 115 H GLU 18 H GLU 18 -0.711 15.909 -12.999 116 HA GLU 18 HA GLU 18 -0.849 14.252 -15.049 117 1HB GLU 18 1HB GLU 18 1.537 15.639 -13.803 118 2HB GLU 18 2HB GLU 18 1.752 14.664 -15.242 119 1HG GLU 18 1HG GLU 18 -0.574 16.325 -15.648 120 2HG GLU 18 2HG GLU 18 0.712 17.349 -15.040 121 HE2 GLU 18 HE GLU 18 1.404 18.257 -16.813 122 H ARG 19 H ARG 19 0.754 13.574 -11.922 123 HA ARG 19 HA ARG 19 2.073 11.281 -12.786 124 1HB ARG 19 1HB ARG 19 2.055 12.792 -10.478 125 2HB ARG 19 2HB ARG 19 1.160 11.386 -9.937 126 1HG ARG 19 1HG ARG 19 2.984 9.970 -10.120 127 2HG ARG 19 2HG ARG 19 3.634 10.804 -11.517 128 1HD ARG 19 1HD ARG 19 5.154 11.743 -10.106 129 2HD ARG 19 2HD ARG 19 3.843 12.733 -9.494 130 HE ARG 19 HE ARG 19 5.076 10.455 -8.148 131 2HH1 ARG 19 1HH ARG 19 2.900 10.496 -5.440 132 1HH2 ARG 19 2HH2 ARG 19 2.104 12.369 -8.384 133 2HH2 ARG 19 1HH2 ARG 19 1.559 11.949 -6.795 134 H ILE 20 H ILE 20 -1.148 11.897 -11.273 135 HA ILE 20 HA ILE 20 -1.815 9.184 -10.938 136 HB ILE 20 HB ILE 20 -3.612 11.596 -11.215 137 1HG1 ILE 20 1HG1 ILE 20 -2.711 10.426 -8.596 138 2HG1 ILE 20 2HG1 ILE 20 -1.684 11.569 -9.438 139 1HG2 ILE 20 3HG2 ILE 20 -4.342 8.951 -11.192 140 2HG2 ILE 20 1HG2 ILE 20 -4.433 9.385 -9.468 141 3HG2 ILE 20 2HG2 ILE 20 -5.361 10.314 -10.670 142 1HD1 ILE 20 3HD1 ILE 20 -4.044 12.906 -9.634 143 2HD1 ILE 20 1HD1 ILE 20 -4.338 12.004 -8.128 144 3HD1 ILE 20 2HD1 ILE 20 -2.938 13.096 -8.253 145 H SER 21 H SER 21 -2.318 11.575 -13.586 146 HA SER 21 HA SER 21 -3.971 9.961 -15.104 147 1HB SER 21 1HB SER 21 -3.892 12.237 -15.724 148 2HB SER 21 2HB SER 21 -2.140 12.292 -15.697 149 HG SER 21 HG SER 21 -2.035 11.543 -17.726 150 H GLY 22 H GLY 22 -0.374 10.454 -15.169 151 1HA GLY 22 2HA GLY 22 1.290 9.211 -16.024 152 2HA GLY 22 1HA GLY 22 0.185 8.721 -17.293 153 H ASP 23 H ASP 23 0.039 8.167 -13.709 154 HA ASP 23 HA ASP 23 0.902 5.541 -13.847 155 1HB ASP 23 1HB ASP 23 -0.698 7.170 -11.857 156 2HB ASP 23 2HB ASP 23 -0.521 5.446 -11.594 157 HD2 ASP 23 HD ASP 23 2.920 7.268 -12.040 158 H LEU 24 H LEU 24 -2.311 7.139 -14.087 159 HA LEU 24 HA LEU 24 -3.917 4.887 -13.815 160 1HB LEU 24 1HB LEU 24 -4.168 7.652 -14.710 161 2HB LEU 24 2HB LEU 24 -5.236 6.568 -15.579 162 HG LEU 24 HG LEU 24 -5.096 6.794 -12.559 163 1HD1 LEU 24 2HD1 LEU 24 -6.738 8.223 -14.609 164 2HD1 LEU 24 3HD1 LEU 24 -7.492 7.784 -13.057 165 3HD1 LEU 24 1HD1 LEU 24 -6.039 8.812 -13.081 166 1HD2 LEU 24 1HD2 LEU 24 -6.245 4.812 -14.278 167 2HD2 LEU 24 2HD2 LEU 24 -6.265 4.912 -12.501 168 3HD2 LEU 24 3HD2 LEU 24 -7.552 5.694 -13.451 169 H LYS 25 H LYS 25 -2.327 6.352 -16.709 170 HA LYS 25 HA LYS 25 -3.444 4.448 -18.488 171 1HB LYS 25 1HB LYS 25 -2.616 6.788 -19.032 172 2HB LYS 25 2HB LYS 25 -0.985 6.160 -18.918 173 1HG LYS 25 1HG LYS 25 -1.626 4.386 -20.636 174 2HG LYS 25 2HG LYS 25 -3.168 5.197 -20.824 175 1HD LYS 25 1HD LYS 25 -0.469 6.566 -21.243 176 2HD LYS 25 2HD LYS 25 -1.416 5.863 -22.540 177 1HE LYS 25 1HE LYS 25 -3.066 7.514 -22.431 178 2HE LYS 25 2HE LYS 25 -2.827 7.801 -20.719 179 H THR 26 H THR 26 -0.460 4.683 -16.524 180 HA THR 26 HA THR 26 0.971 2.623 -17.723 181 HB THR 26 HB THR 26 0.847 3.880 -14.954 182 HG1 THR 26 1HG THR 26 2.736 3.621 -17.189 183 1HG2 THR 26 1HG2 THR 26 2.141 1.329 -15.719 184 2HG2 THR 26 2HG2 THR 26 3.309 2.555 -15.173 185 3HG2 THR 26 3HG2 THR 26 1.971 2.065 -14.107 186 H GLN 27 H GLN 27 -1.588 2.519 -15.195 187 HA GLN 27 HA GLN 27 -1.265 -0.255 -14.820 188 1HB GLN 27 1HB GLN 27 -3.639 1.535 -14.135 189 2HB GLN 27 2HB GLN 27 -3.353 -0.070 -13.492 190 1HG GLN 27 1HG GLN 27 -1.266 2.122 -13.190 191 2HG GLN 27 2HG GLN 27 -2.605 1.997 -12.066 192 1HE2 GLN 27 1HE2 GLN 27 0.499 1.273 -12.422 193 2HE2 GLN 27 2HE2 GLN 27 0.656 -0.178 -11.490 194 H ILE 28 H ILE 28 -3.518 1.828 -16.725 195 HA ILE 28 HA ILE 28 -5.223 -0.174 -17.590 196 HB ILE 28 HB ILE 28 -4.557 2.581 -18.303 197 1HG1 ILE 28 1HG1 ILE 28 -7.277 1.524 -18.732 198 2HG1 ILE 28 2HG1 ILE 28 -6.646 1.249 -17.121 199 1HG2 ILE 28 1HG2 ILE 28 -5.339 0.624 -20.443 200 2HG2 ILE 28 2HG2 ILE 28 -5.926 2.303 -20.498 201 3HG2 ILE 28 3HG2 ILE 28 -4.177 1.971 -20.501 202 1HD1 ILE 28 1HD1 ILE 28 -5.973 3.949 -17.980 203 2HD1 ILE 28 2HD1 ILE 28 -7.722 3.664 -18.150 204 3HD1 ILE 28 3HD1 ILE 28 -6.931 3.427 -16.573 205 H ASP 29 H ASP 29 -2.151 1.075 -19.047 206 HA ASP 29 HA ASP 29 -2.230 -0.523 -21.277 207 1HB ASP 29 1HB ASP 29 -0.331 1.186 -19.900 208 2HB ASP 29 2HB ASP 29 0.501 -0.267 -20.416 209 HD2 ASP 29 HD ASP 29 1.517 1.212 -22.671 210 H GLN 30 H GLN 30 -0.891 -1.036 -17.955 211 HA GLN 30 HA GLN 30 0.437 -3.386 -18.428 212 1HB GLN 30 1HB GLN 30 -0.855 -2.146 -15.995 213 2HB GLN 30 2HB GLN 30 -0.214 -3.772 -15.877 214 1HG GLN 30 1HG GLN 30 2.015 -3.054 -16.451 215 2HG GLN 30 2HG GLN 30 1.451 -1.495 -17.021 216 1HE2 GLN 30 1HE2 GLN 30 2.932 -0.490 -15.633 217 2HE2 GLN 30 2HE2 GLN 30 2.636 -0.307 -13.936 218 H VAL 31 H VAL 31 -3.023 -2.778 -17.605 219 HA VAL 31 HA VAL 31 -3.683 -5.515 -17.365 220 HB VAL 31 HB VAL 31 -5.214 -2.950 -17.711 221 1HG1 VAL 31 1HG1 VAL 31 -6.424 -4.776 -18.914 222 2HG1 VAL 31 2HG1 VAL 31 -6.470 -5.695 -17.390 223 3HG1 VAL 31 3HG1 VAL 31 -7.311 -4.131 -17.512 224 1HG2 VAL 31 2HG2 VAL 31 -4.081 -4.198 -15.509 225 2HG2 VAL 31 3HG2 VAL 31 -5.346 -2.947 -15.474 226 3HG2 VAL 31 1HG2 VAL 31 -5.795 -4.669 -15.414 227 H GLU 32 H GLU 32 -4.186 -3.068 -20.005 228 HA GLU 32 HA GLU 32 -5.406 -4.648 -21.798 229 1HB GLU 32 1HB GLU 32 -3.648 -2.261 -21.924 230 2HB GLU 32 2HB GLU 32 -3.705 -3.175 -23.418 231 1HG GLU 32 1HG GLU 32 -6.339 -3.171 -22.961 232 2HG GLU 32 2HG GLU 32 -5.959 -1.785 -21.958 233 HE2 GLU 32 HE GLU 32 -5.418 -2.008 -25.861 234 H SER 33 H SER 33 -1.872 -4.461 -21.098 235 HA SER 33 HA SER 33 -1.214 -6.255 -23.172 236 1HB SER 33 1HB SER 33 0.164 -4.600 -21.261 237 2HB SER 33 2HB SER 33 0.804 -6.225 -21.111 238 HG SER 33 HG SER 33 2.023 -5.373 -22.741 239 H THR 34 H THR 34 -1.351 -6.508 -19.543 240 HA THR 34 HA THR 34 -0.710 -9.187 -19.337 241 HB THR 34 HB THR 34 -2.177 -7.114 -17.716 242 HG1 THR 34 1HG THR 34 -0.067 -9.118 -17.313 243 1HG2 THR 34 1HG2 THR 34 -3.468 -9.326 -17.409 244 2HG2 THR 34 2HG2 THR 34 -1.938 -10.031 -16.833 245 3HG2 THR 34 3HG2 THR 34 -2.692 -8.689 -15.939 246 H ALA 35 H ALA 35 -3.904 -7.651 -19.976 247 HA ALA 35 HA ALA 35 -5.435 -9.946 -19.762 248 1HB ALA 35 1HB ALA 35 -6.098 -7.950 -21.885 249 2HB ALA 35 3HB ALA 35 -5.921 -7.333 -20.225 250 3HB ALA 35 2HB ALA 35 -7.111 -8.609 -20.578 251 H GLY 36 H GLY 36 -3.192 -8.841 -22.280 252 1HA GLY 36 2HA GLY 36 -2.327 -9.953 -24.040 253 2HA GLY 36 1HA GLY 36 -4.000 -10.171 -24.512 254 H SER 37 H SER 37 -1.991 -11.534 -21.801 255 HA SER 37 HA SER 37 -1.816 -14.055 -22.947 256 1HB SER 37 1HB SER 37 -1.345 -12.878 -20.222 257 2HB SER 37 2HB SER 37 -1.454 -14.624 -20.331 258 HG SER 37 HG SER 37 0.131 -13.843 -22.364 259 H LEU 38 H LEU 38 -4.252 -12.459 -20.892 260 HA LEU 38 HA LEU 38 -5.587 -14.811 -20.094 261 1HB LEU 38 1HB LEU 38 -6.176 -11.883 -20.111 262 2HB LEU 38 2HB LEU 38 -7.495 -13.005 -19.840 263 HG LEU 38 HG LEU 38 -6.858 -12.549 -17.687 264 1HD1 LEU 38 1HD1 LEU 38 -6.545 -15.058 -18.404 265 2HD1 LEU 38 2HD1 LEU 38 -4.840 -14.738 -18.006 266 3HD1 LEU 38 3HD1 LEU 38 -6.099 -14.511 -16.769 267 1HD2 LEU 38 2HD2 LEU 38 -4.595 -11.465 -18.814 268 2HD2 LEU 38 3HD2 LEU 38 -4.963 -11.538 -17.074 269 3HD2 LEU 38 1HD2 LEU 38 -3.940 -12.789 -17.820 270 H GLN 39 H GLN 39 -6.626 -12.273 -22.486 271 HA GLN 39 HA GLN 39 -8.659 -13.712 -23.553 272 1HB GLN 39 1HB GLN 39 -8.064 -12.297 -25.702 273 2HB GLN 39 2HB GLN 39 -8.601 -11.487 -24.244 274 1HG GLN 39 1HG GLN 39 -5.727 -11.875 -24.095 275 2HG GLN 39 2HG GLN 39 -6.119 -11.140 -25.637 276 1HE2 GLN 39 1HE2 GLN 39 -7.858 -10.874 -22.565 277 2HE2 GLN 39 2HE2 GLN 39 -7.650 -9.171 -22.329 278 H GLY 40 H GLY 40 -5.225 -14.258 -23.843 279 1HA GLY 40 2HA GLY 40 -4.005 -15.465 -25.382 280 2HA GLY 40 1HA GLY 40 -5.460 -15.818 -26.293 281 H GLN 41 H GLN 41 -6.052 -16.275 -22.951 282 HA GLN 41 HA GLN 41 -5.747 -19.136 -23.350 283 1HB GLN 41 1HB GLN 41 -3.834 -18.090 -21.954 284 2HB GLN 41 2HB GLN 41 -5.035 -17.800 -20.712 285 1HG GLN 41 1HG GLN 41 -4.224 -20.500 -21.879 286 2HG GLN 41 2HG GLN 41 -3.940 -19.932 -20.245 287 1HE2 GLN 41 1HE2 GLN 41 -6.222 -18.866 -19.420 288 2HE2 GLN 41 2HE2 GLN 41 -7.525 -20.006 -19.403 289 H TRP 42 H TRP 42 -7.883 -19.750 -23.423 290 HA TRP 42 HA TRP 42 -9.439 -19.437 -21.051 291 1HB TRP 42 1HB TRP 42 -10.284 -17.953 -23.544 292 2HB TRP 42 2HB TRP 42 -11.359 -18.333 -22.213 293 HD1 TRP 42 HD TRP 42 -9.393 -15.515 -23.357 294 HE1 TRP 42 1HE TRP 42 -8.781 -13.759 -21.484 295 HE3 TRP 42 3HE TRP 42 -10.482 -18.546 -19.423 296 HZ2 TRP 42 2HZ TRP 42 -8.821 -13.833 -18.631 297 HZ3 TRP 42 3HZ TRP 42 -10.168 -17.627 -17.127 298 HH2 TRP 42 HH TRP 42 -9.369 -15.358 -16.698 299 H ARG 43 H ARG 43 -11.660 -20.581 -21.465 300 HA ARG 43 HA ARG 43 -11.187 -22.649 -23.460 301 1HB ARG 43 1HB ARG 43 -12.023 -22.789 -20.586 302 2HB ARG 43 2HB ARG 43 -12.885 -23.865 -21.667 303 1HG ARG 43 1HG ARG 43 -9.976 -23.859 -22.180 304 2HG ARG 43 2HG ARG 43 -10.358 -24.332 -20.537 305 1HD ARG 43 1HD ARG 43 -12.041 -26.001 -21.477 306 2HD ARG 43 2HD ARG 43 -11.477 -25.594 -23.086 307 HE ARG 43 HE ARG 43 -10.099 -27.261 -21.141 308 2HH1 ARG 43 1HH ARG 43 -7.175 -27.577 -22.988 309 1HH2 ARG 43 2HH2 ARG 43 -9.562 -25.057 -23.863 310 2HH2 ARG 43 1HH2 ARG 43 -8.029 -25.747 -24.279 311 H GLY 44 H GLY 44 -12.840 -19.926 -23.132 312 1HA GLY 44 2HA GLY 44 -15.397 -21.060 -24.102 313 2HA GLY 44 1HA GLY 44 -14.627 -19.641 -24.784 314 H ALA 45 H ALA 45 -16.168 -20.975 -21.818 315 HA ALA 45 HA ALA 45 -17.798 -18.927 -21.262 316 1HB ALA 45 3HB ALA 45 -16.621 -21.166 -19.844 317 2HB ALA 45 1HB ALA 45 -16.820 -19.780 -18.746 318 3HB ALA 45 2HB ALA 45 -18.223 -20.418 -19.635 319 H ALA 46 H ALA 46 -14.627 -19.268 -19.514 320 HA ALA 46 HA ALA 46 -14.657 -16.607 -18.634 321 1HB ALA 46 3HB ALA 46 -12.290 -17.102 -18.020 322 2HB ALA 46 1HB ALA 46 -13.413 -18.382 -17.503 323 3HB ALA 46 2HB ALA 46 -12.393 -18.621 -18.942 324 H GLY 47 H GLY 47 -13.745 -18.138 -21.668 325 1HA GLY 47 2HA GLY 47 -12.953 -17.307 -23.599 326 2HA GLY 47 1HA GLY 47 -11.878 -16.308 -22.641 327 H THR 48 H THR 48 -15.371 -16.505 -23.629 328 HA THR 48 HA THR 48 -15.378 -13.942 -24.761 329 HB THR 48 HB THR 48 -17.885 -14.353 -24.733 330 HG1 THR 48 1HG THR 48 -18.301 -16.602 -23.767 331 1HG2 THR 48 2HG2 THR 48 -16.258 -16.867 -25.382 332 2HG2 THR 48 3HG2 THR 48 -17.876 -16.469 -26.010 333 3HG2 THR 48 1HG2 THR 48 -16.469 -15.493 -26.495 334 H ALA 49 H ALA 49 -16.025 -15.094 -21.445 335 HA ALA 49 HA ALA 49 -17.265 -12.785 -20.507 336 1HB ALA 49 3HB ALA 49 -15.630 -15.001 -19.248 337 2HB ALA 49 2HB ALA 49 -17.386 -14.722 -19.165 338 3HB ALA 49 1HB ALA 49 -16.273 -13.658 -18.273 339 H ALA 50 H ALA 50 -13.771 -13.774 -20.502 340 HA ALA 50 HA ALA 50 -12.963 -11.247 -19.449 341 1HB ALA 50 2HB ALA 50 -10.662 -12.224 -20.098 342 2HB ALA 50 1HB ALA 50 -11.557 -13.691 -20.563 343 3HB ALA 50 3HB ALA 50 -11.613 -13.109 -18.882 344 H GLN 51 H GLN 51 -12.414 -12.920 -22.637 345 HA GLN 51 HA GLN 51 -11.230 -10.962 -23.975 346 1HB GLN 51 1HB GLN 51 -11.592 -13.009 -25.112 347 2HB GLN 51 2HB GLN 51 -13.323 -12.970 -24.844 348 1HG GLN 51 1HG GLN 51 -12.317 -10.628 -26.364 349 2HG GLN 51 2HG GLN 51 -12.035 -12.155 -27.175 350 1HE2 GLN 51 1HE2 GLN 51 -14.344 -9.837 -26.107 351 2HE2 GLN 51 2HE2 GLN 51 -15.768 -10.531 -26.807 352 H ALA 52 H ALA 52 -14.727 -11.157 -23.174 353 HA ALA 52 HA ALA 52 -15.431 -8.894 -24.744 354 1HB ALA 52 2HB ALA 52 -17.032 -10.666 -24.179 355 2HB ALA 52 1HB ALA 52 -17.582 -9.108 -23.518 356 3HB ALA 52 3HB ALA 52 -16.835 -10.316 -22.445 357 H ALA 53 H ALA 53 -14.708 -9.496 -21.250 358 HA ALA 53 HA ALA 53 -15.275 -6.959 -20.320 359 1HB ALA 53 3HB ALA 53 -12.995 -8.692 -19.321 360 2HB ALA 53 2HB ALA 53 -14.700 -9.135 -19.064 361 3HB ALA 53 1HB ALA 53 -14.063 -7.617 -18.387 362 H VAL 54 H VAL 54 -12.029 -8.302 -21.280 363 HA VAL 54 HA VAL 54 -10.671 -5.903 -21.085 364 HB VAL 54 HB VAL 54 -9.231 -7.618 -21.260 365 1HG1 VAL 54 2HG1 VAL 54 -11.333 -8.893 -22.980 366 2HG1 VAL 54 3HG1 VAL 54 -9.666 -9.513 -23.047 367 3HG1 VAL 54 1HG1 VAL 54 -10.547 -9.495 -21.500 368 1HG2 VAL 54 1HG2 VAL 54 -8.889 -5.976 -23.244 369 2HG2 VAL 54 2HG2 VAL 54 -7.994 -7.515 -23.237 370 3HG2 VAL 54 3HG2 VAL 54 -9.443 -7.332 -24.255 371 H VAL 55 H VAL 55 -12.696 -7.264 -23.704 372 HA VAL 55 HA VAL 55 -11.927 -5.492 -25.711 373 HB VAL 55 HB VAL 55 -14.220 -7.287 -25.128 374 1HG1 VAL 55 1HG1 VAL 55 -14.444 -4.839 -26.782 375 2HG1 VAL 55 2HG1 VAL 55 -15.010 -6.342 -27.551 376 3HG1 VAL 55 3HG1 VAL 55 -15.707 -5.819 -25.999 377 1HG2 VAL 55 1HG2 VAL 55 -12.030 -7.895 -26.309 378 2HG2 VAL 55 2HG2 VAL 55 -13.545 -8.383 -27.107 379 3HG2 VAL 55 3HG2 VAL 55 -12.649 -6.961 -27.692 380 H ARG 56 H ARG 56 -14.647 -5.327 -23.312 381 HA ARG 56 HA ARG 56 -15.503 -2.840 -24.202 382 1HB ARG 56 1HB ARG 56 -16.004 -4.624 -21.858 383 2HB ARG 56 2HB ARG 56 -16.327 -2.928 -21.560 384 1HG ARG 56 1HG ARG 56 -18.365 -4.030 -22.395 385 2HG ARG 56 2HG ARG 56 -17.812 -2.843 -23.560 386 1HD ARG 56 1HD ARG 56 -16.844 -4.561 -24.986 387 2HD ARG 56 2HD ARG 56 -17.045 -5.790 -23.753 388 HE ARG 56 HE ARG 56 -19.371 -5.904 -24.236 389 2HH1 ARG 56 1HH ARG 56 -21.125 -4.461 -26.863 390 1HH2 ARG 56 2HH2 ARG 56 -17.830 -3.301 -26.081 391 2HH2 ARG 56 1HH2 ARG 56 -19.182 -3.086 -27.143 392 H PHE 57 H PHE 57 -13.408 -3.873 -21.422 393 HA PHE 57 HA PHE 57 -12.995 -1.369 -20.332 394 1HB PHE 57 1HB PHE 57 -12.153 -3.133 -19.022 395 2HB PHE 57 2HB PHE 57 -11.715 -4.084 -20.428 396 HD1 PHE 57 1HD PHE 57 -10.585 -1.568 -18.041 397 HD2 PHE 57 2HD PHE 57 -9.537 -3.796 -21.497 398 HE1 PHE 57 1HE PHE 57 -8.173 -0.960 -17.702 399 HE2 PHE 57 2HE PHE 57 -7.126 -3.188 -21.158 400 HZ PHE 57 HZ PHE 57 -6.473 -1.777 -19.265 401 H GLN 58 H GLN 58 -11.413 -3.017 -23.098 402 HA GLN 58 HA GLN 58 -9.237 -1.330 -23.292 403 1HB GLN 58 1HB GLN 58 -10.735 -3.069 -25.269 404 2HB GLN 58 2HB GLN 58 -9.408 -2.064 -25.818 405 1HG GLN 58 1HG GLN 58 -8.705 -3.520 -23.361 406 2HG GLN 58 2HG GLN 58 -9.206 -4.617 -24.632 407 1HE2 GLN 58 1HE2 GLN 58 -6.891 -5.215 -24.313 408 2HE2 GLN 58 2HE2 GLN 58 -5.697 -4.429 -25.291 409 H GLU 59 H GLU 59 -12.346 -1.264 -25.192 410 HA GLU 59 HA GLU 59 -11.830 1.060 -26.520 411 1HB GLU 59 1HB GLU 59 -14.415 -0.254 -25.623 412 2HB GLU 59 2HB GLU 59 -14.437 1.235 -26.547 413 1HG GLU 59 1HG GLU 59 -12.773 -1.102 -27.528 414 2HG GLU 59 2HG GLU 59 -14.505 -1.104 -27.798 415 HE2 GLU 59 HE GLU 59 -15.191 0.357 -29.556 416 H ALA 60 H ALA 60 -12.936 0.525 -23.179 417 HA ALA 60 HA ALA 60 -13.723 3.241 -22.773 418 1HB ALA 60 2HB ALA 60 -13.262 0.834 -20.983 419 2HB ALA 60 1HB ALA 60 -14.808 1.576 -21.458 420 3HB ALA 60 3HB ALA 60 -13.718 2.430 -20.339 421 H ALA 61 H ALA 61 -10.751 1.317 -22.554 422 HA ALA 61 HA ALA 61 -9.303 2.924 -20.819 423 1HB ALA 61 3HB ALA 61 -8.865 0.595 -22.090 424 2HB ALA 61 1HB ALA 61 -7.938 1.667 -23.167 425 3HB ALA 61 2HB ALA 61 -7.539 1.584 -21.435 426 H ASN 62 H ASN 62 -9.352 2.966 -24.459 427 HA ASN 62 HA ASN 62 -7.747 5.107 -24.799 428 1HB ASN 62 1HB ASN 62 -10.251 4.846 -26.496 429 2HB ASN 62 2HB ASN 62 -8.618 5.216 -27.014 430 1HD2 ASN 62 1HD2 ASN 62 -10.775 2.712 -25.826 431 2HD2 ASN 62 2HD2 ASN 62 -9.899 1.339 -26.417 432 H LYS 63 H LYS 63 -11.391 5.065 -24.584 433 HA LYS 63 HA LYS 63 -11.845 7.755 -24.753 434 1HB LYS 63 1HB LYS 63 -13.535 5.902 -24.766 435 2HB LYS 63 2HB LYS 63 -13.373 5.788 -23.026 436 1HG LYS 63 1HG LYS 63 -14.931 7.425 -22.845 437 2HG LYS 63 2HG LYS 63 -13.749 8.546 -23.492 438 1HD LYS 63 1HD LYS 63 -15.901 8.556 -24.785 439 2HD LYS 63 2HD LYS 63 -14.517 8.148 -25.781 440 1HE LYS 63 1HE LYS 63 -15.134 5.886 -25.969 441 2HE LYS 63 2HE LYS 63 -16.024 5.889 -24.460 442 H GLN 64 H GLN 64 -10.624 5.823 -22.016 443 HA GLN 64 HA GLN 64 -10.948 7.970 -20.186 444 1HB GLN 64 1HB GLN 64 -10.498 5.204 -20.004 445 2HB GLN 64 2HB GLN 64 -9.002 5.902 -19.416 446 1HG GLN 64 1HG GLN 64 -11.489 7.208 -18.398 447 2HG GLN 64 2HG GLN 64 -11.255 5.552 -17.875 448 1HE2 GLN 64 1HE2 GLN 64 -10.118 8.815 -17.751 449 2HE2 GLN 64 2HE2 GLN 64 -8.928 8.633 -16.506 450 H LYS 65 H LYS 65 -8.365 6.663 -22.287 451 HA LYS 65 HA LYS 65 -6.304 8.227 -21.111 452 1HB LYS 65 1HB LYS 65 -6.607 6.346 -23.381 453 2HB LYS 65 2HB LYS 65 -5.363 7.564 -23.578 454 1HG LYS 65 1HG LYS 65 -4.267 5.748 -22.480 455 2HG LYS 65 2HG LYS 65 -4.538 6.934 -21.218 456 1HD LYS 65 1HD LYS 65 -6.672 4.850 -21.691 457 2HD LYS 65 2HD LYS 65 -5.200 4.354 -20.879 458 1HE LYS 65 1HE LYS 65 -6.970 6.687 -20.002 459 2HE LYS 65 2HE LYS 65 -6.987 5.092 -19.276 460 H GLN 66 H GLN 66 -8.742 8.681 -23.662 461 HA GLN 66 HA GLN 66 -7.480 10.930 -24.780 462 1HB GLN 66 1HB GLN 66 -9.674 9.291 -25.404 463 2HB GLN 66 2HB GLN 66 -10.405 10.851 -25.084 464 1HG GLN 66 1HG GLN 66 -9.849 11.320 -27.253 465 2HG GLN 66 2HG GLN 66 -8.249 11.627 -26.606 466 1HE2 GLN 66 1HE2 GLN 66 -7.751 11.075 -28.889 467 2HE2 GLN 66 2HE2 GLN 66 -7.422 9.422 -29.290 468 H GLU 67 H GLU 67 -10.124 10.447 -22.357 469 HA GLU 67 HA GLU 67 -10.444 13.247 -22.022 470 1HB GLU 67 1HB GLU 67 -12.247 12.701 -20.660 471 2HB GLU 67 2HB GLU 67 -12.146 11.253 -21.641 472 1HG GLU 67 1HG GLU 67 -12.089 10.157 -19.633 473 2HG GLU 67 2HG GLU 67 -10.392 10.595 -19.631 474 HE2 GLU 67 HE GLU 67 -12.578 13.282 -17.626 475 H LEU 68 H LEU 68 -8.409 10.716 -20.678 476 HA LEU 68 HA LEU 68 -7.850 12.066 -18.232 477 1HB LEU 68 1HB LEU 68 -7.680 9.697 -18.317 478 2HB LEU 68 2HB LEU 68 -6.591 9.748 -19.689 479 HG LEU 68 HG LEU 68 -5.017 11.064 -18.045 480 1HD1 LEU 68 2HD1 LEU 68 -7.200 10.406 -16.319 481 2HD1 LEU 68 3HD1 LEU 68 -5.756 9.515 -15.783 482 3HD1 LEU 68 1HD1 LEU 68 -5.698 11.286 -15.949 483 1HD2 LEU 68 2HD2 LEU 68 -5.065 8.531 -19.019 484 2HD2 LEU 68 3HD2 LEU 68 -3.778 9.188 -17.979 485 3HD2 LEU 68 1HD2 LEU 68 -5.088 8.215 -17.267 486 H ASP 69 H ASP 69 -6.495 11.995 -21.538 487 HA ASP 69 HA ASP 69 -4.176 13.424 -20.762 488 1HB ASP 69 1HB ASP 69 -4.727 11.869 -22.879 489 2HB ASP 69 2HB ASP 69 -5.229 13.387 -23.595 490 HD2 ASP 69 HD ASP 69 -2.204 13.906 -24.722 491 H GLU 70 H GLU 70 -7.261 14.118 -22.562 492 HA GLU 70 HA GLU 70 -6.808 16.708 -23.206 493 1HB GLU 70 1HB GLU 70 -9.109 16.849 -23.640 494 2HB GLU 70 2HB GLU 70 -8.829 15.120 -23.700 495 1HG GLU 70 1HG GLU 70 -9.571 14.912 -21.322 496 2HG GLU 70 2HG GLU 70 -9.839 16.642 -21.250 497 HE2 GLU 70 HE GLU 70 -10.865 15.528 -24.330 498 H ILE 71 H ILE 71 -8.125 15.369 -20.113 499 HA ILE 71 HA ILE 71 -8.623 17.844 -18.917 500 HB ILE 71 HB ILE 71 -8.192 15.049 -17.920 501 1HG1 ILE 71 1HG1 ILE 71 -10.602 16.881 -17.780 502 2HG1 ILE 71 2HG1 ILE 71 -10.312 15.744 -19.081 503 1HG2 ILE 71 2HG2 ILE 71 -7.954 17.520 -16.359 504 2HG2 ILE 71 3HG2 ILE 71 -9.185 16.394 -15.738 505 3HG2 ILE 71 1HG2 ILE 71 -7.504 15.847 -15.949 506 1HD1 ILE 71 3HD1 ILE 71 -10.237 14.782 -16.208 507 2HD1 ILE 71 1HD1 ILE 71 -11.794 14.999 -17.042 508 3HD1 ILE 71 2HD1 ILE 71 -10.590 13.859 -17.689 509 H SER 72 H SER 72 -5.709 15.721 -19.002 510 HA SER 72 HA SER 72 -4.249 17.237 -17.195 511 1HB SER 72 1HB SER 72 -2.488 15.810 -17.707 512 2HB SER 72 2HB SER 72 -3.840 14.849 -18.270 513 HG SER 72 HG SER 72 -3.340 16.187 -20.404 514 H THR 73 H THR 73 -5.071 17.678 -20.594 515 HA THR 73 HA THR 73 -2.969 19.659 -20.976 516 HB THR 73 HB THR 73 -5.085 18.345 -22.746 517 HG1 THR 73 1HG THR 73 -3.259 17.169 -23.247 518 1HG2 THR 73 3HG2 THR 73 -4.064 20.926 -23.175 519 2HG2 THR 73 1HG2 THR 73 -2.922 19.882 -24.055 520 3HG2 THR 73 2HG2 THR 73 -4.658 19.830 -24.445 521 H ASN 74 H ASN 74 -6.375 19.423 -20.125 522 HA ASN 74 HA ASN 74 -7.243 21.859 -20.986 523 1HB ASN 74 1HB ASN 74 -7.993 19.913 -18.857 524 2HB ASN 74 2HB ASN 74 -8.512 21.552 -18.516 525 1HD2 ASN 74 1HD2 ASN 74 -8.817 18.786 -20.577 526 2HD2 ASN 74 2HD2 ASN 74 -10.204 19.288 -21.485 527 H ILE 75 H ILE 75 -5.152 20.915 -18.257 528 HA ILE 75 HA ILE 75 -5.398 23.279 -16.757 529 HB ILE 75 HB ILE 75 -2.968 21.513 -16.821 530 1HG1 ILE 75 1HG1 ILE 75 -4.783 19.950 -16.851 531 2HG1 ILE 75 2HG1 ILE 75 -4.142 20.016 -15.221 532 1HG2 ILE 75 2HG2 ILE 75 -4.209 23.446 -14.934 533 2HG2 ILE 75 3HG2 ILE 75 -3.464 21.990 -14.232 534 3HG2 ILE 75 1HG2 ILE 75 -2.497 23.080 -15.254 535 1HD1 ILE 75 2HD1 ILE 75 -5.975 21.722 -14.674 536 2HD1 ILE 75 3HD1 ILE 75 -6.685 21.334 -16.260 537 3HD1 ILE 75 1HD1 ILE 75 -6.542 20.069 -15.015 538 H ARG 76 H ARG 76 -2.991 22.185 -19.238 539 HA ARG 76 HA ARG 76 -1.402 24.388 -19.130 540 1HB ARG 76 1HB ARG 76 -2.099 22.950 -21.730 541 2HB ARG 76 2HB ARG 76 -0.573 23.702 -21.307 542 1HG ARG 76 1HG ARG 76 -0.731 21.937 -19.251 543 2HG ARG 76 2HG ARG 76 -1.704 21.062 -20.418 544 1HD ARG 76 1HD ARG 76 0.699 22.117 -21.709 545 2HD ARG 76 2HD ARG 76 1.139 21.183 -20.293 546 HE ARG 76 HE ARG 76 -0.685 19.524 -21.464 547 2HH1 ARG 76 1HH ARG 76 0.954 18.157 -24.203 548 1HH2 ARG 76 2HH2 ARG 76 2.085 21.262 -22.827 549 2HH2 ARG 76 1HH2 ARG 76 2.372 20.084 -24.065 550 H GLN 77 H GLN 77 -4.622 23.955 -20.534 551 HA GLN 77 HA GLN 77 -4.440 26.266 -22.180 552 1HB GLN 77 1HB GLN 77 -6.665 24.361 -21.400 553 2HB GLN 77 2HB GLN 77 -7.032 25.837 -22.270 554 1HG GLN 77 1HG GLN 77 -4.757 24.538 -23.530 555 2HG GLN 77 2HG GLN 77 -6.047 23.368 -23.339 556 1HE2 GLN 77 1HE2 GLN 77 -7.573 23.311 -24.803 557 2HE2 GLN 77 2HE2 GLN 77 -7.979 24.552 -25.941 558 H ALA 78 H ALA 78 -5.195 25.547 -18.837 559 HA ALA 78 HA ALA 78 -6.865 27.784 -18.354 560 1HB ALA 78 2HB ALA 78 -5.124 26.363 -16.320 561 2HB ALA 78 3HB ALA 78 -6.720 27.115 -16.087 562 3HB ALA 78 1HB ALA 78 -6.577 25.597 -17.006 563 H GLY 79 H GLY 79 -3.456 27.354 -18.907 564 1HA GLY 79 2HA GLY 79 -3.001 30.138 -18.028 565 2HA GLY 79 1HA GLY 79 -2.196 29.342 -19.366 566 H VAL 80 H VAL 80 -2.160 26.760 -17.560 567 HA VAL 80 HA VAL 80 0.101 27.626 -15.893 568 HB VAL 80 HB VAL 80 -1.456 26.883 -14.380 569 1HG1 VAL 80 1HG1 VAL 80 -3.169 26.192 -15.986 570 2HG1 VAL 80 2HG1 VAL 80 -2.272 24.691 -16.320 571 3HG1 VAL 80 3HG1 VAL 80 -2.974 24.969 -14.708 572 1HG2 VAL 80 3HG2 VAL 80 0.736 25.549 -14.362 573 2HG2 VAL 80 1HG2 VAL 80 -0.637 24.876 -13.450 574 3HG2 VAL 80 2HG2 VAL 80 -0.214 24.206 -15.044 575 H GLN 81 H GLN 81 1.765 27.375 -17.401 576 HA GLN 81 HA GLN 81 2.203 24.603 -18.144 577 1HB GLN 81 1HB GLN 81 3.230 25.730 -20.349 578 2HB GLN 81 2HB GLN 81 1.546 25.255 -20.257 579 1HG GLN 81 1HG GLN 81 0.785 27.435 -20.180 580 2HG GLN 81 2HG GLN 81 2.135 27.988 -19.210 581 1HE2 GLN 81 1HE2 GLN 81 0.781 27.720 -22.310 582 2HE2 GLN 81 2HE2 GLN 81 2.078 28.377 -23.253 583 H TYR 82 H TYR 82 3.194 26.956 -16.230 584 HA TYR 82 HA TYR 82 5.952 26.140 -16.375 585 1HB TYR 82 1HB TYR 82 6.775 28.411 -16.757 586 2HB TYR 82 2HB TYR 82 5.532 28.167 -17.969 587 HD1 TYR 82 1HD TYR 82 3.028 28.746 -16.874 588 HD2 TYR 82 2HD TYR 82 6.774 30.526 -15.826 589 HE1 TYR 82 1HE TYR 82 1.817 30.821 -16.041 590 HE2 TYR 82 2HE TYR 82 5.551 32.595 -14.997 591 HH TYR 82 HH TYR 82 2.355 32.644 -14.312 592 H SER 83 H SER 83 6.650 25.845 -14.316 593 HA SER 83 HA SER 83 5.646 27.656 -12.304 594 1HB SER 83 1HB SER 83 5.260 25.628 -10.764 595 2HB SER 83 2HB SER 83 4.054 25.920 -12.002 596 HG SER 83 HG SER 83 5.054 24.280 -13.321 597 H ARG 84 H ARG 84 7.522 24.545 -12.640 598 HA ARG 84 HA ARG 84 9.478 25.621 -10.844 599 1HB ARG 84 1HB ARG 84 8.992 22.917 -12.138 600 2HB ARG 84 2HB ARG 84 10.550 23.252 -11.408 601 1HG ARG 84 1HG ARG 84 9.713 22.923 -9.326 602 2HG ARG 84 2HG ARG 84 8.465 24.125 -9.588 603 1HD ARG 84 1HD ARG 84 6.880 22.546 -10.276 604 2HD ARG 84 2HD ARG 84 8.086 21.447 -10.915 605 HE ARG 84 HE ARG 84 8.390 20.518 -8.758 606 2HH1 ARG 84 1HH ARG 84 6.660 21.137 -5.811 607 1HH2 ARG 84 2HH2 ARG 84 6.313 23.384 -8.575 608 2HH2 ARG 84 1HH2 ARG 84 5.814 23.071 -6.947 609 H ALA 85 H ALA 85 10.032 23.589 -13.789 610 HA ALA 85 HA ALA 85 11.855 25.685 -14.755 611 1HB ALA 85 3HB ALA 85 13.240 23.932 -13.935 612 2HB ALA 85 1HB ALA 85 12.181 22.671 -14.612 613 3HB ALA 85 2HB ALA 85 13.164 23.685 -15.696 614 H ASP 86 H ASP 86 10.796 22.532 -16.157 615 HA ASP 86 HA ASP 86 9.272 24.052 -18.106 616 1HB ASP 86 1HB ASP 86 10.769 21.672 -19.124 617 2HB ASP 86 2HB ASP 86 10.392 23.177 -19.938 618 HD2 ASP 86 HD ASP 86 13.910 22.449 -18.893 619 H GLU 87 H GLU 87 8.300 22.605 -15.822 620 HA GLU 87 HA GLU 87 7.834 19.996 -15.983 621 1HB GLU 87 1HB GLU 87 7.007 21.519 -14.189 622 2HB GLU 87 2HB GLU 87 5.759 22.115 -15.265 623 1HG GLU 87 1HG GLU 87 4.871 19.754 -15.476 624 2HG GLU 87 2HG GLU 87 6.068 19.230 -14.308 625 HE2 GLU 87 HE GLU 87 2.683 20.321 -13.119 626 H GLU 88 H GLU 88 6.083 22.570 -17.816 627 HA GLU 88 HA GLU 88 4.189 20.911 -18.941 628 1HB GLU 88 1HB GLU 88 3.975 23.337 -19.009 629 2HB GLU 88 2HB GLU 88 5.447 23.497 -19.946 630 1HG GLU 88 1HG GLU 88 3.277 21.745 -21.082 631 2HG GLU 88 2HG GLU 88 2.997 23.475 -21.094 632 HE2 GLU 88 HE GLU 88 4.589 23.896 -23.857 633 H GLN 89 H GLN 89 7.541 21.744 -19.952 634 HA GLN 89 HA GLN 89 7.215 20.040 -22.266 635 1HB GLN 89 1HB GLN 89 8.427 22.415 -22.118 636 2HB GLN 89 2HB GLN 89 9.794 21.453 -21.592 637 1HG GLN 89 1HG GLN 89 9.893 20.236 -23.639 638 2HG GLN 89 2HG GLN 89 8.250 20.656 -24.080 639 1HE2 GLN 89 1HE2 GLN 89 11.521 21.876 -23.650 640 2HE2 GLN 89 2HE2 GLN 89 11.410 23.238 -24.715 641 H GLN 90 H GLN 90 7.311 19.094 -19.360 642 HA GLN 90 HA GLN 90 9.691 18.039 -18.661 643 1HB GLN 90 1HB GLN 90 8.395 16.338 -17.406 644 2HB GLN 90 2HB GLN 90 7.680 17.930 -17.251 645 1HG GLN 90 1HG GLN 90 6.083 17.338 -19.133 646 2HG GLN 90 2HG GLN 90 6.749 15.717 -19.140 647 1HE2 GLN 90 1HE2 GLN 90 6.445 14.345 -17.377 648 2HE2 GLN 90 2HE2 GLN 90 5.186 14.584 -16.211 649 H GLN 91 H GLN 91 7.545 17.062 -21.296 650 HA GLN 91 HA GLN 91 8.359 14.473 -21.642 651 1HB GLN 91 1HB GLN 91 6.483 15.629 -22.850 652 2HB GLN 91 2HB GLN 91 7.660 16.496 -23.816 653 1HG GLN 91 1HG GLN 91 8.491 13.836 -24.076 654 2HG GLN 91 2HG GLN 91 6.745 13.692 -24.041 655 1HE2 GLN 91 1HE2 GLN 91 8.571 13.226 -26.226 656 2HE2 GLN 91 2HE2 GLN 91 8.127 14.278 -27.528 657 H ALA 92 H ALA 92 10.010 17.529 -22.375 658 HA ALA 92 HA ALA 92 12.118 16.044 -23.766 659 1HB ALA 92 3HB ALA 92 10.988 18.094 -24.796 660 2HB ALA 92 1HB ALA 92 11.785 19.053 -23.526 661 3HB ALA 92 2HB ALA 92 12.765 18.144 -24.702 662 H LEU 93 H LEU 93 11.687 15.745 -20.891 663 HA LEU 93 HA LEU 93 13.542 17.456 -19.562 664 1HB LEU 93 1HB LEU 93 11.703 16.644 -18.325 665 2HB LEU 93 2HB LEU 93 12.009 14.983 -18.794 666 HG LEU 93 HG LEU 93 14.344 15.907 -17.456 667 1HD1 LEU 93 1HD1 LEU 93 13.001 17.711 -16.511 668 2HD1 LEU 93 2HD1 LEU 93 11.806 16.531 -15.921 669 3HD1 LEU 93 3HD1 LEU 93 13.458 16.531 -15.260 670 1HD2 LEU 93 1HD2 LEU 93 12.150 13.954 -16.736 671 2HD2 LEU 93 2HD2 LEU 93 13.734 13.610 -17.471 672 3HD2 LEU 93 3HD2 LEU 93 13.638 14.162 -15.781 673 H SER 94 H SER 94 15.178 16.973 -21.426 674 HA SER 94 HA SER 94 16.593 14.511 -20.806 675 1HB SER 94 1HB SER 94 16.078 16.010 -23.251 676 2HB SER 94 2HB SER 94 17.805 15.818 -23.027 677 HG SER 94 HG SER 94 15.811 13.862 -23.506 678 H SER 95 H SER 95 16.620 17.967 -20.407 679 HA SER 95 HA SER 95 19.343 18.435 -20.387 680 1HB SER 95 1HB SER 95 17.787 20.283 -20.442 681 2HB SER 95 2HB SER 95 17.019 19.775 -18.951 682 HG SER 95 HG SER 95 19.756 20.176 -18.629 683 H GLN 96 H GLN 96 17.069 17.907 -17.586 684 HA GLN 96 HA GLN 96 19.152 17.715 -15.739 685 1HB GLN 96 1HB GLN 96 16.667 18.249 -15.323 686 2HB GLN 96 2HB GLN 96 16.367 16.525 -15.431 687 1HG GLN 96 1HG GLN 96 17.711 16.049 -13.503 688 2HG GLN 96 2HG GLN 96 18.496 17.615 -13.554 689 1HE2 GLN 96 1HE2 GLN 96 17.893 18.904 -12.006 690 2HE2 GLN 96 2HE2 GLN 96 16.315 19.050 -11.305 691 H MET 97 H MET 97 16.982 15.173 -17.182 692 HA MET 97 HA MET 97 18.222 13.034 -16.006 693 1HB MET 97 1HB MET 97 16.029 13.150 -17.376 694 2HB MET 97 2HB MET 97 17.015 13.110 -18.824 695 1HG MET 97 1HG MET 97 18.087 10.951 -17.645 696 2HG MET 97 2HG MET 97 16.566 10.933 -16.776 697 1HE MET 97 1HE MET 97 14.653 10.323 -17.353 698 2HE MET 97 2HE MET 97 13.940 11.061 -18.807 699 3HE MET 97 3HE MET 97 14.242 9.308 -18.756 700 H GLY 98 H GLY 98 19.773 11.450 -16.799 701 1HA GLY 98 2HA GLY 98 22.151 12.384 -17.701 702 2HA GLY 98 1HA GLY 98 21.288 12.025 -19.184 703 H PHE 99 H PHE 99 21.398 10.422 -15.918 704 HA PHE 99 HA PHE 99 22.970 8.295 -16.605 705 1HB PHE 99 1HB PHE 99 21.951 9.070 -14.338 706 2HB PHE 99 2HB PHE 99 20.463 8.283 -14.823 707 HD1 PHE 99 1HD PHE 99 20.441 5.796 -15.144 708 HD2 PHE 99 2HD PHE 99 23.760 7.821 -13.444 709 HE1 PHE 99 1HE PHE 99 21.275 3.629 -14.191 710 HE2 PHE 99 2HE PHE 99 24.594 5.654 -12.491 711 HZ PHE 99 HZ PHE 99 23.342 3.584 -12.876 712 H MET 601 H MET 601 7.196 -20.088 -17.549 713 HA MET 601 HA MET 601 9.188 -20.943 -17.307 714 1HB MET 601 1HB MET 601 8.600 -19.959 -14.959 715 2HB MET 601 2HB MET 601 8.354 -21.614 -14.437 716 1HG MET 601 1HG MET 601 10.631 -22.170 -14.634 717 2HG MET 601 2HG MET 601 10.936 -20.954 -15.858 718 1HE MET 601 3HE MET 601 12.959 -19.882 -14.939 719 2HE MET 601 1HE MET 601 13.217 -19.405 -13.244 720 3HE MET 601 2HE MET 601 13.057 -21.126 -13.670 721 H THR 602 H THR 602 7.171 -23.093 -15.162 722 HA THR 602 HA THR 602 8.615 -25.404 -15.584 723 HB THR 602 HB THR 602 5.595 -25.153 -15.155 724 HG1 THR 602 1HG THR 602 7.925 -25.040 -13.370 725 1HG2 THR 602 1HG2 THR 602 7.295 -27.415 -15.207 726 2HG2 THR 602 2HG2 THR 602 7.151 -27.005 -13.481 727 3HG2 THR 602 3HG2 THR 602 5.689 -27.327 -14.443 728 H GLU 603 H GLU 603 6.255 -23.798 -17.692 729 HA GLU 603 HA GLU 603 6.998 -25.715 -19.717 730 1HB GLU 603 1HB GLU 603 4.526 -25.848 -20.428 731 2HB GLU 603 2HB GLU 603 4.990 -26.769 -19.011 732 1HG GLU 603 1HG GLU 603 4.247 -24.754 -17.594 733 2HG GLU 603 2HG GLU 603 3.577 -24.065 -19.059 734 HE2 GLU 603 HE GLU 603 1.197 -26.326 -17.182 735 H GLN 604 H GLN 604 7.844 -24.428 -21.295 736 HA GLN 604 HA GLN 604 7.367 -21.718 -21.436 737 1HB GLN 604 1HB GLN 604 8.611 -23.773 -23.252 738 2HB GLN 604 2HB GLN 604 8.280 -22.187 -23.921 739 1HG GLN 604 1HG GLN 604 9.779 -21.100 -22.471 740 2HG GLN 604 2HG GLN 604 9.653 -22.338 -21.236 741 1HE2 GLN 604 1HE2 GLN 604 10.932 -24.113 -21.278 742 2HE2 GLN 604 2HE2 GLN 604 12.235 -24.366 -22.391 743 H GLN 605 H GLN 605 5.734 -24.503 -22.966 744 HA GLN 605 HA GLN 605 4.452 -23.451 -25.026 745 1HB GLN 605 1HB GLN 605 3.324 -25.264 -22.855 746 2HB GLN 605 2HB GLN 605 2.478 -24.946 -24.356 747 1HG GLN 605 1HG GLN 605 5.267 -25.658 -24.890 748 2HG GLN 605 2HG GLN 605 4.500 -26.889 -23.907 749 1HE2 GLN 605 1HE2 GLN 605 3.390 -28.391 -24.895 750 2HE2 GLN 605 2HE2 GLN 605 2.716 -28.321 -26.489 751 H TRP 606 H TRP 606 3.390 -23.113 -21.571 752 HA TRP 606 HA TRP 606 2.095 -20.614 -22.318 753 1HB TRP 606 1HB TRP 606 0.691 -23.075 -21.505 754 2HB TRP 606 2HB TRP 606 0.241 -21.640 -20.605 755 HD1 TRP 606 HD TRP 606 -0.347 -23.304 -23.930 756 HE1 TRP 606 1HE TRP 606 -1.897 -21.877 -25.518 757 HE3 TRP 606 3HE TRP 606 -0.178 -19.054 -21.144 758 HZ2 TRP 606 2HZ TRP 606 -2.857 -19.190 -25.433 759 HZ3 TRP 606 3HZ TRP 606 -1.449 -17.074 -21.967 760 HH2 TRP 606 HH TRP 606 -2.756 -17.096 -24.032 761 H ASN 607 H ASN 607 3.604 -19.415 -21.131 762 HA ASN 607 HA ASN 607 4.710 -20.248 -18.757 763 1HB ASN 607 1HB ASN 607 5.073 -17.672 -18.433 764 2HB ASN 607 2HB ASN 607 5.789 -18.422 -19.846 765 1HD2 ASN 607 1HD2 ASN 607 5.683 -16.034 -20.381 766 2HD2 ASN 607 2HD2 ASN 607 4.305 -15.477 -21.270 767 H PHE 608 H PHE 608 3.201 -20.948 -17.158 768 HA PHE 608 HA PHE 608 0.739 -19.912 -16.644 769 1HB PHE 608 1HB PHE 608 2.917 -21.409 -15.221 770 2HB PHE 608 2HB PHE 608 1.777 -20.636 -14.137 771 HD1 PHE 608 1HD PHE 608 -0.747 -20.925 -15.667 772 HD2 PHE 608 2HD PHE 608 2.422 -23.676 -15.041 773 HE1 PHE 608 1HE PHE 608 -2.344 -22.836 -15.982 774 HE2 PHE 608 2HE PHE 608 0.826 -25.587 -15.355 775 HZ PHE 608 HZ PHE 608 -1.538 -25.145 -15.822 776 H ALA 609 H ALA 609 3.896 -18.934 -15.141 777 HA ALA 609 HA ALA 609 2.763 -16.994 -13.461 778 1HB ALA 609 1HB ALA 609 4.997 -16.443 -12.959 779 2HB ALA 609 3HB ALA 609 5.571 -16.888 -14.584 780 3HB ALA 609 2HB ALA 609 5.090 -18.157 -13.433 781 H GLY 610 H GLY 610 2.740 -17.152 -16.802 782 1HA GLY 610 2HA GLY 610 3.007 -15.514 -18.446 783 2HA GLY 610 1HA GLY 610 3.156 -14.277 -17.213 784 H ILE 611 H ILE 611 0.708 -16.866 -17.979 785 HA ILE 611 HA ILE 611 -1.275 -14.796 -18.392 786 HB ILE 611 HB ILE 611 -1.134 -16.582 -19.996 787 1HG1 ILE 611 1HG1 ILE 611 -3.406 -15.591 -19.002 788 2HG1 ILE 611 2HG1 ILE 611 -3.371 -16.779 -20.291 789 1HG2 ILE 611 2HG2 ILE 611 -1.538 -18.411 -17.622 790 2HG2 ILE 611 3HG2 ILE 611 -1.781 -18.922 -19.309 791 3HG2 ILE 611 1HG2 ILE 611 -0.177 -18.373 -18.768 792 1HD1 ILE 611 2HD1 ILE 611 -3.635 -18.613 -18.622 793 2HD1 ILE 611 3HD1 ILE 611 -3.678 -17.404 -17.317 794 3HD1 ILE 611 1HD1 ILE 611 -4.977 -17.447 -18.533 795 H GLU 612 H GLU 612 -0.438 -17.429 -16.099 796 HA GLU 612 HA GLU 612 -2.805 -17.234 -14.639 797 1HB GLU 612 1HB GLU 612 -0.997 -19.101 -14.652 798 2HB GLU 612 2HB GLU 612 -0.125 -18.107 -13.503 799 1HG GLU 612 1HG GLU 612 -2.234 -18.070 -12.059 800 2HG GLU 612 2HG GLU 612 -2.943 -19.232 -13.162 801 HE2 GLU 612 HE GLU 612 0.152 -20.241 -10.825 802 H ALA 613 H ALA 613 0.530 -15.923 -14.004 803 HA ALA 613 HA ALA 613 -0.268 -14.461 -11.733 804 1HB ALA 613 2HB ALA 613 2.111 -15.147 -13.065 805 2HB ALA 613 3HB ALA 613 2.040 -13.370 -13.142 806 3HB ALA 613 1HB ALA 613 1.961 -14.196 -11.568 807 H ALA 614 H ALA 614 -0.524 -13.936 -15.202 808 HA ALA 614 HA ALA 614 -0.543 -11.180 -15.318 809 1HB ALA 614 3HB ALA 614 -1.601 -13.462 -16.903 810 2HB ALA 614 1HB ALA 614 -2.392 -11.895 -17.194 811 3HB ALA 614 2HB ALA 614 -0.634 -12.059 -17.419 812 H ALA 615 H ALA 615 -3.225 -13.500 -14.577 813 HA ALA 615 HA ALA 615 -5.247 -11.618 -14.373 814 1HB ALA 615 3HB ALA 615 -5.747 -13.963 -14.477 815 2HB ALA 615 2HB ALA 615 -6.297 -13.394 -12.883 816 3HB ALA 615 1HB ALA 615 -4.773 -14.301 -13.026 817 H SER 616 H SER 616 -3.009 -12.936 -11.839 818 HA SER 616 HA SER 616 -4.050 -11.581 -9.724 819 1HB SER 616 1HB SER 616 -1.860 -13.225 -10.185 820 2HB SER 616 2HB SER 616 -1.087 -11.716 -9.743 821 HG SER 616 HG SER 616 -2.171 -11.710 -7.749 822 H ALA 617 H ALA 617 -2.038 -10.430 -12.412 823 HA ALA 617 HA ALA 617 -1.232 -8.015 -11.140 824 1HB ALA 617 3HB ALA 617 -0.421 -9.450 -13.325 825 2HB ALA 617 2HB ALA 617 0.018 -7.753 -13.022 826 3HB ALA 617 1HB ALA 617 -1.342 -8.140 -14.102 827 H ILE 618 H ILE 618 -3.907 -9.056 -13.313 828 HA ILE 618 HA ILE 618 -4.909 -6.545 -13.903 829 HB ILE 618 HB ILE 618 -6.308 -9.202 -13.590 830 1HG1 ILE 618 1HG1 ILE 618 -4.434 -9.123 -15.231 831 2HG1 ILE 618 2HG1 ILE 618 -5.996 -9.476 -15.943 832 1HG2 ILE 618 2HG2 ILE 618 -7.928 -7.389 -13.444 833 2HG2 ILE 618 3HG2 ILE 618 -7.275 -6.662 -14.932 834 3HG2 ILE 618 1HG2 ILE 618 -8.080 -8.248 -14.995 835 1HD1 ILE 618 1HD1 ILE 618 -5.547 -6.588 -15.864 836 2HD1 ILE 618 2HD1 ILE 618 -4.218 -7.420 -16.707 837 3HD1 ILE 618 3HD1 ILE 618 -5.895 -7.634 -17.261 838 H GLN 619 H GLN 619 -5.426 -8.686 -11.054 839 HA GLN 619 HA GLN 619 -7.451 -7.197 -9.922 840 1HB GLN 619 1HB GLN 619 -5.705 -9.394 -9.170 841 2HB GLN 619 2HB GLN 619 -5.875 -8.298 -7.813 842 1HG GLN 619 1HG GLN 619 -8.230 -9.409 -9.411 843 2HG GLN 619 2HG GLN 619 -7.649 -10.107 -7.912 844 1HE2 GLN 619 1HE2 GLN 619 -10.136 -8.592 -8.902 845 2HE2 GLN 619 2HE2 GLN 619 -10.458 -7.423 -7.665 846 H GLY 620 H GLY 620 -3.857 -7.023 -9.480 847 1HA GLY 620 2HA GLY 620 -2.545 -5.448 -8.554 848 2HA GLY 620 1HA GLY 620 -3.906 -4.935 -7.576 849 H ASN 621 H ASN 621 -3.771 -5.037 -11.180 850 HA ASN 621 HA ASN 621 -3.183 -2.314 -11.433 851 1HB ASN 621 1HB ASN 621 -4.206 -4.499 -13.269 852 2HB ASN 621 2HB ASN 621 -4.277 -2.842 -13.834 853 1HD2 ASN 621 1HD2 ASN 621 -2.160 -1.579 -13.166 854 2HD2 ASN 621 2HD2 ASN 621 -0.679 -2.332 -13.654 855 H VAL 622 H VAL 622 -6.135 -4.286 -11.084 856 HA VAL 622 HA VAL 622 -7.976 -2.380 -12.025 857 HB VAL 622 HB VAL 622 -8.135 -4.795 -10.233 858 1HG1 VAL 622 3HG1 VAL 622 -10.308 -2.827 -10.946 859 2HG1 VAL 622 1HG1 VAL 622 -10.682 -4.540 -10.642 860 3HG1 VAL 622 2HG1 VAL 622 -9.921 -3.556 -9.369 861 1HG2 VAL 622 1HG2 VAL 622 -7.935 -4.533 -12.976 862 2HG2 VAL 622 2HG2 VAL 622 -8.560 -5.955 -12.108 863 3HG2 VAL 622 3HG2 VAL 622 -9.687 -4.722 -12.723 864 H THR 623 H THR 623 -6.896 -3.281 -8.674 865 HA THR 623 HA THR 623 -8.396 -1.296 -7.389 866 HB THR 623 HB THR 623 -6.893 -1.862 -5.484 867 HG1 THR 623 1HG THR 623 -4.836 -2.270 -6.194 868 1HG2 THR 623 1HG2 THR 623 -8.387 -3.782 -6.963 869 2HG2 THR 623 2HG2 THR 623 -6.812 -4.549 -6.646 870 3HG2 THR 623 3HG2 THR 623 -7.801 -3.952 -5.291 871 H SER 624 H SER 624 -5.133 -1.241 -8.873 872 HA SER 624 HA SER 624 -4.216 1.072 -7.818 873 1HB SER 624 1HB SER 624 -3.865 -0.305 -10.472 874 2HB SER 624 2HB SER 624 -3.212 1.312 -10.303 875 HG SER 624 HG SER 624 -2.644 -0.465 -8.172 876 H ILE 625 H ILE 625 -6.352 0.628 -10.718 877 HA ILE 625 HA ILE 625 -6.557 3.410 -11.215 878 HB ILE 625 HB ILE 625 -7.738 0.902 -12.260 879 1HG1 ILE 625 1HG1 ILE 625 -7.218 2.725 -14.311 880 2HG1 ILE 625 2HG1 ILE 625 -5.966 3.049 -13.128 881 1HG2 ILE 625 3HG2 ILE 625 -9.098 3.590 -12.488 882 2HG2 ILE 625 1HG2 ILE 625 -9.329 2.283 -13.674 883 3HG2 ILE 625 2HG2 ILE 625 -9.791 2.033 -11.973 884 1HD1 ILE 625 2HD1 ILE 625 -6.647 0.216 -14.014 885 2HD1 ILE 625 3HD1 ILE 625 -5.446 1.221 -14.860 886 3HD1 ILE 625 1HD1 ILE 625 -5.191 0.775 -13.156 887 H HIS 626 H HIS 626 -8.214 1.082 -9.124 888 HA HIS 626 HA HIS 626 -10.577 2.482 -8.748 889 1HB HIS 626 1HB HIS 626 -9.906 0.102 -8.041 890 2HB HIS 626 2HB HIS 626 -9.192 0.844 -6.622 891 HD1 HIS 626 1HD HIS 626 -11.057 -0.639 -5.326 892 HD2 HIS 626 2HD HIS 626 -12.488 2.573 -7.613 893 HE1 HIS 626 1HE HIS 626 -13.443 -0.204 -4.533 894 H SER 627 H SER 627 -7.422 2.630 -6.972 895 HA SER 627 HA SER 627 -8.411 4.726 -5.323 896 1HB SER 627 1HB SER 627 -5.902 3.127 -5.569 897 2HB SER 627 2HB SER 627 -5.698 4.744 -4.924 898 HG SER 627 HG SER 627 -6.410 3.984 -3.064 899 H LEU 628 H LEU 628 -6.079 4.364 -8.070 900 HA LEU 628 HA LEU 628 -5.033 6.847 -8.212 901 1HB LEU 628 1HB LEU 628 -5.687 4.713 -10.141 902 2HB LEU 628 2HB LEU 628 -5.454 6.302 -10.843 903 HG LEU 628 HG LEU 628 -3.416 5.178 -8.933 904 1HD1 LEU 628 1HD1 LEU 628 -4.020 4.224 -11.668 905 2HD1 LEU 628 2HD1 LEU 628 -2.309 4.579 -11.327 906 3HD1 LEU 628 3HD1 LEU 628 -3.195 3.413 -10.315 907 1HD2 LEU 628 3HD2 LEU 628 -3.521 7.620 -9.847 908 2HD2 LEU 628 1HD2 LEU 628 -1.968 6.752 -9.798 909 3HD2 LEU 628 2HD2 LEU 628 -2.859 6.893 -11.332 910 H LEU 629 H LEU 629 -8.193 5.809 -9.672 911 HA LEU 629 HA LEU 629 -8.913 8.240 -10.714 912 1HB LEU 629 1HB LEU 629 -10.138 5.712 -10.115 913 2HB LEU 629 2HB LEU 629 -11.247 7.007 -9.706 914 HG LEU 629 HG LEU 629 -11.492 6.089 -12.020 915 1HD1 LEU 629 3HD1 LEU 629 -11.138 8.954 -11.335 916 2HD1 LEU 629 1HD1 LEU 629 -11.240 8.553 -13.066 917 3HD1 LEU 629 2HD1 LEU 629 -12.556 8.082 -11.964 918 1HD2 LEU 629 1HD2 LEU 629 -8.676 6.516 -12.096 919 2HD2 LEU 629 2HD2 LEU 629 -9.734 5.804 -13.338 920 3HD2 LEU 629 3HD2 LEU 629 -9.429 7.558 -13.328 921 H ASP 630 H ASP 630 -9.295 6.986 -7.354 922 HA ASP 630 HA ASP 630 -10.762 9.181 -6.472 923 1HB ASP 630 1HB ASP 630 -9.233 6.918 -5.244 924 2HB ASP 630 2HB ASP 630 -9.488 8.305 -4.204 925 HD2 ASP 630 HD ASP 630 -11.431 6.346 -6.374 926 H GLU 631 H GLU 631 -7.316 8.510 -6.998 927 HA GLU 631 HA GLU 631 -6.376 10.569 -5.309 928 1HB GLU 631 1HB GLU 631 -5.261 8.485 -7.012 929 2HB GLU 631 2HB GLU 631 -4.412 9.993 -7.286 930 1HG GLU 631 1HG GLU 631 -4.910 8.749 -4.539 931 2HG GLU 631 2HG GLU 631 -3.404 8.635 -5.429 932 HE2 GLU 631 HE GLU 631 -4.823 10.795 -3.091 933 H GLY 632 H GLY 632 -6.941 10.208 -8.865 934 1HA GLY 632 2HA GLY 632 -6.951 11.727 -10.533 935 2HA GLY 632 1HA GLY 632 -6.004 12.810 -9.532 936 H LYS 633 H LYS 633 -9.188 11.389 -8.635 937 HA LYS 633 HA LYS 633 -10.790 13.487 -9.470 938 1HB LYS 633 1HB LYS 633 -11.403 11.130 -8.629 939 2HB LYS 633 2HB LYS 633 -11.327 11.811 -7.016 940 1HG LYS 633 1HG LYS 633 -13.627 11.983 -7.747 941 2HG LYS 633 2HG LYS 633 -12.965 13.605 -7.754 942 1HD LYS 633 1HD LYS 633 -12.350 12.720 -10.323 943 2HD LYS 633 2HD LYS 633 -13.889 11.937 -10.027 944 1HE LYS 633 1HE LYS 633 -14.868 14.162 -9.361 945 2HE LYS 633 2HE LYS 633 -13.334 14.928 -9.724 946 H GLN 634 H GLN 634 -8.680 13.110 -6.628 947 HA GLN 634 HA GLN 634 -9.799 15.244 -5.201 948 1HB GLN 634 1HB GLN 634 -7.086 13.867 -5.067 949 2HB GLN 634 2HB GLN 634 -7.557 15.133 -3.950 950 1HG GLN 634 1HG GLN 634 -9.428 12.793 -4.365 951 2HG GLN 634 2HG GLN 634 -8.002 12.564 -3.372 952 1HE2 GLN 634 1HE2 GLN 634 -8.626 12.576 -1.348 953 2HE2 GLN 634 2HE2 GLN 634 -9.625 13.757 -0.570 954 H SER 635 H SER 635 -7.591 15.012 -7.922 955 HA SER 635 HA SER 635 -6.554 17.649 -7.472 956 1HB SER 635 1HB SER 635 -5.761 15.328 -8.962 957 2HB SER 635 2HB SER 635 -5.970 16.630 -10.117 958 HG SER 635 HG SER 635 -4.498 17.049 -7.676 959 H LEU 636 H LEU 636 -9.004 15.948 -9.429 960 HA LEU 636 HA LEU 636 -9.475 17.687 -11.449 961 1HB LEU 636 1HB LEU 636 -10.936 15.646 -10.004 962 2HB LEU 636 2HB LEU 636 -12.008 16.924 -10.540 963 HG LEU 636 HG LEU 636 -11.720 14.943 -12.094 964 1HD1 LEU 636 1HD1 LEU 636 -11.293 17.788 -13.005 965 2HD1 LEU 636 2HD1 LEU 636 -11.512 16.445 -14.152 966 3HD1 LEU 636 3HD1 LEU 636 -12.794 16.832 -12.980 967 1HD2 LEU 636 3HD2 LEU 636 -9.064 15.235 -11.690 968 2HD2 LEU 636 1HD2 LEU 636 -9.774 14.429 -13.109 969 3HD2 LEU 636 2HD2 LEU 636 -9.251 16.127 -13.219 970 H THR 637 H THR 637 -10.775 17.906 -8.070 971 HA THR 637 HA THR 637 -12.100 20.362 -8.547 972 HB THR 637 HB THR 637 -12.945 19.136 -6.723 973 HG1 THR 637 1HG THR 637 -12.086 20.377 -4.830 974 1HG2 THR 637 2HG2 THR 637 -10.026 18.498 -6.196 975 2HG2 THR 637 3HG2 THR 637 -11.183 18.445 -4.844 976 3HG2 THR 637 1HG2 THR 637 -11.417 17.390 -6.259 977 H LYS 638 H LYS 638 -8.760 19.498 -7.888 978 HA LYS 638 HA LYS 638 -8.092 22.129 -6.950 979 1HB LYS 638 1HB LYS 638 -6.272 19.854 -7.788 980 2HB LYS 638 2HB LYS 638 -5.820 21.275 -6.867 981 1HG LYS 638 1HG LYS 638 -8.118 19.919 -5.643 982 2HG LYS 638 2HG LYS 638 -6.771 18.815 -5.837 983 1HD LYS 638 1HD LYS 638 -5.923 21.468 -4.843 984 2HD LYS 638 2HD LYS 638 -7.076 20.690 -3.777 985 1HE LYS 638 1HE LYS 638 -5.550 18.551 -4.092 986 2HE LYS 638 2HE LYS 638 -4.344 19.695 -4.647 987 H LEU 639 H LEU 639 -8.162 20.314 -10.012 988 HA LEU 639 HA LEU 639 -6.734 22.445 -11.363 989 1HB LEU 639 1HB LEU 639 -7.800 19.758 -12.207 990 2HB LEU 639 2HB LEU 639 -7.185 20.924 -13.362 991 HG LEU 639 HG LEU 639 -5.333 19.615 -13.026 992 1HD1 LEU 639 3HD1 LEU 639 -4.943 22.066 -12.404 993 2HD1 LEU 639 1HD1 LEU 639 -4.858 21.500 -10.719 994 3HD1 LEU 639 2HD1 LEU 639 -3.700 20.885 -11.923 995 1HD2 LEU 639 1HD2 LEU 639 -6.550 18.340 -11.142 996 2HD2 LEU 639 2HD2 LEU 639 -4.770 18.368 -11.141 997 3HD2 LEU 639 3HD2 LEU 639 -5.677 19.432 -10.040 998 H ALA 640 H ALA 640 -9.953 21.597 -10.441 999 HA ALA 640 HA ALA 640 -11.516 22.376 -12.516 1000 1HB ALA 640 2HB ALA 640 -12.031 21.586 -10.060 1001 2HB ALA 640 3HB ALA 640 -12.114 23.330 -9.717 1002 3HB ALA 640 1HB ALA 640 -13.207 22.607 -10.922 1003 H ALA 641 H ALA 641 -9.698 24.449 -10.196 1004 HA ALA 641 HA ALA 641 -10.769 26.887 -10.957 1005 1HB ALA 641 2HB ALA 641 -9.194 27.713 -9.535 1006 2HB ALA 641 3HB ALA 641 -8.937 25.997 -9.135 1007 3HB ALA 641 1HB ALA 641 -7.871 26.807 -10.309 1008 H ALA 642 H ALA 642 -8.466 24.723 -12.561 1009 HA ALA 642 HA ALA 642 -7.279 26.593 -14.264 1010 1HB ALA 642 1HB ALA 642 -6.838 24.017 -13.696 1011 2HB ALA 642 3HB ALA 642 -6.305 24.740 -15.233 1012 3HB ALA 642 2HB ALA 642 -7.805 23.783 -15.172 1013 H TRP 643 H TRP 643 -10.253 24.557 -14.568 1014 HA TRP 643 HA TRP 643 -10.843 25.362 -17.191 1015 1HB TRP 643 1HB TRP 643 -12.445 24.148 -14.954 1016 2HB TRP 643 2HB TRP 643 -13.202 24.611 -16.465 1017 HD1 TRP 643 HD TRP 643 -12.759 23.013 -18.577 1018 HE1 TRP 643 1HE TRP 643 -11.639 20.656 -18.971 1019 HE3 TRP 643 3HE TRP 643 -10.464 22.760 -14.047 1020 HZ2 TRP 643 2HZ TRP 643 -9.956 18.988 -17.380 1021 HZ3 TRP 643 3HZ TRP 643 -9.102 20.734 -13.546 1022 HH2 TRP 643 HH TRP 643 -8.829 18.889 -15.126 1023 H GLY 644 H GLY 644 -11.575 26.656 -13.918 1024 1HA GLY 644 2HA GLY 644 -13.116 28.853 -15.111 1025 2HA GLY 644 1HA GLY 644 -11.646 29.233 -14.236 1026 H GLY 645 H GLY 645 -11.814 27.133 -12.216 1027 1HA GLY 645 2HA GLY 645 -14.130 28.147 -10.680 1028 2HA GLY 645 1HA GLY 645 -12.570 27.734 -9.996 1029 H SER 646 H SER 646 -14.229 26.404 -8.613 1030 HA SER 646 HA SER 646 -14.409 23.789 -9.887 1031 1HB SER 646 1HB SER 646 -14.565 23.060 -7.357 1032 2HB SER 646 2HB SER 646 -13.006 23.456 -8.053 1033 HG SER 646 HG SER 646 -12.902 24.777 -6.351 1034 H GLY 647 H GLY 647 -16.495 24.794 -10.830 1035 1HA GLY 647 2HA GLY 647 -18.668 25.418 -9.126 1036 2HA GLY 647 1HA GLY 647 -18.738 23.728 -9.583 1037 H SER 648 H SER 648 -17.297 26.289 -11.639 1038 HA SER 648 HA SER 648 -19.471 27.014 -13.080 1039 1HB SER 648 1HB SER 648 -16.559 27.054 -13.418 1040 2HB SER 648 2HB SER 648 -17.367 26.867 -14.961 1041 HG SER 648 HG SER 648 -18.312 28.847 -13.110 1042 H GLU 649 H GLU 649 -20.499 26.252 -15.019 1043 HA GLU 649 HA GLU 649 -20.915 23.592 -15.198 1044 1HB GLU 649 1HB GLU 649 -21.877 24.063 -17.450 1045 2HB GLU 649 2HB GLU 649 -22.379 25.241 -16.254 1046 1HG GLU 649 1HG GLU 649 -20.038 26.384 -17.234 1047 2HG GLU 649 2HG GLU 649 -20.683 25.603 -18.664 1048 HE2 GLU 649 HE GLU 649 -21.838 28.935 -17.321 1049 H ALA 650 H ALA 650 -18.343 25.554 -16.717 1050 HA ALA 650 HA ALA 650 -17.463 23.825 -18.654 1051 1HB ALA 650 1HB ALA 650 -16.462 26.109 -17.132 1052 2HB ALA 650 3HB ALA 650 -16.160 25.654 -18.826 1053 3HB ALA 650 2HB ALA 650 -15.160 24.962 -17.526 1054 H TYR 651 H TYR 651 -15.781 24.152 -15.455 1055 HA TYR 651 HA TYR 651 -14.404 21.793 -15.601 1056 1HB TYR 651 1HB TYR 651 -13.868 23.321 -13.837 1057 2HB TYR 651 2HB TYR 651 -15.554 23.633 -13.475 1058 HD1 TYR 651 1HD TYR 651 -13.100 20.792 -13.332 1059 HD2 TYR 651 2HD TYR 651 -16.416 22.777 -11.498 1060 HE1 TYR 651 1HE TYR 651 -12.981 19.187 -11.364 1061 HE2 TYR 651 2HE TYR 651 -16.287 21.165 -9.536 1062 HH TYR 651 HH TYR 651 -15.040 19.645 -8.538 1063 H GLN 652 H GLN 652 -17.803 22.364 -14.652 1064 HA GLN 652 HA GLN 652 -18.236 19.974 -13.362 1065 1HB GLN 652 1HB GLN 652 -20.063 21.807 -14.957 1066 2HB GLN 652 2HB GLN 652 -20.677 20.375 -14.155 1067 1HG GLN 652 1HG GLN 652 -19.004 21.775 -12.269 1068 2HG GLN 652 2HG GLN 652 -20.071 22.955 -13.003 1069 1HE2 GLN 652 1HE2 GLN 652 -21.435 23.302 -11.360 1070 2HE2 GLN 652 2HE2 GLN 652 -22.499 22.123 -10.668 1071 H GLY 653 H GLY 653 -18.780 20.847 -16.850 1072 1HA GLY 653 2HA GLY 653 -18.852 19.578 -18.702 1073 2HA GLY 653 1HA GLY 653 -19.683 18.378 -17.732 1074 H VAL 654 H VAL 654 -16.458 19.407 -16.719 1075 HA VAL 654 HA VAL 654 -15.128 17.310 -18.169 1076 HB VAL 654 HB VAL 654 -14.307 19.401 -16.162 1077 1HG1 VAL 654 2HG1 VAL 654 -13.041 17.254 -15.785 1078 2HG1 VAL 654 3HG1 VAL 654 -12.429 17.397 -17.450 1079 3HG1 VAL 654 1HG1 VAL 654 -12.035 18.648 -16.247 1080 1HG2 VAL 654 2HG2 VAL 654 -14.640 19.461 -18.923 1081 2HG2 VAL 654 3HG2 VAL 654 -13.719 20.627 -17.942 1082 3HG2 VAL 654 1HG2 VAL 654 -12.885 19.255 -18.711 1083 H GLN 655 H GLN 655 -16.122 18.024 -14.767 1084 HA GLN 655 HA GLN 655 -14.953 15.908 -13.550 1085 1HB GLN 655 1HB GLN 655 -17.227 17.701 -13.022 1086 2HB GLN 655 2HB GLN 655 -17.446 16.129 -12.280 1087 1HG GLN 655 1HG GLN 655 -14.691 17.049 -11.919 1088 2HG GLN 655 2HG GLN 655 -15.818 18.259 -11.338 1089 1HE2 GLN 655 1HE2 GLN 655 -14.265 17.160 -9.521 1090 2HE2 GLN 655 2HE2 GLN 655 -15.100 16.035 -8.503 1091 H GLN 656 H GLN 656 -18.083 16.015 -15.346 1092 HA GLN 656 HA GLN 656 -18.796 13.393 -14.713 1093 1HB GLN 656 1HB GLN 656 -19.672 15.462 -16.708 1094 2HB GLN 656 2HB GLN 656 -20.162 13.807 -17.008 1095 1HG GLN 656 1HG GLN 656 -21.703 13.859 -15.334 1096 2HG GLN 656 2HG GLN 656 -20.544 14.498 -14.186 1097 1HE2 GLN 656 1HE2 GLN 656 -19.784 16.849 -15.373 1098 2HE2 GLN 656 2HE2 GLN 656 -21.108 17.964 -15.431 1099 H LYS 657 H LYS 657 -16.809 14.871 -17.294 1100 HA LYS 657 HA LYS 657 -16.702 12.564 -18.919 1101 1HB LYS 657 1HB LYS 657 -14.963 15.037 -18.728 1102 2HB LYS 657 2HB LYS 657 -14.720 13.779 -19.924 1103 1HG LYS 657 1HG LYS 657 -16.881 14.159 -20.924 1104 2HG LYS 657 2HG LYS 657 -17.433 15.111 -19.560 1105 1HD LYS 657 1HD LYS 657 -15.999 16.960 -20.125 1106 2HD LYS 657 2HD LYS 657 -15.043 15.989 -21.226 1107 1HE LYS 657 1HE LYS 657 -17.106 15.713 -22.686 1108 2HE LYS 657 2HE LYS 657 -17.959 16.812 -21.621 1109 H TRP 658 H TRP 658 -14.978 13.673 -16.021 1110 HA TRP 658 HA TRP 658 -12.829 11.822 -16.317 1111 1HB TRP 658 1HB TRP 658 -12.434 13.826 -15.106 1112 2HB TRP 658 2HB TRP 658 -13.806 13.554 -14.050 1113 HD1 TRP 658 HD TRP 658 -13.413 11.903 -11.953 1114 HE1 TRP 658 1HE TRP 658 -11.318 10.793 -10.795 1115 HE3 TRP 658 3HE TRP 658 -10.161 12.838 -15.749 1116 HZ2 TRP 658 2HZ TRP 658 -8.597 10.439 -11.578 1117 HZ3 TRP 658 3HZ TRP 658 -7.803 12.077 -15.472 1118 HH2 TRP 658 HH TRP 658 -7.005 10.915 -13.475 1119 H ASP 659 H ASP 659 -15.774 12.061 -14.190 1120 HA ASP 659 HA ASP 659 -15.410 9.562 -13.056 1121 1HB ASP 659 1HB ASP 659 -17.044 11.633 -12.537 1122 2HB ASP 659 2HB ASP 659 -18.177 10.695 -13.490 1123 HD2 ASP 659 HD ASP 659 -16.911 11.146 -10.534 1124 H ALA 660 H ALA 660 -16.899 10.729 -16.078 1125 HA ALA 660 HA ALA 660 -18.567 8.626 -16.699 1126 1HB ALA 660 2HB ALA 660 -18.739 10.467 -18.106 1127 2HB ALA 660 3HB ALA 660 -16.975 10.654 -18.252 1128 3HB ALA 660 1HB ALA 660 -17.807 9.349 -19.131 1129 H THR 661 H THR 661 -15.579 8.972 -18.643 1130 HA THR 661 HA THR 661 -15.319 6.298 -19.198 1131 HB THR 661 HB THR 661 -13.053 6.950 -19.936 1132 HG1 THR 661 1HG THR 661 -13.726 9.218 -18.196 1133 1HG2 THR 661 3HG2 THR 661 -15.370 8.341 -20.721 1134 2HG2 THR 661 1HG2 THR 661 -14.227 9.637 -20.295 1135 3HG2 THR 661 2HG2 THR 661 -13.785 8.431 -21.527 1136 H ALA 662 H ALA 662 -14.518 8.008 -16.227 1137 HA ALA 662 HA ALA 662 -12.605 6.318 -15.187 1138 1HB ALA 662 3HB ALA 662 -12.955 8.222 -13.925 1139 2HB ALA 662 2HB ALA 662 -13.890 7.051 -12.965 1140 3HB ALA 662 1HB ALA 662 -14.725 8.143 -14.096 1141 H THR 663 H THR 663 -15.930 6.229 -13.816 1142 HA THR 663 HA THR 663 -15.824 3.666 -12.903 1143 HB THR 663 HB THR 663 -17.640 5.025 -12.195 1144 HG1 THR 663 1HG THR 663 -19.497 3.810 -13.174 1145 1HG2 THR 663 3HG2 THR 663 -17.613 5.937 -14.977 1146 2HG2 THR 663 1HG2 THR 663 -19.256 5.445 -14.503 1147 3HG2 THR 663 2HG2 THR 663 -18.396 6.691 -13.567 1148 H GLU 664 H GLU 664 -16.135 4.736 -16.239 1149 HA GLU 664 HA GLU 664 -17.280 2.386 -17.212 1150 1HB GLU 664 1HB GLU 664 -17.290 4.468 -18.503 1151 2HB GLU 664 2HB GLU 664 -15.539 4.493 -18.562 1152 1HG GLU 664 1HG GLU 664 -16.278 3.617 -20.683 1153 2HG GLU 664 2HG GLU 664 -15.619 2.261 -19.790 1154 HE2 GLU 664 HE GLU 664 -16.930 0.666 -20.538 1155 H LEU 665 H LEU 665 -13.844 3.526 -16.979 1156 HA LEU 665 HA LEU 665 -12.865 1.027 -17.984 1157 1HB LEU 665 1HB LEU 665 -11.852 3.332 -18.313 1158 2HB LEU 665 2HB LEU 665 -11.308 3.237 -16.650 1159 HG LEU 665 HG LEU 665 -9.533 2.642 -18.217 1160 1HD1 LEU 665 2HD1 LEU 665 -10.054 1.422 -15.894 1161 2HD1 LEU 665 3HD1 LEU 665 -10.117 0.006 -16.971 1162 3HD1 LEU 665 1HD1 LEU 665 -8.651 1.013 -16.910 1163 1HD2 LEU 665 2HD2 LEU 665 -10.981 1.757 -20.018 1164 2HD2 LEU 665 3HD2 LEU 665 -9.623 0.678 -19.621 1165 3HD2 LEU 665 1HD2 LEU 665 -11.262 0.295 -19.043 1166 H ASN 666 H ASN 666 -13.802 2.387 -14.893 1167 HA ASN 666 HA ASN 666 -12.152 0.741 -13.330 1168 1HB ASN 666 1HB ASN 666 -13.675 2.924 -12.793 1169 2HB ASN 666 2HB ASN 666 -14.830 1.698 -12.307 1170 1HD2 ASN 666 1HD2 ASN 666 -12.975 3.740 -10.948 1171 2HD2 ASN 666 2HD2 ASN 666 -12.238 2.865 -9.648 1172 H ASN 667 H ASN 667 -15.659 0.688 -14.314 1173 HA ASN 667 HA ASN 667 -16.271 -1.671 -13.007 1174 1HB ASN 667 1HB ASN 667 -18.350 -1.539 -14.149 1175 2HB ASN 667 2HB ASN 667 -17.819 0.131 -14.143 1176 1HD2 ASN 667 1HD2 ASN 667 -18.034 1.142 -15.974 1177 2HD2 ASN 667 2HD2 ASN 667 -17.943 0.473 -17.569 1178 H ALA 668 H ALA 668 -14.991 -0.888 -16.280 1179 HA ALA 668 HA ALA 668 -15.306 -3.443 -17.399 1180 1HB ALA 668 3HB ALA 668 -14.800 -1.108 -18.465 1181 2HB ALA 668 2HB ALA 668 -14.080 -2.563 -19.195 1182 3HB ALA 668 1HB ALA 668 -13.098 -1.517 -18.142 1183 H LEU 669 H LEU 669 -12.747 -1.893 -15.413 1184 HA LEU 669 HA LEU 669 -10.861 -3.956 -15.771 1185 1HB LEU 669 1HB LEU 669 -11.166 -1.511 -14.203 1186 2HB LEU 669 2HB LEU 669 -10.308 -2.770 -13.336 1187 HG LEU 669 HG LEU 669 -9.515 -2.007 -16.143 1188 1HD1 LEU 669 1HD1 LEU 669 -9.627 0.023 -14.618 1189 2HD1 LEU 669 2HD1 LEU 669 -8.319 -0.736 -13.678 1190 3HD1 LEU 669 3HD1 LEU 669 -8.058 -0.315 -15.387 1191 1HD2 LEU 669 2HD2 LEU 669 -8.705 -4.098 -14.729 1192 2HD2 LEU 669 3HD2 LEU 669 -7.594 -3.184 -15.777 1193 3HD2 LEU 669 1HD2 LEU 669 -7.608 -2.888 -14.022 1194 H GLN 670 H GLN 670 -13.522 -3.361 -13.431 1195 HA GLN 670 HA GLN 670 -12.813 -5.441 -11.722 1196 1HB GLN 670 1HB GLN 670 -15.134 -3.642 -12.136 1197 2HB GLN 670 2HB GLN 670 -15.559 -5.190 -11.433 1198 1HG GLN 670 1HG GLN 670 -13.367 -3.346 -10.369 1199 2HG GLN 670 2HG GLN 670 -14.987 -3.450 -9.708 1200 1HE2 GLN 670 1HE2 GLN 670 -15.467 -4.955 -8.261 1201 2HE2 GLN 670 2HE2 GLN 670 -14.441 -6.256 -7.757 1202 H ASN 671 H ASN 671 -15.252 -5.242 -14.409 1203 HA ASN 671 HA ASN 671 -16.138 -7.827 -14.186 1204 1HB ASN 671 1HB ASN 671 -16.992 -5.831 -15.665 1205 2HB ASN 671 2HB ASN 671 -15.828 -6.381 -16.855 1206 1HD2 ASN 671 1HD2 ASN 671 -16.102 -8.308 -17.919 1207 2HD2 ASN 671 2HD2 ASN 671 -17.579 -9.214 -17.907 1208 H LEU 672 H LEU 672 -13.191 -6.417 -15.567 1209 HA LEU 672 HA LEU 672 -12.533 -8.663 -17.196 1210 1HB LEU 672 1HB LEU 672 -11.740 -6.543 -17.861 1211 2HB LEU 672 2HB LEU 672 -11.066 -6.200 -16.281 1212 HG LEU 672 HG LEU 672 -9.728 -8.513 -17.076 1213 1HD1 LEU 672 1HD1 LEU 672 -10.469 -6.865 -19.444 1214 2HD1 LEU 672 2HD1 LEU 672 -8.798 -7.469 -19.346 1215 3HD1 LEU 672 3HD1 LEU 672 -10.161 -8.613 -19.305 1216 1HD2 LEU 672 2HD2 LEU 672 -9.045 -6.191 -15.987 1217 2HD2 LEU 672 3HD2 LEU 672 -7.851 -7.256 -16.768 1218 3HD2 LEU 672 1HD2 LEU 672 -8.503 -5.853 -17.648 1219 H ALA 673 H ALA 673 -11.321 -7.354 -14.031 1220 HA ALA 673 HA ALA 673 -9.633 -9.561 -13.567 1221 1HB ALA 673 3HB ALA 673 -10.203 -7.042 -12.416 1222 2HB ALA 673 1HB ALA 673 -10.542 -8.242 -11.146 1223 3HB ALA 673 2HB ALA 673 -8.940 -8.195 -11.922 1224 H ARG 674 H ARG 674 -13.083 -9.048 -13.302 1225 HA ARG 674 HA ARG 674 -13.556 -10.882 -11.259 1226 1HB ARG 674 1HB ARG 674 -15.198 -9.553 -13.415 1227 2HB ARG 674 2HB ARG 674 -15.906 -10.936 -12.604 1228 1HG ARG 674 1HG ARG 674 -14.756 -9.312 -10.549 1229 2HG ARG 674 2HG ARG 674 -15.594 -8.213 -11.626 1230 1HD ARG 674 1HD ARG 674 -16.922 -10.765 -10.624 1231 2HD ARG 674 2HD ARG 674 -16.968 -9.285 -9.687 1232 HE ARG 674 HE ARG 674 -17.813 -8.411 -12.146 1233 2HH1 ARG 674 1HH ARG 674 -21.098 -9.517 -12.371 1234 1HH2 ARG 674 2HH2 ARG 674 -18.830 -11.142 -10.129 1235 2HH2 ARG 674 1HH2 ARG 674 -20.457 -11.136 -10.724 1236 H THR 675 H THR 675 -13.096 -11.131 -14.789 1237 HA THR 675 HA THR 675 -13.668 -14.014 -14.634 1238 HB THR 675 HB THR 675 -13.544 -12.102 -17.027 1239 HG1 THR 675 1HG THR 675 -15.701 -13.463 -15.571 1240 1HG2 THR 675 3HG2 THR 675 -13.268 -14.823 -17.157 1241 2HG2 THR 675 1HG2 THR 675 -15.041 -14.705 -17.052 1242 3HG2 THR 675 2HG2 THR 675 -14.171 -13.890 -18.374 1243 H ILE 676 H ILE 676 -11.143 -11.716 -14.639 1244 HA ILE 676 HA ILE 676 -9.315 -13.553 -15.971 1245 HB ILE 676 HB ILE 676 -9.198 -10.672 -15.146 1246 1HG1 ILE 676 1HG1 ILE 676 -8.974 -12.199 -17.741 1247 2HG1 ILE 676 2HG1 ILE 676 -10.150 -10.981 -17.289 1248 1HG2 ILE 676 1HG2 ILE 676 -6.972 -12.551 -15.183 1249 2HG2 ILE 676 2HG2 ILE 676 -6.748 -11.212 -16.335 1250 3HG2 ILE 676 3HG2 ILE 676 -7.045 -10.865 -14.614 1251 1HD1 ILE 676 3HD1 ILE 676 -7.968 -9.453 -16.995 1252 2HD1 ILE 676 1HD1 ILE 676 -7.282 -10.635 -18.135 1253 3HD1 ILE 676 2HD1 ILE 676 -8.719 -9.690 -18.591 1254 H SER 677 H SER 677 -9.590 -11.696 -12.858 1255 HA SER 677 HA SER 677 -7.505 -12.746 -11.559 1256 1HB SER 677 1HB SER 677 -8.597 -12.136 -9.520 1257 2HB SER 677 2HB SER 677 -9.200 -11.026 -10.735 1258 HG SER 677 HG SER 677 -10.789 -12.174 -9.205 1259 H GLU 678 H GLU 678 -10.634 -14.307 -12.293 1260 HA GLU 678 HA GLU 678 -10.419 -16.417 -10.521 1261 1HB GLU 678 1HB GLU 678 -11.906 -17.571 -12.383 1262 2HB GLU 678 2HB GLU 678 -12.539 -16.224 -11.459 1263 1HG GLU 678 1HG GLU 678 -12.558 -14.814 -13.271 1264 2HG GLU 678 2HG GLU 678 -11.012 -15.388 -13.863 1265 HE2 GLU 678 HE GLU 678 -14.416 -16.171 -15.195 1266 H ALA 679 H ALA 679 -8.726 -15.694 -13.508 1267 HA ALA 679 HA ALA 679 -8.103 -18.123 -14.535 1268 1HB ALA 679 2HB ALA 679 -6.096 -15.879 -14.118 1269 2HB ALA 679 3HB ALA 679 -6.163 -17.053 -15.454 1270 3HB ALA 679 1HB ALA 679 -7.415 -15.797 -15.310 1271 H GLY 680 H GLY 680 -7.202 -16.778 -11.405 1272 1HA GLY 680 2HA GLY 680 -6.324 -17.869 -9.617 1273 2HA GLY 680 1HA GLY 680 -4.914 -17.937 -10.655 1274 H GLN 681 H GLN 681 -7.859 -19.706 -9.609 1275 HA GLN 681 HA GLN 681 -6.530 -22.138 -10.526 1276 1HB GLN 681 1HB GLN 681 -7.448 -21.369 -7.891 1277 2HB GLN 681 2HB GLN 681 -8.385 -22.749 -8.427 1278 1HG GLN 681 1HG GLN 681 -6.454 -23.677 -7.356 1279 2HG GLN 681 2HG GLN 681 -6.167 -23.873 -9.074 1280 1HE2 GLN 681 1HE2 GLN 681 -4.001 -23.847 -9.087 1281 2HE2 GLN 681 2HE2 GLN 681 -3.009 -22.502 -8.634 1282 H ALA 682 H ALA 682 -9.517 -20.233 -10.258 1283 HA ALA 682 HA ALA 682 -11.485 -21.970 -10.815 1284 1HB ALA 682 3HB ALA 682 -11.377 -19.486 -12.486 1285 2HB ALA 682 2HB ALA 682 -11.285 -19.295 -10.719 1286 3HB ALA 682 1HB ALA 682 -12.685 -20.112 -11.454 1287 H MET 683 H MET 683 -9.603 -20.271 -13.429 1288 HA MET 683 HA MET 683 -10.539 -21.494 -15.564 1289 1HB MET 683 1HB MET 683 -8.691 -19.823 -15.574 1290 2HB MET 683 2HB MET 683 -7.591 -20.993 -14.871 1291 1HG MET 683 1HG MET 683 -8.980 -21.650 -17.485 1292 2HG MET 683 2HG MET 683 -7.592 -20.581 -17.496 1293 1HE MET 683 2HE MET 683 -7.235 -22.804 -19.187 1294 2HE MET 683 3HE MET 683 -6.564 -24.336 -18.579 1295 3HE MET 683 1HE MET 683 -8.301 -23.993 -18.402 1296 H ALA 684 H ALA 684 -8.587 -23.023 -13.034 1297 HA ALA 684 HA ALA 684 -8.172 -25.395 -14.659 1298 1HB ALA 684 2HB ALA 684 -6.726 -26.100 -12.890 1299 2HB ALA 684 3HB ALA 684 -6.426 -24.359 -13.108 1300 3HB ALA 684 1HB ALA 684 -7.429 -24.925 -11.751 1301 H SER 685 H SER 685 -9.901 -24.314 -11.669 1302 HA SER 685 HA SER 685 -10.957 -26.752 -11.009 1303 1HB SER 685 1HB SER 685 -11.923 -23.905 -10.595 1304 2HB SER 685 2HB SER 685 -12.852 -25.261 -9.987 1305 HG SER 685 HG SER 685 -10.067 -25.234 -9.394 1306 H THR 686 H THR 686 -13.320 -24.252 -11.980 1307 HA THR 686 HA THR 686 -14.097 -25.665 -14.366 1308 HB THR 686 HB THR 686 -15.076 -26.854 -12.196 1309 HG1 THR 686 1HG THR 686 -16.042 -27.523 -14.089 1310 1HG2 THR 686 1HG2 THR 686 -16.989 -24.500 -12.637 1311 2HG2 THR 686 2HG2 THR 686 -17.323 -25.927 -11.626 1312 3HG2 THR 686 3HG2 THR 686 -16.040 -24.786 -11.159 1313 H GLU 687 H GLU 687 -16.426 -24.611 -15.029 1314 HA GLU 687 HA GLU 687 -16.049 -21.756 -14.562 1315 1HB GLU 687 1HB GLU 687 -16.376 -23.293 -17.122 1316 2HB GLU 687 2HB GLU 687 -17.160 -21.729 -17.026 1317 1HG GLU 687 1HG GLU 687 -15.153 -20.562 -16.913 1318 2HG GLU 687 2HG GLU 687 -14.325 -21.844 -16.052 1319 HE2 GLU 687 HE GLU 687 -13.242 -21.056 -19.225 1320 H GLY 688 H GLY 688 -17.863 -20.637 -13.905 1321 1HA GLY 688 2HA GLY 688 -20.502 -21.779 -14.441 1322 2HA GLY 688 1HA GLY 688 -20.135 -20.169 -13.856 1323 H ASN 689 H ASN 689 -18.103 -21.429 -11.868 1324 HA ASN 689 HA ASN 689 -19.980 -22.748 -10.107 1325 1HB ASN 689 1HB ASN 689 -17.388 -23.359 -10.653 1326 2HB ASN 689 2HB ASN 689 -17.104 -22.245 -9.331 1327 1HD2 ASN 689 1HD2 ASN 689 -18.887 -25.135 -10.304 1328 2HD2 ASN 689 2HD2 ASN 689 -19.005 -25.873 -8.742 1329 H VAL 690 H VAL 690 -17.388 -20.175 -10.002 1330 HA VAL 690 HA VAL 690 -18.570 -19.044 -7.624 1331 HB VAL 690 HB VAL 690 -16.653 -17.586 -7.643 1332 1HG1 VAL 690 2HG1 VAL 690 -16.376 -20.516 -7.900 1333 2HG1 VAL 690 3HG1 VAL 690 -14.864 -19.600 -8.107 1334 3HG1 VAL 690 1HG1 VAL 690 -15.820 -19.415 -6.617 1335 1HG2 VAL 690 3HG2 VAL 690 -16.143 -18.711 -10.412 1336 2HG2 VAL 690 1HG2 VAL 690 -16.417 -17.014 -9.949 1337 3HG2 VAL 690 2HG2 VAL 690 -14.915 -17.838 -9.465 1338 H THR 691 H THR 691 -19.528 -16.966 -7.473 1339 HA THR 691 HA THR 691 -20.017 -15.579 -9.997 1340 HB THR 691 HB THR 691 -22.071 -16.893 -8.182 1341 HG1 THR 691 1HG THR 691 -22.845 -17.235 -10.497 1342 1HG2 THR 691 1HG2 THR 691 -22.590 -14.360 -8.511 1343 2HG2 THR 691 2HG2 THR 691 -22.717 -14.739 -10.246 1344 3HG2 THR 691 3HG2 THR 691 -23.824 -15.508 -9.083 1345 H GLY 692 H GLY 692 -20.942 -15.509 -6.485 1346 1HA GLY 692 2HA GLY 692 -21.305 -13.535 -5.293 1347 2HA GLY 692 1HA GLY 692 -20.442 -12.619 -6.513 1348 H MET 693 H MET 693 -19.546 -15.639 -4.699 1349 HA MET 693 HA MET 693 -17.906 -14.528 -2.864 1350 1HB MET 693 1HB MET 693 -18.566 -17.099 -3.773 1351 2HB MET 693 2HB MET 693 -16.844 -17.029 -4.094 1352 1HG MET 693 1HG MET 693 -16.856 -15.980 -1.572 1353 2HG MET 693 2HG MET 693 -18.290 -16.981 -1.463 1354 1HE MET 693 3HE MET 693 -15.768 -17.086 0.156 1355 2HE MET 693 1HE MET 693 -14.823 -18.587 0.004 1356 3HE MET 693 2HE MET 693 -14.404 -17.167 -0.985 1357 H PHE 694 H PHE 694 -16.692 -16.080 -5.929 1358 HA PHE 694 HA PHE 694 -14.229 -14.613 -5.657 1359 1HB PHE 694 1HB PHE 694 -14.831 -17.093 -6.528 1360 2HB PHE 694 2HB PHE 694 -15.155 -16.277 -8.045 1361 HD1 PHE 694 1HD PHE 694 -13.003 -18.394 -7.378 1362 HD2 PHE 694 2HD PHE 694 -12.906 -14.159 -7.626 1363 HE1 PHE 694 1HE PHE 694 -10.560 -18.483 -7.949 1364 HE2 PHE 694 2HE PHE 694 -10.463 -14.248 -8.197 1365 HZ PHE 694 HZ PHE 694 -9.320 -16.409 -8.351 1366 H ALA 695 H ALA 695 -14.877 -12.401 -5.955 1367 HA ALA 695 HA ALA 695 -16.190 -11.741 -8.454 1368 1HB ALA 695 3HB ALA 695 -15.516 -10.365 -5.876 1369 2HB ALA 695 2HB ALA 695 -17.044 -10.396 -6.787 1370 3HB ALA 695 1HB ALA 695 -15.704 -9.360 -7.333 No H/Q in entry = 1370 Start of MODEL 7 1 H ALA 1 H ALA 1 -4.955 38.291 -5.475 2 HA ALA 1 HA ALA 1 -6.963 37.521 -6.341 3 1HB ALA 1 1HB ALA 1 -8.280 40.071 -5.346 4 2HB ALA 1 3HB ALA 1 -8.190 38.586 -4.368 5 3HB ALA 1 2HB ALA 1 -9.064 38.579 -5.918 6 H GLU 2 H GLU 2 -5.403 37.948 -8.110 7 HA GLU 2 HA GLU 2 -6.165 40.374 -9.544 8 1HB GLU 2 1HB GLU 2 -3.686 39.982 -8.656 9 2HB GLU 2 2HB GLU 2 -3.551 38.954 -10.068 10 1HG GLU 2 1HG GLU 2 -4.301 40.856 -11.519 11 2HG GLU 2 2HG GLU 2 -4.422 41.883 -10.105 12 HE2 GLU 2 HE GLU 2 -1.171 41.381 -12.077 13 H MET 3 H MET 3 -4.534 37.198 -10.269 14 HA MET 3 HA MET 3 -5.779 37.105 -12.802 15 1HB MET 3 1HB MET 3 -3.680 35.739 -11.331 16 2HB MET 3 2HB MET 3 -4.768 34.518 -11.961 17 1HG MET 3 1HG MET 3 -4.592 35.725 -14.243 18 2HG MET 3 2HG MET 3 -3.283 36.660 -13.547 19 1HE MET 3 1HE MET 3 -1.821 36.085 -15.211 20 2HE MET 3 2HE MET 3 -0.835 34.605 -15.293 21 3HE MET 3 3HE MET 3 -2.394 34.684 -16.148 22 H LYS 4 H LYS 4 -6.805 34.759 -13.411 23 HA LYS 4 HA LYS 4 -9.271 34.701 -12.054 24 1HB LYS 4 1HB LYS 4 -9.212 34.177 -14.376 25 2HB LYS 4 2HB LYS 4 -7.997 32.935 -14.151 26 1HG LYS 4 1HG LYS 4 -9.521 31.374 -13.381 27 2HG LYS 4 2HG LYS 4 -10.495 32.571 -12.550 28 1HD LYS 4 1HD LYS 4 -10.496 32.851 -15.514 29 2HD LYS 4 2HD LYS 4 -11.188 31.347 -14.938 30 1HE LYS 4 1HE LYS 4 -13.076 32.406 -14.252 31 2HE LYS 4 2HE LYS 4 -12.150 33.524 -13.270 32 H THR 5 H THR 5 -6.746 32.098 -12.354 33 HA THR 5 HA THR 5 -7.569 31.228 -9.660 34 HB THR 5 HB THR 5 -7.012 28.940 -10.453 35 HG1 THR 5 1HG THR 5 -6.182 28.776 -12.616 36 1HG2 THR 5 1HG2 THR 5 -9.137 30.537 -11.565 37 2HG2 THR 5 2HG2 THR 5 -8.465 29.549 -12.885 38 3HG2 THR 5 3HG2 THR 5 -9.078 28.765 -11.409 39 H ASP 6 H ASP 6 -4.765 30.129 -11.581 40 HA ASP 6 HA ASP 6 -2.823 31.733 -10.822 41 1HB ASP 6 1HB ASP 6 -3.788 30.168 -8.472 42 2HB ASP 6 2HB ASP 6 -2.052 30.125 -8.706 43 HD2 ASP 6 HD ASP 6 -2.952 32.856 -6.516 44 H ALA 7 H ALA 7 -0.975 30.858 -11.831 45 HA ALA 7 HA ALA 7 -1.164 28.267 -12.954 46 1HB ALA 7 2HB ALA 7 0.740 30.570 -12.956 47 2HB ALA 7 3HB ALA 7 1.403 28.976 -13.388 48 3HB ALA 7 1HB ALA 7 0.048 29.657 -14.319 49 H ALA 8 H ALA 8 0.695 29.742 -10.231 50 HA ALA 8 HA ALA 8 2.245 27.499 -9.658 51 1HB ALA 8 3HB ALA 8 3.059 29.280 -8.505 52 2HB ALA 8 1HB ALA 8 1.459 30.049 -8.368 53 3HB ALA 8 2HB ALA 8 1.923 28.752 -7.240 54 H THR 9 H THR 9 -0.977 28.578 -8.398 55 HA THR 9 HA THR 9 -1.329 26.501 -6.582 56 HB THR 9 HB THR 9 -2.689 28.781 -7.416 57 HG1 THR 9 1HG THR 9 -4.251 27.827 -5.782 58 1HG2 THR 9 3HG2 THR 9 -4.372 26.300 -8.055 59 2HG2 THR 9 1HG2 THR 9 -4.998 27.961 -7.919 60 3HG2 THR 9 2HG2 THR 9 -3.875 27.538 -9.234 61 H LEU 10 H LEU 10 -2.341 26.709 -10.054 62 HA LEU 10 HA LEU 10 -3.486 24.160 -10.091 63 1HB LEU 10 1HB LEU 10 -2.322 25.856 -12.302 64 2HB LEU 10 2HB LEU 10 -3.251 24.392 -12.559 65 HG LEU 10 HG LEU 10 -4.305 26.851 -11.135 66 1HD1 LEU 10 1HD1 LEU 10 -4.380 26.035 -14.028 67 2HD1 LEU 10 2HD1 LEU 10 -5.693 27.006 -13.320 68 3HD1 LEU 10 3HD1 LEU 10 -4.024 27.622 -13.303 69 1HD2 LEU 10 2HD2 LEU 10 -5.468 24.181 -11.823 70 2HD2 LEU 10 3HD2 LEU 10 -5.662 25.175 -10.360 71 3HD2 LEU 10 1HD2 LEU 10 -6.518 25.618 -11.856 72 H ALA 11 H ALA 11 -0.228 25.297 -11.236 73 HA ALA 11 HA ALA 11 0.750 22.825 -11.942 74 1HB ALA 11 3HB ALA 11 2.166 25.254 -10.775 75 2HB ALA 11 1HB ALA 11 2.980 23.897 -11.589 76 3HB ALA 11 2HB ALA 11 1.850 24.930 -12.496 77 H GLN 12 H GLN 12 0.155 24.232 -8.756 78 HA GLN 12 HA GLN 12 1.914 22.585 -7.346 79 1HB GLN 12 1HB GLN 12 -0.048 24.621 -6.774 80 2HB GLN 12 2HB GLN 12 -0.350 23.262 -5.709 81 1HG GLN 12 1HG GLN 12 1.507 23.704 -4.475 82 2HG GLN 12 2HG GLN 12 2.523 23.767 -5.901 83 1HE2 GLN 12 1HE2 GLN 12 3.701 25.520 -5.385 84 2HE2 GLN 12 2HE2 GLN 12 3.084 27.132 -5.238 85 H GLU 13 H GLU 13 -1.506 22.255 -8.398 86 HA GLU 13 HA GLU 13 -1.589 19.662 -7.106 87 1HB GLU 13 1HB GLU 13 -3.798 21.258 -8.477 88 2HB GLU 13 2HB GLU 13 -4.026 19.739 -7.633 89 1HG GLU 13 1HG GLU 13 -3.445 22.470 -6.512 90 2HG GLU 13 2HG GLU 13 -4.563 21.251 -5.936 91 HE2 GLU 13 HE GLU 13 -2.588 19.472 -4.127 92 H ALA 14 H ALA 14 -1.904 21.276 -10.318 93 HA ALA 14 HA ALA 14 -2.572 19.081 -11.835 94 1HB ALA 14 3HB ALA 14 -2.266 21.643 -12.376 95 2HB ALA 14 1HB ALA 14 -0.617 21.150 -12.830 96 3HB ALA 14 2HB ALA 14 -2.021 20.430 -13.655 97 H GLY 15 H GLY 15 0.707 20.301 -10.880 98 1HA GLY 15 2HA GLY 15 2.665 19.212 -10.664 99 2HA GLY 15 1HA GLY 15 2.293 18.524 -12.232 100 H ASN 16 H ASN 16 0.270 17.983 -9.327 101 HA ASN 16 HA ASN 16 1.527 15.506 -8.750 102 1HB ASN 16 1HB ASN 16 -0.770 17.122 -7.673 103 2HB ASN 16 2HB ASN 16 -0.847 15.397 -7.377 104 1HD2 ASN 16 1HD2 ASN 16 -0.686 16.124 -5.141 105 2HD2 ASN 16 2HD2 ASN 16 0.874 16.364 -4.425 106 H PHE 17 H PHE 17 -1.382 16.734 -10.463 107 HA PHE 17 HA PHE 17 -2.724 14.300 -10.730 108 1HB PHE 17 1HB PHE 17 -3.704 16.559 -11.139 109 2HB PHE 17 2HB PHE 17 -2.542 16.867 -12.414 110 HD1 PHE 17 1HD PHE 17 -5.461 14.784 -11.500 111 HD2 PHE 17 2HD PHE 17 -2.962 16.177 -14.634 112 HE1 PHE 17 1HE PHE 17 -7.073 13.869 -13.192 113 HE2 PHE 17 2HE PHE 17 -4.574 15.262 -16.326 114 HZ PHE 17 HZ PHE 17 -6.611 14.119 -15.585 115 H GLU 18 H GLU 18 -0.483 16.053 -12.993 116 HA GLU 18 HA GLU 18 -0.565 14.486 -15.119 117 1HB GLU 18 1HB GLU 18 1.726 15.885 -13.745 118 2HB GLU 18 2HB GLU 18 2.081 14.881 -15.136 119 1HG GLU 18 1HG GLU 18 -0.229 16.458 -15.805 120 2HG GLU 18 2HG GLU 18 0.938 17.543 -15.075 121 HE2 GLU 18 HE GLU 18 2.242 18.348 -16.595 122 H ARG 19 H ARG 19 0.890 13.658 -11.965 123 HA ARG 19 HA ARG 19 2.229 11.388 -12.907 124 1HB ARG 19 1HB ARG 19 2.210 12.827 -10.548 125 2HB ARG 19 2HB ARG 19 1.309 11.406 -10.060 126 1HG ARG 19 1HG ARG 19 3.118 9.929 -10.570 127 2HG ARG 19 2HG ARG 19 3.924 11.114 -11.578 128 1HD ARG 19 1HD ARG 19 3.640 12.286 -8.964 129 2HD ARG 19 2HD ARG 19 4.239 10.655 -8.733 130 HE ARG 19 HE ARG 19 5.641 12.073 -10.871 131 2HH1 ARG 19 1HH ARG 19 8.528 12.603 -9.014 132 1HH2 ARG 19 2HH2 ARG 19 5.531 11.543 -7.369 133 2HH2 ARG 19 1HH2 ARG 19 7.193 11.966 -7.128 134 H ILE 20 H ILE 20 -1.020 12.036 -11.501 135 HA ILE 20 HA ILE 20 -1.723 9.311 -11.217 136 HB ILE 20 HB ILE 20 -3.513 11.730 -11.452 137 1HG1 ILE 20 1HG1 ILE 20 -2.544 10.575 -8.847 138 2HG1 ILE 20 2HG1 ILE 20 -1.569 11.752 -9.704 139 1HG2 ILE 20 2HG2 ILE 20 -4.581 9.472 -11.666 140 2HG2 ILE 20 3HG2 ILE 20 -4.005 9.108 -10.022 141 3HG2 ILE 20 1HG2 ILE 20 -5.152 10.443 -10.289 142 1HD1 ILE 20 2HD1 ILE 20 -3.985 13.007 -9.846 143 2HD1 ILE 20 3HD1 ILE 20 -4.199 12.103 -8.328 144 3HD1 ILE 20 1HD1 ILE 20 -2.843 13.244 -8.501 145 H SER 21 H SER 21 -2.189 11.805 -13.778 146 HA SER 21 HA SER 21 -3.867 10.334 -15.369 147 1HB SER 21 1HB SER 21 -3.647 12.563 -16.022 148 2HB SER 21 2HB SER 21 -1.906 12.569 -15.821 149 HG SER 21 HG SER 21 -1.760 12.215 -17.918 150 H GLY 22 H GLY 22 -0.243 10.652 -15.541 151 1HA GLY 22 2HA GLY 22 1.332 9.311 -16.418 152 2HA GLY 22 1HA GLY 22 0.149 8.814 -17.613 153 H ASP 23 H ASP 23 0.166 8.408 -14.005 154 HA ASP 23 HA ASP 23 0.961 5.781 -14.017 155 1HB ASP 23 1HB ASP 23 -0.637 7.520 -12.130 156 2HB ASP 23 2HB ASP 23 -0.531 5.805 -11.789 157 HD2 ASP 23 HD ASP 23 1.839 8.466 -12.422 158 H LEU 24 H LEU 24 -2.233 7.365 -14.429 159 HA LEU 24 HA LEU 24 -3.812 5.067 -14.101 160 1HB LEU 24 1HB LEU 24 -4.132 7.846 -14.874 161 2HB LEU 24 2HB LEU 24 -5.149 6.794 -15.838 162 HG LEU 24 HG LEU 24 -5.158 7.179 -12.845 163 1HD1 LEU 24 3HD1 LEU 24 -6.998 7.788 -15.115 164 2HD1 LEU 24 1HD1 LEU 24 -7.712 7.362 -13.540 165 3HD1 LEU 24 2HD1 LEU 24 -6.597 8.744 -13.668 166 1HD2 LEU 24 1HD2 LEU 24 -6.187 4.847 -14.433 167 2HD2 LEU 24 2HD2 LEU 24 -5.350 4.878 -12.863 168 3HD2 LEU 24 3HD2 LEU 24 -7.051 5.390 -12.975 169 H LYS 25 H LYS 25 -2.246 6.608 -16.963 170 HA LYS 25 HA LYS 25 -3.362 4.752 -18.790 171 1HB LYS 25 1HB LYS 25 -2.784 6.722 -19.818 172 2HB LYS 25 2HB LYS 25 -1.330 6.939 -18.865 173 1HG LYS 25 1HG LYS 25 -0.045 5.561 -20.237 174 2HG LYS 25 2HG LYS 25 -1.402 4.544 -20.678 175 1HD LYS 25 1HD LYS 25 -0.815 5.812 -22.648 176 2HD LYS 25 2HD LYS 25 -2.324 6.476 -22.053 177 1HE LYS 25 1HE LYS 25 -1.270 8.500 -22.152 178 2HE LYS 25 2HE LYS 25 -0.479 8.011 -20.667 179 H THR 26 H THR 26 -0.434 4.889 -16.755 180 HA THR 26 HA THR 26 0.997 2.848 -18.026 181 HB THR 26 HB THR 26 0.914 4.080 -15.245 182 HG1 THR 26 1HG THR 26 1.966 5.269 -16.914 183 1HG2 THR 26 3HG2 THR 26 2.228 1.544 -16.088 184 2HG2 THR 26 1HG2 THR 26 3.351 2.759 -15.432 185 3HG2 THR 26 2HG2 THR 26 1.978 2.194 -14.450 186 H GLN 27 H GLN 27 -1.168 2.657 -15.118 187 HA GLN 27 HA GLN 27 -0.982 -0.083 -14.914 188 1HB GLN 27 1HB GLN 27 -3.288 1.747 -14.112 189 2HB GLN 27 2HB GLN 27 -3.064 0.107 -13.536 190 1HG GLN 27 1HG GLN 27 -0.945 2.275 -13.189 191 2HG GLN 27 2HG GLN 27 -2.194 1.977 -11.997 192 1HE2 GLN 27 1HE2 GLN 27 0.480 0.528 -13.778 193 2HE2 GLN 27 2HE2 GLN 27 0.899 -0.693 -12.624 194 H ILE 28 H ILE 28 -3.313 2.010 -16.713 195 HA ILE 28 HA ILE 28 -5.072 0.046 -17.514 196 HB ILE 28 HB ILE 28 -4.218 2.698 -18.591 197 1HG1 ILE 28 1HG1 ILE 28 -6.856 1.601 -17.571 198 2HG1 ILE 28 2HG1 ILE 28 -5.723 2.571 -16.650 199 1HG2 ILE 28 1HG2 ILE 28 -5.655 0.582 -20.107 200 2HG2 ILE 28 2HG2 ILE 28 -6.313 2.235 -20.190 201 3HG2 ILE 28 3HG2 ILE 28 -4.630 1.920 -20.680 202 1HD1 ILE 28 2HD1 ILE 28 -5.955 4.298 -18.628 203 2HD1 ILE 28 3HD1 ILE 28 -7.441 3.394 -19.003 204 3HD1 ILE 28 1HD1 ILE 28 -7.256 4.184 -17.418 205 H ASP 29 H ASP 29 -1.921 1.071 -18.934 206 HA ASP 29 HA ASP 29 -2.125 -0.506 -21.196 207 1HB ASP 29 1HB ASP 29 -0.388 1.357 -20.432 208 2HB ASP 29 2HB ASP 29 0.516 -0.003 -19.796 209 HD2 ASP 29 HD ASP 29 1.082 1.807 -21.909 210 H GLN 30 H GLN 30 -0.890 -1.079 -17.855 211 HA GLN 30 HA GLN 30 0.393 -3.454 -18.267 212 1HB GLN 30 1HB GLN 30 -1.202 -2.527 -15.838 213 2HB GLN 30 2HB GLN 30 -0.084 -3.876 -15.826 214 1HG GLN 30 1HG GLN 30 0.495 -0.929 -16.058 215 2HG GLN 30 2HG GLN 30 1.303 -2.142 -15.084 216 1HE2 GLN 30 1HE2 GLN 30 1.871 -0.106 -17.431 217 2HE2 GLN 30 2HE2 GLN 30 2.990 -0.961 -18.439 218 H VAL 31 H VAL 31 -3.088 -2.859 -17.429 219 HA VAL 31 HA VAL 31 -3.789 -5.576 -17.389 220 HB VAL 31 HB VAL 31 -5.313 -2.997 -17.716 221 1HG1 VAL 31 3HG1 VAL 31 -6.480 -4.875 -18.912 222 2HG1 VAL 31 1HG1 VAL 31 -6.560 -5.740 -17.358 223 3HG1 VAL 31 2HG1 VAL 31 -7.396 -4.181 -17.553 224 1HG2 VAL 31 3HG2 VAL 31 -4.183 -4.252 -15.502 225 2HG2 VAL 31 1HG2 VAL 31 -5.427 -2.979 -15.480 226 3HG2 VAL 31 2HG2 VAL 31 -5.905 -4.692 -15.413 227 H GLU 32 H GLU 32 -4.250 -3.014 -19.929 228 HA GLU 32 HA GLU 32 -5.395 -4.555 -21.816 229 1HB GLU 32 1HB GLU 32 -3.495 -2.206 -21.969 230 2HB GLU 32 2HB GLU 32 -4.033 -2.974 -23.449 231 1HG GLU 32 1HG GLU 32 -6.424 -2.652 -22.716 232 2HG GLU 32 2HG GLU 32 -5.853 -1.821 -21.282 233 HE2 GLU 32 HE GLU 32 -4.354 -1.221 -24.493 234 H SER 33 H SER 33 -1.945 -4.404 -20.873 235 HA SER 33 HA SER 33 -1.163 -6.036 -23.074 236 1HB SER 33 1HB SER 33 0.669 -4.780 -22.528 237 2HB SER 33 2HB SER 33 0.154 -4.564 -20.867 238 HG SER 33 HG SER 33 1.095 -6.496 -20.266 239 H THR 34 H THR 34 -1.335 -6.387 -19.456 240 HA THR 34 HA THR 34 -0.579 -9.042 -19.310 241 HB THR 34 HB THR 34 -2.144 -7.072 -17.654 242 HG1 THR 34 1HG THR 34 -0.350 -7.844 -16.235 243 1HG2 THR 34 3HG2 THR 34 -3.362 -9.325 -17.409 244 2HG2 THR 34 1HG2 THR 34 -1.812 -10.007 -16.858 245 3HG2 THR 34 2HG2 THR 34 -2.603 -8.718 -15.918 246 H ALA 35 H ALA 35 -3.854 -7.635 -19.872 247 HA ALA 35 HA ALA 35 -5.299 -9.965 -19.742 248 1HB ALA 35 1HB ALA 35 -5.929 -7.950 -21.874 249 2HB ALA 35 3HB ALA 35 -5.891 -7.397 -20.183 250 3HB ALA 35 2HB ALA 35 -6.998 -8.705 -20.667 251 H GLY 36 H GLY 36 -2.839 -9.004 -22.020 252 1HA GLY 36 2HA GLY 36 -1.950 -10.055 -23.796 253 2HA GLY 36 1HA GLY 36 -3.597 -10.285 -24.348 254 H SER 37 H SER 37 -1.769 -11.614 -21.498 255 HA SER 37 HA SER 37 -1.514 -14.148 -22.625 256 1HB SER 37 1HB SER 37 -1.523 -13.437 -19.660 257 2HB SER 37 2HB SER 37 -0.775 -14.842 -20.395 258 HG SER 37 HG SER 37 0.049 -12.364 -21.467 259 H LEU 38 H LEU 38 -4.166 -12.470 -21.098 260 HA LEU 38 HA LEU 38 -5.506 -14.851 -20.214 261 1HB LEU 38 1HB LEU 38 -6.171 -11.924 -20.307 262 2HB LEU 38 2HB LEU 38 -7.407 -13.114 -19.953 263 HG LEU 38 HG LEU 38 -6.800 -12.673 -17.825 264 1HD1 LEU 38 1HD1 LEU 38 -6.213 -15.033 -18.184 265 2HD1 LEU 38 2HD1 LEU 38 -4.535 -14.557 -18.539 266 3HD1 LEU 38 3HD1 LEU 38 -5.216 -14.279 -16.918 267 1HD2 LEU 38 1HD2 LEU 38 -4.291 -11.654 -19.056 268 2HD2 LEU 38 2HD2 LEU 38 -5.383 -10.903 -17.868 269 3HD2 LEU 38 3HD2 LEU 38 -4.221 -12.147 -17.348 270 H GLN 39 H GLN 39 -6.495 -12.265 -22.569 271 HA GLN 39 HA GLN 39 -8.407 -13.762 -23.790 272 1HB GLN 39 1HB GLN 39 -7.914 -12.192 -25.807 273 2HB GLN 39 2HB GLN 39 -8.404 -11.461 -24.292 274 1HG GLN 39 1HG GLN 39 -5.551 -11.756 -24.181 275 2HG GLN 39 2HG GLN 39 -5.928 -11.097 -25.760 276 1HE2 GLN 39 1HE2 GLN 39 -7.594 -10.740 -22.644 277 2HE2 GLN 39 2HE2 GLN 39 -7.459 -9.018 -22.513 278 H GLY 40 H GLY 40 -4.925 -14.040 -23.993 279 1HA GLY 40 2HA GLY 40 -3.579 -15.080 -25.547 280 2HA GLY 40 1HA GLY 40 -4.978 -15.494 -26.516 281 H GLN 41 H GLN 41 -5.780 -16.196 -23.310 282 HA GLN 41 HA GLN 41 -5.340 -18.989 -23.828 283 1HB GLN 41 1HB GLN 41 -4.435 -17.876 -21.153 284 2HB GLN 41 2HB GLN 41 -4.129 -19.466 -21.823 285 1HG GLN 41 1HG GLN 41 -2.631 -18.547 -23.521 286 2HG GLN 41 2HG GLN 41 -3.073 -16.904 -23.100 287 1HE2 GLN 41 1HE2 GLN 41 -1.277 -16.042 -22.339 288 2HE2 GLN 41 2HE2 GLN 41 -0.317 -16.644 -21.029 289 H TRP 42 H TRP 42 -7.391 -19.780 -23.629 290 HA TRP 42 HA TRP 42 -8.775 -19.444 -21.156 291 1HB TRP 42 1HB TRP 42 -9.813 -18.055 -23.625 292 2HB TRP 42 2HB TRP 42 -10.850 -18.523 -22.293 293 HD1 TRP 42 HD TRP 42 -9.050 -15.574 -23.416 294 HE1 TRP 42 1HE TRP 42 -8.569 -13.795 -21.527 295 HE3 TRP 42 3HE TRP 42 -10.003 -18.687 -19.510 296 HZ2 TRP 42 2HZ TRP 42 -8.638 -13.888 -18.676 297 HZ3 TRP 42 3HZ TRP 42 -9.772 -17.764 -17.206 298 HH2 TRP 42 HH TRP 42 -9.116 -15.453 -16.757 299 H ARG 43 H ARG 43 -10.594 -20.973 -21.049 300 HA ARG 43 HA ARG 43 -10.784 -22.707 -23.356 301 1HB ARG 43 1HB ARG 43 -10.171 -23.628 -20.504 302 2HB ARG 43 2HB ARG 43 -10.689 -24.719 -21.774 303 1HG ARG 43 1HG ARG 43 -8.276 -22.898 -22.135 304 2HG ARG 43 2HG ARG 43 -8.129 -24.465 -21.364 305 1HD ARG 43 1HD ARG 43 -9.477 -25.279 -23.552 306 2HD ARG 43 2HD ARG 43 -8.795 -23.817 -24.236 307 HE ARG 43 HE ARG 43 -6.668 -25.124 -22.916 308 2HH1 ARG 43 1HH ARG 43 -5.557 -27.192 -25.477 309 1HH2 ARG 43 2HH2 ARG 43 -8.854 -25.806 -25.620 310 2HH2 ARG 43 1HH2 ARG 43 -7.718 -26.820 -26.445 311 H GLY 44 H GLY 44 -12.888 -21.529 -23.512 312 1HA GLY 44 2HA GLY 44 -14.835 -22.421 -21.470 313 2HA GLY 44 1HA GLY 44 -15.151 -22.516 -23.191 314 H ALA 45 H ALA 45 -16.692 -21.007 -21.196 315 HA ALA 45 HA ALA 45 -17.026 -18.629 -22.608 316 1HB ALA 45 3HB ALA 45 -17.874 -19.426 -19.794 317 2HB ALA 45 1HB ALA 45 -18.522 -18.043 -20.707 318 3HB ALA 45 2HB ALA 45 -18.793 -19.702 -21.293 319 H ALA 46 H ALA 46 -14.855 -19.561 -19.984 320 HA ALA 46 HA ALA 46 -14.339 -17.169 -18.776 321 1HB ALA 46 1HB ALA 46 -11.950 -18.800 -19.401 322 2HB ALA 46 3HB ALA 46 -13.313 -19.720 -18.720 323 3HB ALA 46 2HB ALA 46 -12.639 -18.335 -17.827 324 H GLY 47 H GLY 47 -13.534 -18.258 -22.053 325 1HA GLY 47 2HA GLY 47 -12.381 -17.285 -23.733 326 2HA GLY 47 1HA GLY 47 -11.531 -16.294 -22.564 327 H THR 48 H THR 48 -14.854 -16.664 -23.997 328 HA THR 48 HA THR 48 -14.945 -14.062 -24.995 329 HB THR 48 HB THR 48 -17.441 -14.627 -25.138 330 HG1 THR 48 1HG THR 48 -17.601 -15.933 -23.240 331 1HG2 THR 48 1HG2 THR 48 -15.458 -16.826 -25.927 332 2HG2 THR 48 2HG2 THR 48 -17.145 -16.747 -26.488 333 3HG2 THR 48 3HG2 THR 48 -15.992 -15.475 -26.956 334 H ALA 49 H ALA 49 -15.622 -15.349 -21.761 335 HA ALA 49 HA ALA 49 -17.121 -13.146 -20.860 336 1HB ALA 49 2HB ALA 49 -15.478 -15.315 -19.517 337 2HB ALA 49 3HB ALA 49 -16.344 -14.068 -18.587 338 3HB ALA 49 1HB ALA 49 -17.248 -15.183 -19.639 339 H ALA 50 H ALA 50 -13.601 -14.001 -20.601 340 HA ALA 50 HA ALA 50 -12.978 -11.510 -19.364 341 1HB ALA 50 2HB ALA 50 -10.588 -12.437 -20.133 342 2HB ALA 50 1HB ALA 50 -11.521 -13.937 -20.352 343 3HB ALA 50 3HB ALA 50 -11.470 -13.145 -18.759 344 H GLN 51 H GLN 51 -12.486 -12.951 -22.660 345 HA GLN 51 HA GLN 51 -11.164 -10.921 -23.816 346 1HB GLN 51 1HB GLN 51 -11.589 -12.966 -25.023 347 2HB GLN 51 2HB GLN 51 -13.325 -12.744 -24.938 348 1HG GLN 51 1HG GLN 51 -11.949 -10.446 -26.193 349 2HG GLN 51 2HG GLN 51 -11.669 -11.948 -27.052 350 1HE2 GLN 51 1HE2 GLN 51 -13.970 -9.559 -26.070 351 2HE2 GLN 51 2HE2 GLN 51 -15.321 -10.091 -27.013 352 H ALA 52 H ALA 52 -14.765 -11.239 -23.494 353 HA ALA 52 HA ALA 52 -15.415 -8.883 -24.809 354 1HB ALA 52 2HB ALA 52 -17.099 -10.522 -24.356 355 2HB ALA 52 1HB ALA 52 -17.532 -9.086 -23.398 356 3HB ALA 52 3HB ALA 52 -16.764 -10.484 -22.608 357 H ALA 53 H ALA 53 -14.935 -9.519 -21.263 358 HA ALA 53 HA ALA 53 -15.359 -6.933 -20.404 359 1HB ALA 53 3HB ALA 53 -13.419 -9.000 -19.291 360 2HB ALA 53 1HB ALA 53 -14.144 -7.639 -18.402 361 3HB ALA 53 2HB ALA 53 -15.172 -8.972 -18.982 362 H VAL 54 H VAL 54 -12.587 -8.412 -22.057 363 HA VAL 54 HA VAL 54 -10.785 -6.300 -21.404 364 HB VAL 54 HB VAL 54 -10.647 -8.364 -23.609 365 1HG1 VAL 54 3HG1 VAL 54 -9.050 -6.252 -23.414 366 2HG1 VAL 54 1HG1 VAL 54 -8.252 -7.264 -22.187 367 3HG1 VAL 54 2HG1 VAL 54 -8.420 -7.857 -23.857 368 1HG2 VAL 54 1HG2 VAL 54 -10.719 -8.785 -20.802 369 2HG2 VAL 54 2HG2 VAL 54 -10.345 -9.961 -22.084 370 3HG2 VAL 54 3HG2 VAL 54 -9.035 -9.027 -21.324 371 H VAL 55 H VAL 55 -13.121 -7.042 -24.005 372 HA VAL 55 HA VAL 55 -12.191 -5.058 -25.782 373 HB VAL 55 HB VAL 55 -14.647 -6.736 -25.463 374 1HG1 VAL 55 1HG1 VAL 55 -14.524 -4.138 -26.849 375 2HG1 VAL 55 2HG1 VAL 55 -15.101 -5.482 -27.862 376 3HG1 VAL 55 3HG1 VAL 55 -15.928 -5.101 -26.333 377 1HG2 VAL 55 1HG2 VAL 55 -12.257 -7.150 -26.710 378 2HG2 VAL 55 2HG2 VAL 55 -13.782 -7.950 -27.160 379 3HG2 VAL 55 3HG2 VAL 55 -13.235 -6.511 -28.053 380 H ARG 56 H ARG 56 -14.981 -5.158 -23.453 381 HA ARG 56 HA ARG 56 -15.823 -2.610 -23.903 382 1HB ARG 56 1HB ARG 56 -15.958 -4.490 -21.533 383 2HB ARG 56 2HB ARG 56 -16.526 -2.845 -21.321 384 1HG ARG 56 1HG ARG 56 -17.837 -3.342 -23.603 385 2HG ARG 56 2HG ARG 56 -17.618 -5.013 -23.122 386 1HD ARG 56 1HD ARG 56 -18.485 -3.529 -20.797 387 2HD ARG 56 2HD ARG 56 -19.546 -3.111 -22.127 388 HE ARG 56 HE ARG 56 -19.326 -5.723 -20.825 389 2HH1 ARG 56 1HH ARG 56 -21.636 -7.263 -22.912 390 1HH2 ARG 56 2HH2 ARG 56 -20.309 -4.058 -23.794 391 2HH2 ARG 56 1HH2 ARG 56 -21.391 -5.316 -24.289 392 H PHE 57 H PHE 57 -13.455 -3.849 -21.443 393 HA PHE 57 HA PHE 57 -12.941 -1.380 -20.258 394 1HB PHE 57 1HB PHE 57 -12.150 -3.276 -19.074 395 2HB PHE 57 2HB PHE 57 -11.691 -4.116 -20.541 396 HD1 PHE 57 1HD PHE 57 -10.653 -1.474 -18.176 397 HD2 PHE 57 2HD PHE 57 -9.472 -4.006 -21.370 398 HE1 PHE 57 1HE PHE 57 -8.253 -0.854 -17.780 399 HE2 PHE 57 2HE PHE 57 -7.072 -3.386 -20.974 400 HZ PHE 57 HZ PHE 57 -6.491 -1.818 -19.184 401 H GLN 58 H GLN 58 -11.296 -3.136 -22.966 402 HA GLN 58 HA GLN 58 -9.200 -1.413 -23.267 403 1HB GLN 58 1HB GLN 58 -10.708 -3.202 -25.191 404 2HB GLN 58 2HB GLN 58 -9.391 -2.205 -25.773 405 1HG GLN 58 1HG GLN 58 -8.771 -3.706 -23.277 406 2HG GLN 58 2HG GLN 58 -9.093 -4.725 -24.666 407 1HE2 GLN 58 1HE2 GLN 58 -6.979 -5.415 -24.787 408 2HE2 GLN 58 2HE2 GLN 58 -5.683 -4.430 -25.376 409 H GLU 59 H GLU 59 -12.361 -1.393 -25.076 410 HA GLU 59 HA GLU 59 -11.870 0.893 -26.491 411 1HB GLU 59 1HB GLU 59 -14.362 -0.533 -25.572 412 2HB GLU 59 2HB GLU 59 -14.538 1.047 -26.309 413 1HG GLU 59 1HG GLU 59 -12.821 -1.063 -27.654 414 2HG GLU 59 2HG GLU 59 -14.564 -1.114 -27.831 415 HE2 GLU 59 HE GLU 59 -14.643 -0.479 -29.868 416 H ALA 60 H ALA 60 -12.844 0.443 -23.105 417 HA ALA 60 HA ALA 60 -13.616 3.187 -22.764 418 1HB ALA 60 1HB ALA 60 -13.132 0.883 -20.835 419 2HB ALA 60 2HB ALA 60 -13.753 2.482 -20.359 420 3HB ALA 60 3HB ALA 60 -14.700 1.450 -21.457 421 H ALA 61 H ALA 61 -10.690 1.204 -22.545 422 HA ALA 61 HA ALA 61 -9.185 2.755 -20.822 423 1HB ALA 61 3HB ALA 61 -8.749 0.451 -21.987 424 2HB ALA 61 1HB ALA 61 -8.020 1.436 -23.278 425 3HB ALA 61 2HB ALA 61 -7.367 1.512 -21.624 426 H ASN 62 H ASN 62 -9.600 2.994 -24.417 427 HA ASN 62 HA ASN 62 -7.875 5.127 -24.718 428 1HB ASN 62 1HB ASN 62 -10.348 4.873 -26.452 429 2HB ASN 62 2HB ASN 62 -8.704 5.237 -26.938 430 1HD2 ASN 62 1HD2 ASN 62 -10.883 2.730 -25.786 431 2HD2 ASN 62 2HD2 ASN 62 -10.014 1.360 -26.392 432 H LYS 63 H LYS 63 -11.472 4.912 -24.257 433 HA LYS 63 HA LYS 63 -12.071 7.593 -24.491 434 1HB LYS 63 1HB LYS 63 -13.577 5.479 -24.271 435 2HB LYS 63 2HB LYS 63 -13.486 5.778 -22.547 436 1HG LYS 63 1HG LYS 63 -15.249 7.189 -22.895 437 2HG LYS 63 2HG LYS 63 -14.039 8.317 -23.472 438 1HD LYS 63 1HD LYS 63 -15.906 8.066 -25.102 439 2HD LYS 63 2HD LYS 63 -14.376 7.570 -25.796 440 1HE LYS 63 1HE LYS 63 -14.977 5.333 -25.894 441 2HE LYS 63 2HE LYS 63 -15.924 5.407 -24.422 442 H GLN 64 H GLN 64 -10.728 5.727 -21.744 443 HA GLN 64 HA GLN 64 -11.025 7.889 -19.946 444 1HB GLN 64 1HB GLN 64 -10.069 5.117 -19.883 445 2HB GLN 64 2HB GLN 64 -9.034 6.166 -18.934 446 1HG GLN 64 1HG GLN 64 -11.888 6.766 -18.509 447 2HG GLN 64 2HG GLN 64 -11.510 5.098 -18.130 448 1HE2 GLN 64 1HE2 GLN 64 -10.971 8.439 -17.362 449 2HE2 GLN 64 2HE2 GLN 64 -10.151 8.228 -15.852 450 H LYS 65 H LYS 65 -8.496 6.687 -22.165 451 HA LYS 65 HA LYS 65 -6.425 8.295 -21.091 452 1HB LYS 65 1HB LYS 65 -6.815 6.434 -23.340 453 2HB LYS 65 2HB LYS 65 -5.697 7.737 -23.688 454 1HG LYS 65 1HG LYS 65 -4.249 6.198 -22.697 455 2HG LYS 65 2HG LYS 65 -4.695 7.155 -21.298 456 1HD LYS 65 1HD LYS 65 -5.038 4.972 -20.502 457 2HD LYS 65 2HD LYS 65 -6.654 5.415 -21.016 458 1HE LYS 65 1HE LYS 65 -6.210 3.203 -21.899 459 2HE LYS 65 2HE LYS 65 -6.186 4.310 -23.256 460 H GLN 66 H GLN 66 -9.063 8.773 -23.421 461 HA GLN 66 HA GLN 66 -7.945 11.085 -24.564 462 1HB GLN 66 1HB GLN 66 -10.074 9.414 -25.146 463 2HB GLN 66 2HB GLN 66 -10.904 10.848 -24.576 464 1HG GLN 66 1HG GLN 66 -10.598 11.121 -26.957 465 2HG GLN 66 2HG GLN 66 -9.487 12.228 -26.176 466 1HE2 GLN 66 1HE2 GLN 66 -7.306 11.914 -26.272 467 2HE2 GLN 66 2HE2 GLN 66 -6.534 10.753 -27.298 468 H GLU 67 H GLU 67 -10.482 10.501 -22.035 469 HA GLU 67 HA GLU 67 -10.795 13.263 -21.556 470 1HB GLU 67 1HB GLU 67 -11.751 10.719 -20.234 471 2HB GLU 67 2HB GLU 67 -11.950 12.242 -19.390 472 1HG GLU 67 1HG GLU 67 -13.896 11.465 -20.924 473 2HG GLU 67 2HG GLU 67 -13.385 13.135 -21.057 474 HE2 GLU 67 HE GLU 67 -12.248 12.748 -24.311 475 H LEU 68 H LEU 68 -8.636 10.724 -20.396 476 HA LEU 68 HA LEU 68 -7.896 12.086 -18.002 477 1HB LEU 68 1HB LEU 68 -7.777 9.691 -18.137 478 2HB LEU 68 2HB LEU 68 -6.704 9.766 -19.520 479 HG LEU 68 HG LEU 68 -5.157 11.108 -17.824 480 1HD1 LEU 68 1HD1 LEU 68 -7.261 10.010 -16.122 481 2HD1 LEU 68 2HD1 LEU 68 -5.629 9.502 -15.624 482 3HD1 LEU 68 3HD1 LEU 68 -6.017 11.233 -15.771 483 1HD2 LEU 68 3HD2 LEU 68 -5.203 8.548 -18.897 484 2HD2 LEU 68 1HD2 LEU 68 -3.839 9.330 -18.063 485 3HD2 LEU 68 2HD2 LEU 68 -4.953 8.281 -17.155 486 H ASP 69 H ASP 69 -6.734 11.914 -21.387 487 HA ASP 69 HA ASP 69 -4.366 13.331 -20.807 488 1HB ASP 69 1HB ASP 69 -4.801 11.780 -22.799 489 2HB ASP 69 2HB ASP 69 -5.802 13.044 -23.486 490 HD2 ASP 69 HD ASP 69 -2.889 12.305 -24.728 491 H GLU 70 H GLU 70 -7.556 14.085 -22.389 492 HA GLU 70 HA GLU 70 -7.084 16.681 -23.033 493 1HB GLU 70 1HB GLU 70 -9.401 16.863 -23.362 494 2HB GLU 70 2HB GLU 70 -9.143 15.133 -23.476 495 1HG GLU 70 1HG GLU 70 -9.790 14.872 -21.077 496 2HG GLU 70 2HG GLU 70 -10.029 16.603 -20.947 497 HE2 GLU 70 HE GLU 70 -12.539 16.478 -23.464 498 H ILE 71 H ILE 71 -8.286 15.307 -19.909 499 HA ILE 71 HA ILE 71 -8.688 17.779 -18.659 500 HB ILE 71 HB ILE 71 -8.240 14.976 -17.664 501 1HG1 ILE 71 1HG1 ILE 71 -10.696 16.754 -17.664 502 2HG1 ILE 71 2HG1 ILE 71 -10.352 15.526 -18.866 503 1HG2 ILE 71 3HG2 ILE 71 -7.863 17.378 -16.163 504 2HG2 ILE 71 1HG2 ILE 71 -9.354 16.584 -15.604 505 3HG2 ILE 71 2HG2 ILE 71 -7.817 15.687 -15.609 506 1HD1 ILE 71 1HD1 ILE 71 -10.164 14.604 -16.033 507 2HD1 ILE 71 2HD1 ILE 71 -11.793 15.053 -16.593 508 3HD1 ILE 71 3HD1 ILE 71 -10.874 13.793 -17.450 509 H SER 72 H SER 72 -5.832 15.615 -18.962 510 HA SER 72 HA SER 72 -4.268 17.047 -17.154 511 1HB SER 72 1HB SER 72 -2.919 15.278 -17.527 512 2HB SER 72 2HB SER 72 -4.010 14.736 -18.787 513 HG SER 72 HG SER 72 -2.612 15.356 -20.290 514 H THR 73 H THR 73 -5.216 17.571 -20.505 515 HA THR 73 HA THR 73 -3.079 19.513 -20.925 516 HB THR 73 HB THR 73 -5.188 18.132 -22.629 517 HG1 THR 73 1HG THR 73 -2.303 18.652 -22.784 518 1HG2 THR 73 1HG2 THR 73 -4.829 20.724 -23.161 519 2HG2 THR 73 2HG2 THR 73 -3.247 20.169 -23.759 520 3HG2 THR 73 3HG2 THR 73 -4.744 19.532 -24.480 521 H ASN 74 H ASN 74 -6.456 19.314 -19.976 522 HA ASN 74 HA ASN 74 -7.298 21.784 -20.800 523 1HB ASN 74 1HB ASN 74 -8.075 19.794 -18.726 524 2HB ASN 74 2HB ASN 74 -8.550 21.432 -18.322 525 1HD2 ASN 74 1HD2 ASN 74 -9.080 18.695 -20.306 526 2HD2 ASN 74 2HD2 ASN 74 -10.416 19.281 -21.240 527 H ILE 75 H ILE 75 -5.014 20.797 -18.316 528 HA ILE 75 HA ILE 75 -5.262 23.140 -16.705 529 HB ILE 75 HB ILE 75 -2.961 21.199 -16.788 530 1HG1 ILE 75 1HG1 ILE 75 -5.061 19.923 -16.700 531 2HG1 ILE 75 2HG1 ILE 75 -4.141 19.790 -15.215 532 1HG2 ILE 75 1HG2 ILE 75 -3.158 23.485 -15.395 533 2HG2 ILE 75 2HG2 ILE 75 -3.992 22.386 -14.269 534 3HG2 ILE 75 3HG2 ILE 75 -2.324 22.036 -14.785 535 1HD1 ILE 75 2HD1 ILE 75 -6.331 21.877 -15.535 536 2HD1 ILE 75 3HD1 ILE 75 -6.682 20.220 -14.988 537 3HD1 ILE 75 1HD1 ILE 75 -5.604 21.264 -14.030 538 H ARG 76 H ARG 76 -2.879 21.928 -19.157 539 HA ARG 76 HA ARG 76 -1.183 24.032 -19.060 540 1HB ARG 76 1HB ARG 76 -2.008 22.664 -21.663 541 2HB ARG 76 2HB ARG 76 -0.440 23.344 -21.277 542 1HG ARG 76 1HG ARG 76 -0.617 21.576 -19.228 543 2HG ARG 76 2HG ARG 76 -1.666 20.753 -20.366 544 1HD ARG 76 1HD ARG 76 0.780 21.722 -21.684 545 2HD ARG 76 2HD ARG 76 1.160 20.682 -20.325 546 HE ARG 76 HE ARG 76 -0.850 19.291 -21.620 547 2HH1 ARG 76 1HH ARG 76 0.817 17.778 -24.265 548 1HH2 ARG 76 2HH2 ARG 76 2.233 20.666 -22.696 549 2HH2 ARG 76 1HH2 ARG 76 2.463 19.490 -23.946 550 H GLN 77 H GLN 77 -4.451 23.844 -20.384 551 HA GLN 77 HA GLN 77 -4.164 26.120 -22.050 552 1HB GLN 77 1HB GLN 77 -6.474 24.394 -21.137 553 2HB GLN 77 2HB GLN 77 -6.802 25.914 -21.945 554 1HG GLN 77 1HG GLN 77 -4.721 24.482 -23.393 555 2HG GLN 77 2HG GLN 77 -6.091 23.418 -23.144 556 1HE2 GLN 77 1HE2 GLN 77 -6.529 23.452 -25.354 557 2HE2 GLN 77 2HE2 GLN 77 -7.312 24.786 -26.134 558 H ALA 78 H ALA 78 -4.880 25.494 -18.662 559 HA ALA 78 HA ALA 78 -6.277 27.894 -18.139 560 1HB ALA 78 1HB ALA 78 -4.658 26.647 -15.981 561 2HB ALA 78 2HB ALA 78 -6.390 27.053 -16.024 562 3HB ALA 78 3HB ALA 78 -5.806 25.563 -16.802 563 H GLY 79 H GLY 79 -2.957 27.132 -18.837 564 1HA GLY 79 2HA GLY 79 -2.200 29.871 -18.036 565 2HA GLY 79 1HA GLY 79 -1.511 28.958 -19.363 566 H VAL 80 H VAL 80 -1.683 26.443 -17.472 567 HA VAL 80 HA VAL 80 0.452 27.144 -15.617 568 HB VAL 80 HB VAL 80 -0.814 24.440 -15.858 569 1HG1 VAL 80 2HG1 VAL 80 0.833 25.909 -13.939 570 2HG1 VAL 80 3HG1 VAL 80 -0.605 25.179 -13.187 571 3HG1 VAL 80 1HG1 VAL 80 0.539 24.161 -14.094 572 1HG2 VAL 80 1HG2 VAL 80 -2.092 26.852 -14.527 573 2HG2 VAL 80 2HG2 VAL 80 -2.717 25.958 -15.934 574 3HG2 VAL 80 3HG2 VAL 80 -2.632 25.166 -14.342 575 H GLN 81 H GLN 81 2.254 27.412 -16.985 576 HA GLN 81 HA GLN 81 3.195 24.892 -18.059 577 1HB GLN 81 1HB GLN 81 4.139 26.421 -20.030 578 2HB GLN 81 2HB GLN 81 2.537 25.715 -20.119 579 1HG GLN 81 1HG GLN 81 1.504 27.749 -19.987 580 2HG GLN 81 2HG GLN 81 2.537 28.293 -18.680 581 1HE2 GLN 81 1HE2 GLN 81 2.010 30.194 -20.295 582 2HE2 GLN 81 2HE2 GLN 81 3.271 30.565 -21.423 583 H TYR 82 H TYR 82 3.632 27.117 -15.807 584 HA TYR 82 HA TYR 82 6.502 26.812 -15.836 585 1HB TYR 82 1HB TYR 82 6.843 29.274 -15.698 586 2HB TYR 82 2HB TYR 82 5.935 28.929 -17.157 587 HD1 TYR 82 1HD TYR 82 6.058 30.898 -14.215 588 HD2 TYR 82 2HD TYR 82 3.309 29.058 -16.929 589 HE1 TYR 82 1HE TYR 82 4.234 32.503 -13.468 590 HE2 TYR 82 2HE TYR 82 1.494 30.669 -16.172 591 HH TYR 82 HH TYR 82 1.757 32.502 -13.393 592 H SER 83 H SER 83 6.681 25.841 -13.859 593 HA SER 83 HA SER 83 5.708 27.396 -11.628 594 1HB SER 83 1HB SER 83 3.931 25.960 -11.450 595 2HB SER 83 2HB SER 83 4.695 24.721 -12.426 596 HG SER 83 HG SER 83 4.843 23.744 -10.501 597 H ARG 84 H ARG 84 7.404 24.355 -12.679 598 HA ARG 84 HA ARG 84 9.028 24.363 -10.374 599 1HB ARG 84 1HB ARG 84 10.294 22.546 -11.689 600 2HB ARG 84 2HB ARG 84 8.596 22.226 -11.394 601 1HG ARG 84 1HG ARG 84 8.006 22.488 -13.623 602 2HG ARG 84 2HG ARG 84 9.216 23.721 -13.915 603 1HD ARG 84 1HD ARG 84 11.005 21.918 -13.788 604 2HD ARG 84 2HD ARG 84 9.734 20.720 -13.650 605 HE ARG 84 HE ARG 84 10.502 22.180 -16.070 606 2HH1 ARG 84 1HH ARG 84 8.061 20.709 -18.055 607 1HH2 ARG 84 2HH2 ARG 84 7.892 20.374 -14.495 608 2HH2 ARG 84 1HH2 ARG 84 7.113 19.959 -15.985 609 H ALA 85 H ALA 85 9.028 26.122 -13.326 610 HA ALA 85 HA ALA 85 11.754 26.271 -13.907 611 1HB ALA 85 1HB ALA 85 11.033 28.452 -15.013 612 2HB ALA 85 2HB ALA 85 10.132 27.001 -15.513 613 3HB ALA 85 3HB ALA 85 9.406 28.146 -14.360 614 H ASP 86 H ASP 86 9.753 27.714 -11.374 615 HA ASP 86 HA ASP 86 11.387 29.873 -10.797 616 1HB ASP 86 1HB ASP 86 9.023 28.711 -9.784 617 2HB ASP 86 2HB ASP 86 10.137 28.634 -8.434 618 HD2 ASP 86 HD ASP 86 7.791 30.341 -9.335 619 H GLU 87 H GLU 87 11.030 26.648 -9.115 620 HA GLU 87 HA GLU 87 13.277 27.032 -7.513 621 1HB GLU 87 1HB GLU 87 12.998 24.653 -6.930 622 2HB GLU 87 2HB GLU 87 11.448 25.471 -6.942 623 1HG GLU 87 1HG GLU 87 11.080 24.632 -9.307 624 2HG GLU 87 2HG GLU 87 12.576 23.728 -9.183 625 HE2 GLU 87 HE GLU 87 11.146 21.162 -7.466 626 H GLU 88 H GLU 88 12.738 25.277 -10.628 627 HA GLU 88 HA GLU 88 15.072 23.997 -10.893 628 1HB GLU 88 1HB GLU 88 13.238 23.899 -12.539 629 2HB GLU 88 2HB GLU 88 13.561 25.546 -13.042 630 1HG GLU 88 1HG GLU 88 15.090 24.790 -14.531 631 2HG GLU 88 2HG GLU 88 16.056 24.154 -13.215 632 HE2 GLU 88 HE GLU 88 14.605 20.972 -13.386 633 H GLN 89 H GLN 89 14.458 27.425 -11.952 634 HA GLN 89 HA GLN 89 16.824 28.083 -12.931 635 1HB GLN 89 1HB GLN 89 14.921 29.642 -12.730 636 2HB GLN 89 2HB GLN 89 15.157 29.751 -10.997 637 1HG GLN 89 1HG GLN 89 17.698 30.353 -12.058 638 2HG GLN 89 2HG GLN 89 16.588 31.138 -13.164 639 1HE2 GLN 89 1HE2 GLN 89 18.467 32.172 -11.117 640 2HE2 GLN 89 2HE2 GLN 89 17.547 33.214 -10.084 641 H GLN 90 H GLN 90 16.011 28.059 -9.394 642 HA GLN 90 HA GLN 90 18.474 28.921 -8.527 643 1HB GLN 90 1HB GLN 90 16.465 28.820 -7.095 644 2HB GLN 90 2HB GLN 90 16.471 27.069 -7.164 645 1HG GLN 90 1HG GLN 90 17.967 26.950 -5.464 646 2HG GLN 90 2HG GLN 90 19.099 27.970 -6.330 647 1HE2 GLN 90 1HE2 GLN 90 16.352 27.901 -4.150 648 2HE2 GLN 90 2HE2 GLN 90 16.556 29.473 -3.453 649 H GLN 91 H GLN 91 17.220 25.569 -9.081 650 HA GLN 91 HA GLN 91 19.335 24.178 -8.119 651 1HB GLN 91 1HB GLN 91 17.247 23.134 -8.896 652 2HB GLN 91 2HB GLN 91 17.602 23.573 -10.555 653 1HG GLN 91 1HG GLN 91 19.802 22.073 -9.250 654 2HG GLN 91 2HG GLN 91 18.304 21.167 -9.330 655 1HE2 GLN 91 1HE2 GLN 91 19.324 19.746 -10.785 656 2HE2 GLN 91 2HE2 GLN 91 19.511 20.127 -12.464 657 H ALA 92 H ALA 92 18.896 25.535 -11.454 658 HA ALA 92 HA ALA 92 21.221 24.561 -12.567 659 1HB ALA 92 2HB ALA 92 19.649 25.551 -14.012 660 2HB ALA 92 1HB ALA 92 20.981 26.731 -13.988 661 3HB ALA 92 3HB ALA 92 19.518 27.021 -13.018 662 H LEU 93 H LEU 93 20.713 27.056 -10.132 663 HA LEU 93 HA LEU 93 23.515 27.868 -10.423 664 1HB LEU 93 1HB LEU 93 21.463 29.496 -10.466 665 2HB LEU 93 2HB LEU 93 21.509 29.302 -8.725 666 HG LEU 93 HG LEU 93 24.169 29.864 -9.653 667 1HD1 LEU 93 3HD1 LEU 93 21.999 31.453 -10.939 668 2HD1 LEU 93 1HD1 LEU 93 23.432 32.324 -10.342 669 3HD1 LEU 93 2HD1 LEU 93 23.618 31.018 -11.536 670 1HD2 LEU 93 1HD2 LEU 93 22.205 30.874 -7.698 671 2HD2 LEU 93 2HD2 LEU 93 23.949 30.559 -7.529 672 3HD2 LEU 93 3HD2 LEU 93 23.387 32.075 -8.273 673 H SER 94 H SER 94 23.349 25.360 -9.459 674 HA SER 94 HA SER 94 23.897 25.810 -6.643 675 1HB SER 94 1HB SER 94 21.592 24.725 -7.062 676 2HB SER 94 2HB SER 94 22.462 23.321 -7.649 677 HG SER 94 HG SER 94 22.112 24.248 -5.023 678 H SER 95 H SER 95 23.995 23.341 -9.321 679 HA SER 95 HA SER 95 25.910 21.734 -8.454 680 1HB SER 95 1HB SER 95 26.554 21.387 -10.847 681 2HB SER 95 2HB SER 95 24.819 21.414 -10.608 682 HG SER 95 HG SER 95 24.649 23.380 -11.600 683 H GLN 96 H GLN 96 26.521 24.812 -10.302 684 HA GLN 96 HA GLN 96 29.266 24.664 -10.155 685 1HB GLN 96 1HB GLN 96 27.908 26.185 -11.639 686 2HB GLN 96 2HB GLN 96 27.549 27.183 -10.245 687 1HG GLN 96 1HG GLN 96 29.999 27.574 -9.896 688 2HG GLN 96 2HG GLN 96 30.355 26.579 -11.294 689 1HE2 GLN 96 1HE2 GLN 96 28.467 29.401 -10.260 690 2HE2 GLN 96 2HE2 GLN 96 28.617 30.320 -11.721 691 H MET 97 H MET 97 27.063 26.794 -8.180 692 HA MET 97 HA MET 97 29.114 27.424 -6.380 693 1HB MET 97 1HB MET 97 27.048 28.813 -6.836 694 2HB MET 97 2HB MET 97 26.061 27.578 -6.080 695 1HG MET 97 1HG MET 97 26.553 28.333 -3.985 696 2HG MET 97 2HG MET 97 28.273 28.357 -4.316 697 1HE MET 97 3HE MET 97 25.597 30.005 -3.179 698 2HE MET 97 1HE MET 97 26.909 31.028 -2.545 699 3HE MET 97 2HE MET 97 25.663 31.733 -3.603 700 H GLY 98 H GLY 98 30.034 25.440 -5.604 701 1HA GLY 98 2HA GLY 98 28.361 23.468 -4.336 702 2HA GLY 98 1HA GLY 98 29.222 24.485 -3.198 703 H PHE 99 H PHE 99 30.183 22.231 -2.696 704 HA PHE 99 HA PHE 99 32.572 21.921 -4.364 705 1HB PHE 99 1HB PHE 99 33.192 22.440 -2.103 706 2HB PHE 99 2HB PHE 99 31.812 21.591 -1.435 707 HD1 PHE 99 1HD PHE 99 31.899 19.212 -1.016 708 HD2 PHE 99 2HD PHE 99 35.206 21.213 -2.768 709 HE1 PHE 99 1HE PHE 99 33.350 17.216 -0.556 710 HE2 PHE 99 2HE PHE 99 36.657 19.217 -2.307 711 HZ PHE 99 HZ PHE 99 35.712 17.243 -1.207 712 H MET 601 H MET 601 7.624 -21.968 -18.294 713 HA MET 601 HA MET 601 8.505 -22.653 -20.434 714 1HB MET 601 1HB MET 601 10.441 -24.127 -19.370 715 2HB MET 601 2HB MET 601 10.239 -22.476 -18.819 716 1HG MET 601 1HG MET 601 8.775 -23.355 -16.927 717 2HG MET 601 2HG MET 601 9.165 -24.984 -17.441 718 1HE MET 601 3HE MET 601 10.166 -25.828 -15.454 719 2HE MET 601 1HE MET 601 11.376 -26.238 -16.693 720 3HE MET 601 2HE MET 601 11.900 -25.627 -15.106 721 H THR 602 H THR 602 6.596 -24.946 -18.708 722 HA THR 602 HA THR 602 7.476 -27.296 -20.063 723 HB THR 602 HB THR 602 4.907 -26.616 -18.535 724 HG1 THR 602 1HG THR 602 7.160 -26.433 -17.532 725 1HG2 THR 602 3HG2 THR 602 5.626 -28.977 -19.999 726 2HG2 THR 602 1HG2 THR 602 5.898 -29.340 -18.278 727 3HG2 THR 602 2HG2 THR 602 4.295 -28.797 -18.831 728 H GLU 603 H GLU 603 5.049 -24.752 -20.687 729 HA GLU 603 HA GLU 603 4.856 -25.806 -23.357 730 1HB GLU 603 1HB GLU 603 2.361 -25.302 -21.676 731 2HB GLU 603 2HB GLU 603 2.382 -25.773 -23.364 732 1HG GLU 603 1HG GLU 603 3.598 -27.892 -22.725 733 2HG GLU 603 2HG GLU 603 3.477 -27.427 -21.039 734 HE2 GLU 603 HE GLU 603 0.339 -29.040 -22.837 735 H GLN 604 H GLN 604 5.397 -24.063 -24.593 736 HA GLN 604 HA GLN 604 5.167 -21.459 -23.558 737 1HB GLN 604 1HB GLN 604 6.282 -22.775 -25.947 738 2HB GLN 604 2HB GLN 604 5.596 -21.205 -26.315 739 1HG GLN 604 1HG GLN 604 6.952 -20.163 -24.510 740 2HG GLN 604 2HG GLN 604 7.602 -21.730 -24.070 741 1HE2 GLN 604 1HE2 GLN 604 8.350 -18.991 -25.558 742 2HE2 GLN 604 2HE2 GLN 604 9.472 -19.515 -26.769 743 H GLN 605 H GLN 605 3.073 -23.585 -25.407 744 HA GLN 605 HA GLN 605 1.605 -21.845 -26.867 745 1HB GLN 605 1HB GLN 605 0.679 -24.298 -25.310 746 2HB GLN 605 2HB GLN 605 -0.296 -23.495 -26.525 747 1HG GLN 605 1HG GLN 605 2.213 -23.867 -27.777 748 2HG GLN 605 2HG GLN 605 1.953 -25.349 -26.880 749 1HE2 GLN 605 1HE2 GLN 605 1.909 -24.707 -29.774 750 2HE2 GLN 605 2HE2 GLN 605 0.392 -25.280 -30.384 751 H TRP 606 H TRP 606 1.597 -22.376 -23.343 752 HA TRP 606 HA TRP 606 0.201 -19.921 -22.954 753 1HB TRP 606 1HB TRP 606 -1.805 -20.621 -22.069 754 2HB TRP 606 2HB TRP 606 -1.620 -21.641 -23.482 755 HD1 TRP 606 HD TRP 606 -0.964 -24.293 -22.972 756 HE1 TRP 606 1HE TRP 606 -1.410 -25.896 -20.923 757 HE3 TRP 606 3HE TRP 606 -1.973 -20.598 -19.628 758 HZ2 TRP 606 2HZ TRP 606 -2.118 -25.448 -18.195 759 HZ3 TRP 606 3HZ TRP 606 -2.532 -21.266 -17.292 760 HH2 TRP 606 HH TRP 606 -2.614 -23.595 -16.557 761 H ASN 607 H ASN 607 1.937 -19.270 -21.666 762 HA ASN 607 HA ASN 607 3.202 -21.018 -19.896 763 1HB ASN 607 1HB ASN 607 3.121 -17.966 -20.093 764 2HB ASN 607 2HB ASN 607 4.136 -18.801 -18.934 765 1HD2 ASN 607 1HD2 ASN 607 6.133 -19.075 -19.534 766 2HD2 ASN 607 2HD2 ASN 607 6.733 -19.290 -21.145 767 H PHE 608 H PHE 608 1.509 -21.943 -18.530 768 HA PHE 608 HA PHE 608 -0.490 -20.562 -17.272 769 1HB PHE 608 1HB PHE 608 -0.704 -22.614 -16.084 770 2HB PHE 608 2HB PHE 608 0.273 -23.129 -17.445 771 HD1 PHE 608 1HD PHE 608 2.385 -24.083 -17.100 772 HD2 PHE 608 2HD PHE 608 0.506 -22.001 -13.916 773 HE1 PHE 608 1HE PHE 608 4.155 -24.902 -15.520 774 HE2 PHE 608 2HE PHE 608 2.276 -22.820 -12.336 775 HZ PHE 608 HZ PHE 608 4.079 -24.261 -13.157 776 H ALA 609 H ALA 609 2.944 -21.004 -16.293 777 HA ALA 609 HA ALA 609 2.597 -19.901 -13.712 778 1HB ALA 609 2HB ALA 609 5.139 -19.997 -15.373 779 2HB ALA 609 1HB ALA 609 4.461 -21.425 -14.554 780 3HB ALA 609 3HB ALA 609 4.986 -20.017 -13.600 781 H GLY 610 H GLY 610 2.436 -18.553 -16.850 782 1HA GLY 610 2HA GLY 610 3.072 -16.429 -17.612 783 2HA GLY 610 1HA GLY 610 3.411 -15.925 -15.968 784 H ILE 611 H ILE 611 0.606 -17.249 -17.879 785 HA ILE 611 HA ILE 611 -0.975 -14.998 -17.563 786 HB ILE 611 HB ILE 611 -1.550 -16.439 -19.273 787 1HG1 ILE 611 1HG1 ILE 611 -3.451 -15.712 -17.465 788 2HG1 ILE 611 2HG1 ILE 611 -3.779 -16.436 -19.027 789 1HG2 ILE 611 3HG2 ILE 611 -1.231 -18.625 -17.244 790 2HG2 ILE 611 1HG2 ILE 611 -2.240 -18.891 -18.686 791 3HG2 ILE 611 2HG2 ILE 611 -0.522 -18.461 -18.868 792 1HD1 ILE 611 1HD1 ILE 611 -3.201 -18.267 -16.698 793 2HD1 ILE 611 2HD1 ILE 611 -4.799 -17.491 -16.807 794 3HD1 ILE 611 3HD1 ILE 611 -4.230 -18.545 -18.124 795 H GLU 612 H GLU 612 -0.076 -17.480 -15.291 796 HA GLU 612 HA GLU 612 -2.352 -17.387 -13.689 797 1HB GLU 612 1HB GLU 612 -0.878 -19.224 -13.368 798 2HB GLU 612 2HB GLU 612 0.533 -18.194 -13.229 799 1HG GLU 612 1HG GLU 612 -0.270 -17.320 -11.058 800 2HG GLU 612 2HG GLU 612 -1.759 -18.231 -11.209 801 HE2 GLU 612 HE GLU 612 -0.637 -21.183 -11.203 802 H ALA 613 H ALA 613 0.692 -15.467 -13.769 803 HA ALA 613 HA ALA 613 -0.112 -13.961 -11.439 804 1HB ALA 613 1HB ALA 613 2.299 -14.702 -12.394 805 2HB ALA 613 3HB ALA 613 2.065 -13.236 -11.412 806 3HB ALA 613 2HB ALA 613 2.161 -13.113 -13.185 807 H ALA 614 H ALA 614 -0.572 -13.917 -14.888 808 HA ALA 614 HA ALA 614 -0.679 -11.214 -15.423 809 1HB ALA 614 3HB ALA 614 -2.355 -13.515 -16.507 810 2HB ALA 614 1HB ALA 614 -2.219 -11.907 -17.259 811 3HB ALA 614 2HB ALA 614 -0.786 -12.955 -17.136 812 H ALA 615 H ALA 615 -3.275 -13.431 -14.193 813 HA ALA 615 HA ALA 615 -5.288 -11.531 -14.077 814 1HB ALA 615 3HB ALA 615 -6.386 -13.383 -13.442 815 2HB ALA 615 1HB ALA 615 -4.833 -14.242 -13.312 816 3HB ALA 615 2HB ALA 615 -5.504 -13.398 -11.896 817 H SER 616 H SER 616 -2.972 -12.610 -11.491 818 HA SER 616 HA SER 616 -3.859 -10.957 -9.532 819 1HB SER 616 1HB SER 616 -1.706 -12.702 -9.912 820 2HB SER 616 2HB SER 616 -0.915 -11.168 -9.609 821 HG SER 616 HG SER 616 -1.373 -12.405 -7.645 822 H ALA 617 H ALA 617 -1.985 -10.212 -12.442 823 HA ALA 617 HA ALA 617 -1.041 -7.685 -11.509 824 1HB ALA 617 3HB ALA 617 -0.369 -9.417 -13.531 825 2HB ALA 617 2HB ALA 617 0.154 -7.719 -13.441 826 3HB ALA 617 1HB ALA 617 -1.262 -8.163 -14.424 827 H ILE 618 H ILE 618 -3.908 -8.949 -13.223 828 HA ILE 618 HA ILE 618 -4.839 -6.451 -14.122 829 HB ILE 618 HB ILE 618 -6.238 -9.072 -13.591 830 1HG1 ILE 618 1HG1 ILE 618 -4.449 -9.143 -15.292 831 2HG1 ILE 618 2HG1 ILE 618 -6.038 -9.445 -15.964 832 1HG2 ILE 618 1HG2 ILE 618 -7.836 -7.213 -13.501 833 2HG2 ILE 618 2HG2 ILE 618 -7.267 -6.647 -15.089 834 3HG2 ILE 618 3HG2 ILE 618 -8.077 -8.225 -14.945 835 1HD1 ILE 618 3HD1 ILE 618 -5.441 -6.580 -15.991 836 2HD1 ILE 618 1HD1 ILE 618 -4.183 -7.511 -16.838 837 3HD1 ILE 618 2HD1 ILE 618 -5.884 -7.651 -17.342 838 H GLN 619 H GLN 619 -5.442 -8.408 -11.145 839 HA GLN 619 HA GLN 619 -7.388 -6.808 -10.084 840 1HB GLN 619 1HB GLN 619 -5.617 -8.934 -9.181 841 2HB GLN 619 2HB GLN 619 -5.799 -7.740 -7.913 842 1HG GLN 619 1HG GLN 619 -8.047 -9.205 -9.369 843 2HG GLN 619 2HG GLN 619 -7.573 -9.419 -7.696 844 1HE2 GLN 619 1HE2 GLN 619 -9.974 -8.324 -9.366 845 2HE2 GLN 619 2HE2 GLN 619 -10.475 -6.912 -8.496 846 H GLY 620 H GLY 620 -3.870 -6.783 -9.132 847 1HA GLY 620 2HA GLY 620 -2.518 -5.094 -8.514 848 2HA GLY 620 1HA GLY 620 -3.893 -4.501 -7.604 849 H ASN 621 H ASN 621 -3.836 -4.851 -11.177 850 HA ASN 621 HA ASN 621 -3.166 -2.144 -11.597 851 1HB ASN 621 1HB ASN 621 -4.126 -4.451 -13.312 852 2HB ASN 621 2HB ASN 621 -4.196 -2.835 -13.987 853 1HD2 ASN 621 1HD2 ASN 621 -2.069 -1.541 -13.167 854 2HD2 ASN 621 2HD2 ASN 621 -0.583 -2.300 -13.629 855 H VAL 622 H VAL 622 -6.121 -4.100 -11.197 856 HA VAL 622 HA VAL 622 -7.933 -2.246 -12.304 857 HB VAL 622 HB VAL 622 -8.142 -4.592 -10.430 858 1HG1 VAL 622 1HG1 VAL 622 -10.318 -2.673 -11.279 859 2HG1 VAL 622 2HG1 VAL 622 -10.671 -4.365 -10.855 860 3HG1 VAL 622 3HG1 VAL 622 -9.934 -3.281 -9.651 861 1HG2 VAL 622 3HG2 VAL 622 -7.886 -4.420 -13.175 862 2HG2 VAL 622 1HG2 VAL 622 -8.538 -5.811 -12.275 863 3HG2 VAL 622 2HG2 VAL 622 -9.644 -4.592 -12.954 864 H THR 623 H THR 623 -7.027 -3.023 -8.869 865 HA THR 623 HA THR 623 -8.535 -0.905 -7.785 866 HB THR 623 HB THR 623 -7.085 -1.458 -5.754 867 HG1 THR 623 1HG THR 623 -5.639 -3.361 -6.292 868 1HG2 THR 623 2HG2 THR 623 -9.124 -2.916 -6.515 869 2HG2 THR 623 3HG2 THR 623 -7.902 -4.030 -7.173 870 3HG2 THR 623 1HG2 THR 623 -7.936 -3.677 -5.429 871 H SER 624 H SER 624 -5.215 -1.121 -9.078 872 HA SER 624 HA SER 624 -4.175 1.133 -7.987 873 1HB SER 624 1HB SER 624 -3.794 -0.203 -10.681 874 2HB SER 624 2HB SER 624 -2.909 1.257 -10.290 875 HG SER 624 HG SER 624 -2.902 -1.157 -8.686 876 H ILE 625 H ILE 625 -6.323 0.765 -10.865 877 HA ILE 625 HA ILE 625 -6.212 3.516 -11.552 878 HB ILE 625 HB ILE 625 -7.613 1.080 -12.450 879 1HG1 ILE 625 1HG1 ILE 625 -7.050 2.822 -14.578 880 2HG1 ILE 625 2HG1 ILE 625 -5.731 3.057 -13.448 881 1HG2 ILE 625 1HG2 ILE 625 -8.870 3.805 -12.611 882 2HG2 ILE 625 2HG2 ILE 625 -9.106 2.617 -13.916 883 3HG2 ILE 625 3HG2 ILE 625 -9.614 2.228 -12.255 884 1HD1 ILE 625 2HD1 ILE 625 -6.652 0.249 -14.127 885 2HD1 ILE 625 3HD1 ILE 625 -5.551 1.128 -15.216 886 3HD1 ILE 625 1HD1 ILE 625 -5.063 0.792 -13.537 887 H HIS 626 H HIS 626 -8.193 1.489 -9.395 888 HA HIS 626 HA HIS 626 -10.291 3.302 -9.078 889 1HB HIS 626 1HB HIS 626 -10.278 0.874 -8.459 890 2HB HIS 626 2HB HIS 626 -9.261 1.265 -7.086 891 HD1 HIS 626 1HD HIS 626 -11.110 0.463 -5.422 892 HD2 HIS 626 2HD HIS 626 -12.248 3.681 -7.860 893 HE1 HIS 626 1HE HIS 626 -13.260 1.398 -4.414 894 H SER 627 H SER 627 -7.219 2.788 -7.232 895 HA SER 627 HA SER 627 -7.819 4.914 -5.469 896 1HB SER 627 1HB SER 627 -5.555 3.018 -5.931 897 2HB SER 627 2HB SER 627 -5.125 4.537 -5.170 898 HG SER 627 HG SER 627 -6.469 2.361 -4.112 899 H LEU 628 H LEU 628 -5.946 4.471 -8.494 900 HA LEU 628 HA LEU 628 -4.512 6.845 -8.440 901 1HB LEU 628 1HB LEU 628 -5.357 4.862 -10.467 902 2HB LEU 628 2HB LEU 628 -4.922 6.445 -11.081 903 HG LEU 628 HG LEU 628 -3.088 4.958 -9.206 904 1HD1 LEU 628 2HD1 LEU 628 -3.844 4.117 -11.854 905 2HD1 LEU 628 3HD1 LEU 628 -2.131 4.601 -11.831 906 3HD1 LEU 628 1HD1 LEU 628 -2.721 3.360 -10.699 907 1HD2 LEU 628 3HD2 LEU 628 -2.776 7.413 -9.735 908 2HD2 LEU 628 1HD2 LEU 628 -1.383 6.355 -10.069 909 3HD2 LEU 628 2HD2 LEU 628 -2.415 6.919 -11.406 910 H LEU 629 H LEU 629 -7.822 6.105 -9.697 911 HA LEU 629 HA LEU 629 -8.271 8.717 -10.646 912 1HB LEU 629 1HB LEU 629 -9.682 6.202 -10.436 913 2HB LEU 629 2HB LEU 629 -10.737 7.539 -10.023 914 HG LEU 629 HG LEU 629 -9.265 8.224 -12.396 915 1HD1 LEU 629 3HD1 LEU 629 -10.657 5.535 -12.493 916 2HD1 LEU 629 1HD1 LEU 629 -10.177 6.488 -13.918 917 3HD1 LEU 629 2HD1 LEU 629 -8.936 5.873 -12.799 918 1HD2 LEU 629 1HD2 LEU 629 -11.575 8.958 -11.451 919 2HD2 LEU 629 2HD2 LEU 629 -11.342 8.836 -13.211 920 3HD2 LEU 629 3HD2 LEU 629 -12.189 7.540 -12.334 921 H ASP 630 H ASP 630 -8.615 7.119 -7.479 922 HA ASP 630 HA ASP 630 -10.270 9.014 -6.331 923 1HB ASP 630 1HB ASP 630 -8.693 6.727 -5.512 924 2HB ASP 630 2HB ASP 630 -8.407 8.024 -4.369 925 HD2 ASP 630 HD ASP 630 -10.022 8.584 -3.069 926 H GLU 631 H GLU 631 -6.746 8.818 -6.923 927 HA GLU 631 HA GLU 631 -6.139 10.989 -5.197 928 1HB GLU 631 1HB GLU 631 -4.668 9.106 -6.948 929 2HB GLU 631 2HB GLU 631 -3.958 10.707 -6.895 930 1HG GLU 631 1HG GLU 631 -4.554 8.883 -4.524 931 2HG GLU 631 2HG GLU 631 -2.977 9.383 -5.100 932 HE2 GLU 631 HE GLU 631 -4.127 9.780 -2.583 933 H GLY 632 H GLY 632 -6.715 10.487 -8.707 934 1HA GLY 632 2HA GLY 632 -6.821 11.941 -10.433 935 2HA GLY 632 1HA GLY 632 -5.940 13.122 -9.485 936 H LYS 633 H LYS 633 -9.036 11.488 -8.596 937 HA LYS 633 HA LYS 633 -10.816 13.369 -9.448 938 1HB LYS 633 1HB LYS 633 -11.149 11.066 -8.303 939 2HB LYS 633 2HB LYS 633 -11.121 11.962 -6.798 940 1HG LYS 633 1HG LYS 633 -13.439 11.780 -7.509 941 2HG LYS 633 2HG LYS 633 -12.954 13.454 -7.690 942 1HD LYS 633 1HD LYS 633 -12.264 12.275 -10.160 943 2HD LYS 633 2HD LYS 633 -13.794 11.526 -9.747 944 1HE LYS 633 1HE LYS 633 -13.970 14.354 -9.138 945 2HE LYS 633 2HE LYS 633 -13.337 14.178 -10.763 946 H GLN 634 H GLN 634 -8.689 13.416 -6.562 947 HA GLN 634 HA GLN 634 -9.903 15.638 -5.397 948 1HB GLN 634 1HB GLN 634 -7.149 14.381 -5.137 949 2HB GLN 634 2HB GLN 634 -7.585 15.811 -4.223 950 1HG GLN 634 1HG GLN 634 -9.644 13.680 -4.106 951 2HG GLN 634 2HG GLN 634 -8.097 13.180 -3.453 952 1HE2 GLN 634 1HE2 GLN 634 -7.004 14.906 -2.055 953 2HE2 GLN 634 2HE2 GLN 634 -7.992 15.684 -0.864 954 H SER 635 H SER 635 -7.345 15.228 -7.867 955 HA SER 635 HA SER 635 -6.575 17.941 -7.791 956 1HB SER 635 1HB SER 635 -5.818 15.502 -9.214 957 2HB SER 635 2HB SER 635 -5.882 16.860 -10.320 958 HG SER 635 HG SER 635 -3.801 16.403 -9.041 959 H LEU 636 H LEU 636 -9.223 16.152 -9.172 960 HA LEU 636 HA LEU 636 -9.694 17.721 -11.452 961 1HB LEU 636 1HB LEU 636 -10.930 15.548 -10.016 962 2HB LEU 636 2HB LEU 636 -12.141 16.721 -10.494 963 HG LEU 636 HG LEU 636 -11.799 14.869 -12.122 964 1HD1 LEU 636 2HD1 LEU 636 -11.195 17.659 -13.140 965 2HD1 LEU 636 3HD1 LEU 636 -11.765 16.294 -14.130 966 3HD1 LEU 636 1HD1 LEU 636 -12.804 16.956 -12.845 967 1HD2 LEU 636 2HD2 LEU 636 -9.056 16.113 -12.395 968 2HD2 LEU 636 3HD2 LEU 636 -9.468 14.435 -11.966 969 3HD2 LEU 636 1HD2 LEU 636 -9.775 15.033 -13.614 970 H THR 637 H THR 637 -11.067 17.837 -8.094 971 HA THR 637 HA THR 637 -12.524 20.226 -8.646 972 HB THR 637 HB THR 637 -13.417 18.790 -6.960 973 HG1 THR 637 1HG THR 637 -13.063 20.183 -5.037 974 1HG2 THR 637 3HG2 THR 637 -10.542 18.676 -5.959 975 2HG2 THR 637 1HG2 THR 637 -11.901 18.325 -4.865 976 3HG2 THR 637 2HG2 THR 637 -11.642 17.322 -6.313 977 H LYS 638 H LYS 638 -9.242 19.471 -7.565 978 HA LYS 638 HA LYS 638 -8.801 22.140 -6.601 979 1HB LYS 638 1HB LYS 638 -6.835 19.888 -7.115 980 2HB LYS 638 2HB LYS 638 -6.513 21.363 -6.226 981 1HG LYS 638 1HG LYS 638 -7.897 20.739 -4.412 982 2HG LYS 638 2HG LYS 638 -8.843 19.626 -5.381 983 1HD LYS 638 1HD LYS 638 -7.452 18.240 -4.011 984 2HD LYS 638 2HD LYS 638 -6.726 18.187 -5.605 985 1HE LYS 638 1HE LYS 638 -5.194 18.624 -3.498 986 2HE LYS 638 2HE LYS 638 -4.894 19.514 -4.978 987 H LEU 639 H LEU 639 -8.641 20.386 -9.642 988 HA LEU 639 HA LEU 639 -7.011 22.496 -10.821 989 1HB LEU 639 1HB LEU 639 -7.953 19.814 -11.837 990 2HB LEU 639 2HB LEU 639 -7.096 20.981 -12.825 991 HG LEU 639 HG LEU 639 -5.930 19.949 -10.239 992 1HD1 LEU 639 2HD1 LEU 639 -6.555 18.051 -11.773 993 2HD1 LEU 639 3HD1 LEU 639 -5.416 18.731 -12.960 994 3HD1 LEU 639 1HD1 LEU 639 -4.825 18.177 -11.375 995 1HD2 LEU 639 1HD2 LEU 639 -5.135 21.986 -11.893 996 2HD2 LEU 639 2HD2 LEU 639 -4.080 21.085 -10.777 997 3HD2 LEU 639 3HD2 LEU 639 -4.169 20.615 -12.491 998 H ALA 640 H ALA 640 -10.284 21.673 -10.213 999 HA ALA 640 HA ALA 640 -11.647 22.328 -12.461 1000 1HB ALA 640 2HB ALA 640 -12.639 21.579 -10.323 1001 2HB ALA 640 1HB ALA 640 -13.444 23.045 -10.933 1002 3HB ALA 640 3HB ALA 640 -12.272 23.164 -9.599 1003 H ALA 641 H ALA 641 -9.741 24.444 -10.333 1004 HA ALA 641 HA ALA 641 -10.819 26.883 -11.216 1005 1HB ALA 641 2HB ALA 641 -9.346 27.722 -9.716 1006 2HB ALA 641 3HB ALA 641 -9.015 26.023 -9.301 1007 3HB ALA 641 1HB ALA 641 -7.968 26.876 -10.461 1008 H ALA 642 H ALA 642 -8.479 24.586 -12.570 1009 HA ALA 642 HA ALA 642 -7.247 26.369 -14.364 1010 1HB ALA 642 1HB ALA 642 -6.722 23.878 -13.524 1011 2HB ALA 642 3HB ALA 642 -6.127 24.490 -15.086 1012 3HB ALA 642 2HB ALA 642 -7.581 23.466 -15.027 1013 H TRP 643 H TRP 643 -10.421 24.956 -14.210 1014 HA TRP 643 HA TRP 643 -10.833 25.211 -17.075 1015 1HB TRP 643 1HB TRP 643 -12.398 24.068 -14.788 1016 2HB TRP 643 2HB TRP 643 -13.216 24.496 -16.278 1017 HD1 TRP 643 HD TRP 643 -12.837 22.864 -18.375 1018 HE1 TRP 643 1HE TRP 643 -11.703 20.514 -18.771 1019 HE3 TRP 643 3HE TRP 643 -10.364 22.721 -13.934 1020 HZ2 TRP 643 2HZ TRP 643 -9.939 18.895 -17.217 1021 HZ3 TRP 643 3HZ TRP 643 -8.957 20.720 -13.452 1022 HH2 TRP 643 HH TRP 643 -8.724 18.850 -15.008 1023 H GLY 644 H GLY 644 -11.662 26.720 -13.920 1024 1HA GLY 644 2HA GLY 644 -13.147 28.833 -15.339 1025 2HA GLY 644 1HA GLY 644 -11.776 29.248 -14.329 1026 H GLY 645 H GLY 645 -11.851 28.099 -12.017 1027 1HA GLY 645 2HA GLY 645 -14.285 28.996 -10.788 1028 2HA GLY 645 1HA GLY 645 -12.875 28.310 -10.005 1029 H SER 646 H SER 646 -13.992 26.842 -8.658 1030 HA SER 646 HA SER 646 -14.761 24.451 -9.989 1031 1HB SER 646 1HB SER 646 -15.230 23.729 -7.534 1032 2HB SER 646 2HB SER 646 -13.572 24.066 -7.992 1033 HG SER 646 HG SER 646 -13.625 25.384 -6.296 1034 H GLY 647 H GLY 647 -16.878 23.345 -9.618 1035 1HA GLY 647 2HA GLY 647 -19.073 24.877 -8.559 1036 2HA GLY 647 1HA GLY 647 -19.124 23.280 -9.280 1037 H SER 648 H SER 648 -17.338 25.315 -11.339 1038 HA SER 648 HA SER 648 -19.521 26.603 -12.590 1039 1HB SER 648 1HB SER 648 -16.598 26.524 -12.838 1040 2HB SER 648 2HB SER 648 -17.367 26.537 -14.413 1041 HG SER 648 HG SER 648 -17.685 28.625 -14.128 1042 H GLU 649 H GLU 649 -20.510 26.086 -14.629 1043 HA GLU 649 HA GLU 649 -21.044 23.477 -15.077 1044 1HB GLU 649 1HB GLU 649 -21.940 24.200 -17.271 1045 2HB GLU 649 2HB GLU 649 -22.373 25.329 -16.003 1046 1HG GLU 649 1HG GLU 649 -20.291 26.696 -16.682 1047 2HG GLU 649 2HG GLU 649 -20.171 25.655 -18.087 1048 HE2 GLU 649 HE GLU 649 -21.792 26.684 -19.945 1049 H ALA 650 H ALA 650 -18.410 25.492 -16.466 1050 HA ALA 650 HA ALA 650 -17.543 23.815 -18.458 1051 1HB ALA 650 2HB ALA 650 -16.499 26.031 -16.838 1052 2HB ALA 650 1HB ALA 650 -16.283 25.685 -18.571 1053 3HB ALA 650 3HB ALA 650 -15.226 24.906 -17.369 1054 H TYR 651 H TYR 651 -15.821 24.060 -15.276 1055 HA TYR 651 HA TYR 651 -14.472 21.688 -15.495 1056 1HB TYR 651 1HB TYR 651 -13.868 23.162 -13.713 1057 2HB TYR 651 2HB TYR 651 -15.539 23.522 -13.325 1058 HD1 TYR 651 1HD TYR 651 -16.433 22.641 -11.368 1059 HD2 TYR 651 2HD TYR 651 -13.139 20.635 -13.221 1060 HE1 TYR 651 1HE TYR 651 -16.326 21.006 -9.425 1061 HE2 TYR 651 2HE TYR 651 -13.044 19.006 -11.271 1062 HH TYR 651 HH TYR 651 -15.368 19.264 -8.592 1063 H GLN 652 H GLN 652 -17.854 22.277 -14.538 1064 HA GLN 652 HA GLN 652 -18.299 19.888 -13.240 1065 1HB GLN 652 1HB GLN 652 -20.096 21.776 -14.795 1066 2HB GLN 652 2HB GLN 652 -20.743 20.318 -14.068 1067 1HG GLN 652 1HG GLN 652 -19.054 21.682 -12.131 1068 2HG GLN 652 2HG GLN 652 -20.210 22.823 -12.790 1069 1HE2 GLN 652 1HE2 GLN 652 -20.514 22.366 -10.256 1070 2HE2 GLN 652 2HE2 GLN 652 -21.846 21.324 -9.883 1071 H GLY 653 H GLY 653 -18.871 20.776 -16.720 1072 1HA GLY 653 2HA GLY 653 -18.972 19.513 -18.575 1073 2HA GLY 653 1HA GLY 653 -19.784 18.306 -17.597 1074 H VAL 654 H VAL 654 -16.546 19.347 -16.634 1075 HA VAL 654 HA VAL 654 -15.226 17.269 -18.114 1076 HB VAL 654 HB VAL 654 -14.393 19.339 -16.091 1077 1HG1 VAL 654 2HG1 VAL 654 -13.070 17.315 -15.648 1078 2HG1 VAL 654 3HG1 VAL 654 -12.613 17.233 -17.367 1079 3HG1 VAL 654 1HG1 VAL 654 -12.070 18.600 -16.365 1080 1HG2 VAL 654 2HG2 VAL 654 -14.818 19.556 -18.771 1081 2HG2 VAL 654 3HG2 VAL 654 -13.671 20.560 -17.852 1082 3HG2 VAL 654 1HG2 VAL 654 -13.089 19.132 -18.741 1083 H GLN 655 H GLN 655 -16.258 17.917 -14.719 1084 HA GLN 655 HA GLN 655 -15.044 15.793 -13.532 1085 1HB GLN 655 1HB GLN 655 -17.358 17.547 -12.965 1086 2HB GLN 655 2HB GLN 655 -17.483 15.976 -12.197 1087 1HG GLN 655 1HG GLN 655 -14.766 16.855 -11.869 1088 2HG GLN 655 2HG GLN 655 -15.795 18.214 -11.464 1089 1HE2 GLN 655 1HE2 GLN 655 -14.146 16.707 -9.698 1090 2HE2 GLN 655 2HE2 GLN 655 -15.149 15.970 -8.494 1091 H GLN 656 H GLN 656 -18.203 15.929 -15.279 1092 HA GLN 656 HA GLN 656 -18.887 13.286 -14.686 1093 1HB GLN 656 1HB GLN 656 -19.860 15.443 -16.503 1094 2HB GLN 656 2HB GLN 656 -20.268 13.812 -16.995 1095 1HG GLN 656 1HG GLN 656 -22.041 14.081 -15.566 1096 2HG GLN 656 2HG GLN 656 -20.875 13.646 -14.332 1097 1HE2 GLN 656 1HE2 GLN 656 -21.400 16.577 -16.289 1098 2HE2 GLN 656 2HE2 GLN 656 -21.548 17.696 -14.975 1099 H LYS 657 H LYS 657 -16.834 14.813 -17.140 1100 HA LYS 657 HA LYS 657 -16.803 12.552 -18.875 1101 1HB LYS 657 1HB LYS 657 -15.094 15.045 -18.682 1102 2HB LYS 657 2HB LYS 657 -14.868 13.814 -19.908 1103 1HG LYS 657 1HG LYS 657 -17.026 14.204 -20.872 1104 2HG LYS 657 2HG LYS 657 -17.604 15.059 -19.455 1105 1HD LYS 657 1HD LYS 657 -15.788 16.830 -19.940 1106 2HD LYS 657 2HD LYS 657 -15.540 16.030 -21.480 1107 1HE LYS 657 1HE LYS 657 -18.029 16.332 -21.955 1108 2HE LYS 657 2HE LYS 657 -18.144 17.283 -20.487 1109 H TRP 658 H TRP 658 -15.118 13.566 -15.945 1110 HA TRP 658 HA TRP 658 -12.897 11.812 -16.331 1111 1HB TRP 658 1HB TRP 658 -12.587 13.785 -15.030 1112 2HB TRP 658 2HB TRP 658 -13.926 13.387 -13.972 1113 HD1 TRP 658 HD TRP 658 -13.353 11.882 -11.863 1114 HE1 TRP 658 1HE TRP 658 -11.212 10.729 -10.838 1115 HE3 TRP 658 3HE TRP 658 -10.370 12.622 -15.914 1116 HZ2 TRP 658 2HZ TRP 658 -8.570 10.267 -11.814 1117 HZ3 TRP 658 3HZ TRP 658 -8.024 11.790 -15.796 1118 HH2 TRP 658 HH TRP 658 -7.113 10.647 -13.837 1119 H ASP 659 H ASP 659 -15.808 11.866 -14.141 1120 HA ASP 659 HA ASP 659 -15.370 9.319 -13.157 1121 1HB ASP 659 1HB ASP 659 -17.879 9.455 -12.591 1122 2HB ASP 659 2HB ASP 659 -16.862 10.728 -11.946 1123 HD2 ASP 659 HD ASP 659 -17.432 12.909 -12.726 1124 H ALA 660 H ALA 660 -16.965 10.609 -16.077 1125 HA ALA 660 HA ALA 660 -18.608 8.545 -16.800 1126 1HB ALA 660 3HB ALA 660 -18.792 10.347 -18.211 1127 2HB ALA 660 1HB ALA 660 -17.041 10.669 -18.205 1128 3HB ALA 660 2HB ALA 660 -17.701 9.352 -19.205 1129 H THR 661 H THR 661 -15.622 8.900 -18.737 1130 HA THR 661 HA THR 661 -15.400 6.230 -19.344 1131 HB THR 661 HB THR 661 -13.125 6.877 -20.089 1132 HG1 THR 661 1HG THR 661 -12.486 9.106 -19.307 1133 1HG2 THR 661 1HG2 THR 661 -15.316 8.047 -21.110 1134 2HG2 THR 661 2HG2 THR 661 -14.636 9.490 -20.319 1135 3HG2 THR 661 3HG2 THR 661 -13.694 8.626 -21.558 1136 H ALA 662 H ALA 662 -14.519 7.897 -16.367 1137 HA ALA 662 HA ALA 662 -12.620 6.139 -15.393 1138 1HB ALA 662 3HB ALA 662 -12.862 8.064 -14.130 1139 2HB ALA 662 2HB ALA 662 -13.790 6.920 -13.131 1140 3HB ALA 662 1HB ALA 662 -14.639 8.036 -14.228 1141 H THR 663 H THR 663 -15.897 6.180 -13.911 1142 HA THR 663 HA THR 663 -15.881 3.634 -12.982 1143 HB THR 663 HB THR 663 -17.629 5.146 -12.324 1144 HG1 THR 663 1HG THR 663 -18.927 3.360 -12.444 1145 1HG2 THR 663 3HG2 THR 663 -17.672 5.830 -15.149 1146 2HG2 THR 663 1HG2 THR 663 -19.299 5.303 -14.654 1147 3HG2 THR 663 2HG2 THR 663 -18.503 6.649 -13.804 1148 H GLU 664 H GLU 664 -16.319 4.674 -16.338 1149 HA GLU 664 HA GLU 664 -17.514 2.371 -17.275 1150 1HB GLU 664 1HB GLU 664 -17.401 4.393 -18.626 1151 2HB GLU 664 2HB GLU 664 -15.649 4.366 -18.625 1152 1HG GLU 664 1HG GLU 664 -16.491 3.488 -20.764 1153 2HG GLU 664 2HG GLU 664 -15.669 2.214 -19.886 1154 HE2 GLU 664 HE GLU 664 -18.848 3.571 -20.041 1155 H LEU 665 H LEU 665 -14.021 3.276 -16.955 1156 HA LEU 665 HA LEU 665 -13.198 0.698 -17.924 1157 1HB LEU 665 1HB LEU 665 -11.998 2.833 -18.380 1158 2HB LEU 665 2HB LEU 665 -11.577 2.923 -16.681 1159 HG LEU 665 HG LEU 665 -10.694 0.398 -17.365 1160 1HD1 LEU 665 2HD1 LEU 665 -10.775 2.067 -19.797 1161 2HD1 LEU 665 3HD1 LEU 665 -9.210 1.291 -19.460 1162 3HD1 LEU 665 1HD1 LEU 665 -10.680 0.299 -19.609 1163 1HD2 LEU 665 2HD2 LEU 665 -9.646 2.433 -16.094 1164 2HD2 LEU 665 3HD2 LEU 665 -8.602 1.194 -16.830 1165 3HD2 LEU 665 1HD2 LEU 665 -8.857 2.749 -17.658 1166 H ASN 666 H ASN 666 -13.758 2.348 -14.818 1167 HA ASN 666 HA ASN 666 -12.328 0.641 -13.212 1168 1HB ASN 666 1HB ASN 666 -13.971 2.844 -12.831 1169 2HB ASN 666 2HB ASN 666 -14.962 1.574 -12.141 1170 1HD2 ASN 666 1HD2 ASN 666 -11.615 2.775 -12.187 1171 2HD2 ASN 666 2HD2 ASN 666 -11.249 2.482 -10.520 1172 H ASN 667 H ASN 667 -15.668 0.493 -14.573 1173 HA ASN 667 HA ASN 667 -16.373 -1.804 -13.094 1174 1HB ASN 667 1HB ASN 667 -18.447 -1.671 -14.251 1175 2HB ASN 667 2HB ASN 667 -17.912 -0.002 -14.231 1176 1HD2 ASN 667 1HD2 ASN 667 -18.055 1.033 -16.058 1177 2HD2 ASN 667 2HD2 ASN 667 -17.976 0.370 -17.656 1178 H ALA 668 H ALA 668 -15.092 -1.036 -16.372 1179 HA ALA 668 HA ALA 668 -15.404 -3.607 -17.466 1180 1HB ALA 668 1HB ALA 668 -14.863 -1.209 -18.493 1181 2HB ALA 668 2HB ALA 668 -13.184 -1.769 -18.311 1182 3HB ALA 668 3HB ALA 668 -14.330 -2.701 -19.303 1183 H LEU 669 H LEU 669 -12.695 -1.949 -15.736 1184 HA LEU 669 HA LEU 669 -10.864 -4.037 -16.026 1185 1HB LEU 669 1HB LEU 669 -11.122 -1.545 -14.517 1186 2HB LEU 669 2HB LEU 669 -10.212 -2.774 -13.662 1187 HG LEU 669 HG LEU 669 -9.517 -2.236 -16.524 1188 1HD1 LEU 669 2HD1 LEU 669 -8.752 -0.421 -14.221 1189 2HD1 LEU 669 3HD1 LEU 669 -7.992 -0.411 -15.831 1190 3HD1 LEU 669 1HD1 LEU 669 -9.714 0.008 -15.656 1191 1HD2 LEU 669 3HD2 LEU 669 -8.499 -4.048 -15.010 1192 2HD2 LEU 669 1HD2 LEU 669 -7.392 -3.008 -15.938 1193 3HD2 LEU 669 2HD2 LEU 669 -7.652 -2.706 -14.203 1194 H GLN 670 H GLN 670 -13.279 -3.274 -13.444 1195 HA GLN 670 HA GLN 670 -12.545 -5.334 -11.767 1196 1HB GLN 670 1HB GLN 670 -14.856 -3.513 -12.097 1197 2HB GLN 670 2HB GLN 670 -15.278 -5.039 -11.346 1198 1HG GLN 670 1HG GLN 670 -12.766 -3.994 -10.247 1199 2HG GLN 670 2HG GLN 670 -14.051 -2.811 -10.098 1200 1HE2 GLN 670 1HE2 GLN 670 -13.046 -6.095 -9.373 1201 2HE2 GLN 670 2HE2 GLN 670 -14.120 -6.390 -8.046 1202 H ASN 671 H ASN 671 -15.127 -5.204 -14.320 1203 HA ASN 671 HA ASN 671 -15.998 -7.789 -13.947 1204 1HB ASN 671 1HB ASN 671 -16.729 -5.678 -15.558 1205 2HB ASN 671 2HB ASN 671 -15.981 -6.718 -16.753 1206 1HD2 ASN 671 1HD2 ASN 671 -17.469 -7.776 -17.809 1207 2HD2 ASN 671 2HD2 ASN 671 -18.847 -8.592 -17.151 1208 H LEU 672 H LEU 672 -13.194 -6.387 -15.619 1209 HA LEU 672 HA LEU 672 -12.649 -8.671 -17.233 1210 1HB LEU 672 1HB LEU 672 -11.896 -6.634 -18.071 1211 2HB LEU 672 2HB LEU 672 -11.213 -6.132 -16.537 1212 HG LEU 672 HG LEU 672 -9.910 -8.546 -17.465 1213 1HD1 LEU 672 3HD1 LEU 672 -10.764 -7.200 -19.637 1214 2HD1 LEU 672 1HD1 LEU 672 -9.235 -6.341 -19.328 1215 3HD1 LEU 672 2HD1 LEU 672 -9.232 -8.105 -19.573 1216 1HD2 LEU 672 3HD2 LEU 672 -9.222 -6.601 -15.831 1217 2HD2 LEU 672 1HD2 LEU 672 -8.001 -7.475 -16.786 1218 3HD2 LEU 672 2HD2 LEU 672 -8.569 -5.874 -17.319 1219 H ALA 673 H ALA 673 -11.470 -7.370 -14.078 1220 HA ALA 673 HA ALA 673 -9.612 -9.501 -13.733 1221 1HB ALA 673 2HB ALA 673 -10.134 -6.983 -12.596 1222 2HB ALA 673 3HB ALA 673 -10.451 -8.149 -11.290 1223 3HB ALA 673 1HB ALA 673 -8.870 -8.135 -12.106 1224 H ARG 674 H ARG 674 -13.044 -9.161 -13.441 1225 HA ARG 674 HA ARG 674 -13.373 -10.956 -11.306 1226 1HB ARG 674 1HB ARG 674 -15.162 -9.702 -13.396 1227 2HB ARG 674 2HB ARG 674 -15.787 -11.074 -12.502 1228 1HG ARG 674 1HG ARG 674 -14.641 -9.492 -10.493 1229 2HG ARG 674 2HG ARG 674 -15.308 -8.301 -11.592 1230 1HD ARG 674 1HD ARG 674 -17.029 -10.675 -10.860 1231 2HD ARG 674 2HD ARG 674 -16.808 -9.417 -9.660 1232 HE ARG 674 HE ARG 674 -17.497 -8.335 -12.282 1233 2HH1 ARG 674 1HH ARG 674 -20.786 -7.597 -11.442 1234 1HH2 ARG 674 2HH2 ARG 674 -18.849 -9.730 -9.319 1235 2HH2 ARG 674 1HH2 ARG 674 -20.400 -8.988 -9.530 1236 H THR 675 H THR 675 -13.073 -11.204 -14.851 1237 HA THR 675 HA THR 675 -13.600 -14.092 -14.680 1238 HB THR 675 HB THR 675 -13.588 -12.118 -17.024 1239 HG1 THR 675 1HG THR 675 -15.368 -12.166 -15.341 1240 1HG2 THR 675 2HG2 THR 675 -12.984 -14.614 -17.533 1241 2HG2 THR 675 3HG2 THR 675 -14.642 -14.980 -16.998 1242 3HG2 THR 675 1HG2 THR 675 -14.373 -13.919 -18.403 1243 H ILE 676 H ILE 676 -11.081 -11.814 -14.663 1244 HA ILE 676 HA ILE 676 -9.269 -13.622 -16.062 1245 HB ILE 676 HB ILE 676 -9.148 -10.753 -15.198 1246 1HG1 ILE 676 1HG1 ILE 676 -8.924 -12.241 -17.818 1247 2HG1 ILE 676 2HG1 ILE 676 -10.123 -11.055 -17.339 1248 1HG2 ILE 676 3HG2 ILE 676 -6.928 -12.613 -15.219 1249 2HG2 ILE 676 1HG2 ILE 676 -6.705 -11.331 -16.434 1250 3HG2 ILE 676 2HG2 ILE 676 -6.982 -10.902 -14.729 1251 1HD1 ILE 676 3HD1 ILE 676 -7.934 -9.511 -17.020 1252 2HD1 ILE 676 1HD1 ILE 676 -7.287 -10.641 -18.234 1253 3HD1 ILE 676 2HD1 ILE 676 -8.743 -9.684 -18.596 1254 H SER 677 H SER 677 -9.554 -11.841 -12.908 1255 HA SER 677 HA SER 677 -7.440 -12.875 -11.643 1256 1HB SER 677 1HB SER 677 -9.029 -11.204 -10.696 1257 2HB SER 677 2HB SER 677 -10.222 -12.466 -10.457 1258 HG SER 677 HG SER 677 -7.590 -12.436 -9.243 1259 H GLU 678 H GLU 678 -10.463 -14.518 -12.524 1260 HA GLU 678 HA GLU 678 -10.281 -16.646 -10.768 1261 1HB GLU 678 1HB GLU 678 -11.613 -17.815 -12.746 1262 2HB GLU 678 2HB GLU 678 -12.350 -16.526 -11.815 1263 1HG GLU 678 1HG GLU 678 -12.306 -15.042 -13.573 1264 2HG GLU 678 2HG GLU 678 -10.731 -15.576 -14.124 1265 HE2 GLU 678 HE GLU 678 -10.644 -17.018 -15.588 1266 H ALA 679 H ALA 679 -8.437 -15.816 -13.631 1267 HA ALA 679 HA ALA 679 -7.675 -18.156 -14.713 1268 1HB ALA 679 2HB ALA 679 -5.389 -16.986 -14.962 1269 2HB ALA 679 1HB ALA 679 -6.110 -15.649 -14.034 1270 3HB ALA 679 3HB ALA 679 -6.815 -16.131 -15.596 1271 H GLY 680 H GLY 680 -6.957 -16.950 -11.454 1272 1HA GLY 680 2HA GLY 680 -6.171 -18.070 -9.656 1273 2HA GLY 680 1HA GLY 680 -4.760 -18.312 -10.666 1274 H GLN 681 H GLN 681 -7.897 -19.724 -9.641 1275 HA GLN 681 HA GLN 681 -6.869 -22.295 -10.562 1276 1HB GLN 681 1HB GLN 681 -7.975 -21.445 -7.917 1277 2HB GLN 681 2HB GLN 681 -8.499 -23.014 -8.494 1278 1HG GLN 681 1HG GLN 681 -6.365 -23.937 -8.379 1279 2HG GLN 681 2HG GLN 681 -5.566 -22.419 -8.736 1280 1HE2 GLN 681 1HE2 GLN 681 -5.675 -24.617 -6.499 1281 2HE2 GLN 681 2HE2 GLN 681 -5.575 -23.708 -5.028 1282 H ALA 682 H ALA 682 -9.702 -20.175 -9.966 1283 HA ALA 682 HA ALA 682 -11.805 -21.716 -10.557 1284 1HB ALA 682 1HB ALA 682 -11.049 -18.881 -11.128 1285 2HB ALA 682 2HB ALA 682 -12.492 -19.515 -11.955 1286 3HB ALA 682 3HB ALA 682 -12.404 -19.534 -10.177 1287 H MET 683 H MET 683 -10.012 -19.901 -13.155 1288 HA MET 683 HA MET 683 -11.146 -20.915 -15.304 1289 1HB MET 683 1HB MET 683 -9.164 -19.324 -15.187 1290 2HB MET 683 2HB MET 683 -8.112 -20.693 -14.885 1291 1HG MET 683 1HG MET 683 -9.900 -20.771 -17.323 1292 2HG MET 683 2HG MET 683 -8.475 -19.752 -17.369 1293 1HE MET 683 2HE MET 683 -6.583 -20.414 -18.309 1294 2HE MET 683 3HE MET 683 -5.988 -22.061 -18.624 1295 3HE MET 683 1HE MET 683 -7.443 -21.466 -19.459 1296 H ALA 684 H ALA 684 -9.058 -22.706 -13.062 1297 HA ALA 684 HA ALA 684 -8.882 -24.958 -14.886 1298 1HB ALA 684 1HB ALA 684 -7.447 -25.908 -13.114 1299 2HB ALA 684 2HB ALA 684 -6.913 -24.271 -13.566 1300 3HB ALA 684 3HB ALA 684 -7.829 -24.525 -12.061 1301 H SER 685 H SER 685 -10.389 -23.991 -11.751 1302 HA SER 685 HA SER 685 -11.520 -26.500 -11.286 1303 1HB SER 685 1HB SER 685 -12.052 -23.701 -10.253 1304 2HB SER 685 2HB SER 685 -13.104 -25.023 -9.786 1305 HG SER 685 HG SER 685 -11.389 -26.084 -8.775 1306 H THR 686 H THR 686 -13.517 -23.518 -11.697 1307 HA THR 686 HA THR 686 -14.800 -24.482 -14.062 1308 HB THR 686 HB THR 686 -15.687 -25.827 -11.917 1309 HG1 THR 686 1HG THR 686 -16.479 -25.563 -14.263 1310 1HG2 THR 686 1HG2 THR 686 -16.277 -23.573 -10.745 1311 2HG2 THR 686 2HG2 THR 686 -17.554 -23.413 -11.975 1312 3HG2 THR 686 3HG2 THR 686 -17.575 -24.787 -10.844 1313 H GLU 687 H GLU 687 -16.998 -23.051 -14.288 1314 HA GLU 687 HA GLU 687 -16.488 -20.435 -13.194 1315 1HB GLU 687 1HB GLU 687 -16.475 -19.322 -15.377 1316 2HB GLU 687 2HB GLU 687 -15.170 -20.489 -15.303 1317 1HG GLU 687 1HG GLU 687 -16.149 -20.888 -17.427 1318 2HG GLU 687 2HG GLU 687 -16.815 -22.162 -16.423 1319 HE2 GLU 687 HE GLU 687 -18.761 -22.393 -17.047 1320 H GLY 688 H GLY 688 -18.375 -19.030 -13.284 1321 1HA GLY 688 2HA GLY 688 -20.840 -20.361 -14.216 1322 2HA GLY 688 1HA GLY 688 -20.597 -18.633 -14.059 1323 H ASN 689 H ASN 689 -19.228 -20.689 -11.548 1324 HA ASN 689 HA ASN 689 -21.581 -20.372 -9.915 1325 1HB ASN 689 1HB ASN 689 -19.608 -22.361 -10.124 1326 2HB ASN 689 2HB ASN 689 -19.156 -21.528 -8.650 1327 1HD2 ASN 689 1HD2 ASN 689 -22.060 -22.712 -10.339 1328 2HD2 ASN 689 2HD2 ASN 689 -22.871 -23.363 -8.954 1329 H VAL 690 H VAL 690 -17.974 -19.851 -9.651 1330 HA VAL 690 HA VAL 690 -18.322 -18.020 -7.474 1331 HB VAL 690 HB VAL 690 -15.919 -17.890 -7.506 1332 1HG1 VAL 690 1HG1 VAL 690 -17.341 -20.470 -7.550 1333 2HG1 VAL 690 2HG1 VAL 690 -15.584 -20.600 -7.804 1334 3HG1 VAL 690 3HG1 VAL 690 -16.216 -19.797 -6.346 1335 1HG2 VAL 690 1HG2 VAL 690 -16.251 -18.876 -10.286 1336 2HG2 VAL 690 2HG2 VAL 690 -15.029 -17.786 -9.589 1337 3HG2 VAL 690 3HG2 VAL 690 -14.875 -19.546 -9.378 1338 H THR 691 H THR 691 -18.964 -15.950 -7.734 1339 HA THR 691 HA THR 691 -17.889 -14.483 -10.026 1340 HB THR 691 HB THR 691 -20.806 -14.989 -9.326 1341 HG1 THR 691 1HG THR 691 -20.652 -15.115 -11.770 1342 1HG2 THR 691 1HG2 THR 691 -19.587 -12.601 -10.796 1343 2HG2 THR 691 2HG2 THR 691 -21.251 -13.158 -11.092 1344 3HG2 THR 691 3HG2 THR 691 -20.785 -12.566 -9.479 1345 H GLY 692 H GLY 692 -19.907 -14.241 -7.022 1346 1HA GLY 692 2HA GLY 692 -20.088 -12.452 -5.605 1347 2HA GLY 692 1HA GLY 692 -18.943 -11.544 -6.573 1348 H MET 693 H MET 693 -18.507 -14.869 -5.230 1349 HA MET 693 HA MET 693 -17.120 -14.139 -2.973 1350 1HB MET 693 1HB MET 693 -17.435 -16.572 -4.701 1351 2HB MET 693 2HB MET 693 -16.004 -16.579 -3.689 1352 1HG MET 693 1HG MET 693 -17.605 -17.558 -2.265 1353 2HG MET 693 2HG MET 693 -17.646 -15.885 -1.747 1354 1HE MET 693 3HE MET 693 -19.292 -14.703 -1.429 1355 2HE MET 693 1HE MET 693 -20.050 -14.123 -2.932 1356 3HE MET 693 2HE MET 693 -21.013 -15.032 -1.742 1357 H PHE 694 H PHE 694 -15.845 -15.108 -6.238 1358 HA PHE 694 HA PHE 694 -13.159 -14.592 -5.489 1359 1HB PHE 694 1HB PHE 694 -14.530 -15.950 -7.480 1360 2HB PHE 694 2HB PHE 694 -14.109 -14.491 -8.356 1361 HD1 PHE 694 1HD PHE 694 -13.003 -17.695 -7.371 1362 HD2 PHE 694 2HD PHE 694 -11.593 -13.793 -8.264 1363 HE1 PHE 694 1HE PHE 694 -10.715 -18.624 -7.820 1364 HE2 PHE 694 2HE PHE 694 -9.305 -14.722 -8.713 1365 HZ PHE 694 HZ PHE 694 -8.893 -17.126 -8.486 1366 H ALA 695 H ALA 695 -11.819 -12.820 -5.965 1367 HA ALA 695 HA ALA 695 -11.302 -10.698 -6.308 1368 1HB ALA 695 1HB ALA 695 -12.847 -11.531 -8.588 1369 2HB ALA 695 3HB ALA 695 -11.538 -10.327 -8.510 1370 3HB ALA 695 2HB ALA 695 -13.224 -9.827 -8.234 No H/Q in entry = 1370 Start of MODEL 8 1 H ALA 1 H ALA 1 -2.620 30.825 -2.248 2 HA ALA 1 HA ALA 1 -0.161 31.757 -3.237 3 1HB ALA 1 1HB ALA 1 -1.952 29.645 -3.708 4 2HB ALA 1 2HB ALA 1 -1.907 30.550 -5.240 5 3HB ALA 1 3HB ALA 1 -0.398 29.929 -4.530 6 H GLU 2 H GLU 2 -0.009 32.619 -5.619 7 HA GLU 2 HA GLU 2 -0.829 35.172 -5.655 8 1HB GLU 2 1HB GLU 2 0.541 33.447 -7.390 9 2HB GLU 2 2HB GLU 2 -0.793 34.025 -8.367 10 1HG GLU 2 1HG GLU 2 0.357 36.230 -6.830 11 2HG GLU 2 2HG GLU 2 1.611 35.412 -7.741 12 HE2 GLU 2 HE GLU 2 0.725 36.759 -10.661 13 H MET 3 H MET 3 -2.360 32.611 -7.747 14 HA MET 3 HA MET 3 -4.877 34.020 -7.312 15 1HB MET 3 1HB MET 3 -3.523 33.081 -9.856 16 2HB MET 3 2HB MET 3 -5.273 32.998 -9.795 17 1HG MET 3 1HG MET 3 -4.828 35.542 -8.793 18 2HG MET 3 2HG MET 3 -3.494 35.388 -9.919 19 1HE MET 3 1HE MET 3 -5.603 37.509 -10.169 20 2HE MET 3 2HE MET 3 -4.516 37.344 -11.569 21 3HE MET 3 3HE MET 3 -6.276 37.440 -11.816 22 H LYS 4 H LYS 4 -6.728 32.404 -8.402 23 HA LYS 4 HA LYS 4 -6.408 29.973 -6.843 24 1HB LYS 4 1HB LYS 4 -8.796 29.769 -7.000 25 2HB LYS 4 2HB LYS 4 -8.404 31.413 -6.538 26 1HG LYS 4 1HG LYS 4 -8.417 31.614 -9.304 27 2HG LYS 4 2HG LYS 4 -9.652 30.398 -9.042 28 1HD LYS 4 1HD LYS 4 -11.104 31.887 -8.065 29 2HD LYS 4 2HD LYS 4 -9.834 32.698 -7.171 30 1HE LYS 4 1HE LYS 4 -9.176 34.003 -9.121 31 2HE LYS 4 2HE LYS 4 -10.193 33.047 -10.181 32 H THR 5 H THR 5 -6.330 31.151 -10.142 33 HA THR 5 HA THR 5 -6.375 28.360 -11.088 34 HB THR 5 HB THR 5 -7.125 29.364 -13.253 35 HG1 THR 5 1HG THR 5 -7.642 31.756 -12.980 36 1HG2 THR 5 2HG2 THR 5 -8.689 30.322 -10.800 37 2HG2 THR 5 3HG2 THR 5 -9.302 30.430 -12.468 38 3HG2 THR 5 1HG2 THR 5 -8.987 28.838 -11.737 39 H ASP 6 H ASP 6 -4.342 30.890 -10.243 40 HA ASP 6 HA ASP 6 -2.615 31.324 -12.176 41 1HB ASP 6 1HB ASP 6 -2.557 31.377 -9.360 42 2HB ASP 6 2HB ASP 6 -1.173 30.386 -9.779 43 HD2 ASP 6 HD ASP 6 0.711 33.151 -10.495 44 H ALA 7 H ALA 7 -0.645 30.240 -13.013 45 HA ALA 7 HA ALA 7 -1.006 27.472 -13.429 46 1HB ALA 7 2HB ALA 7 0.797 29.645 -14.286 47 2HB ALA 7 3HB ALA 7 1.585 28.051 -14.196 48 3HB ALA 7 1HB ALA 7 0.140 28.273 -15.211 49 H ALA 8 H ALA 8 0.653 29.420 -11.003 50 HA ALA 8 HA ALA 8 2.467 27.397 -10.183 51 1HB ALA 8 1HB ALA 8 2.247 29.039 -8.033 52 2HB ALA 8 3HB ALA 8 1.576 30.099 -9.295 53 3HB ALA 8 2HB ALA 8 3.219 29.436 -9.471 54 H THR 9 H THR 9 -0.835 28.461 -9.204 55 HA THR 9 HA THR 9 -0.948 26.592 -7.034 56 HB THR 9 HB THR 9 -2.150 28.871 -7.269 57 HG1 THR 9 1HG THR 9 -3.024 27.603 -5.647 58 1HG2 THR 9 2HG2 THR 9 -3.398 27.354 -9.479 59 2HG2 THR 9 3HG2 THR 9 -4.594 27.939 -8.297 60 3HG2 THR 9 1HG2 THR 9 -3.506 29.091 -9.108 61 H LEU 10 H LEU 10 -1.620 26.529 -10.496 62 HA LEU 10 HA LEU 10 -3.311 24.237 -10.334 63 1HB LEU 10 1HB LEU 10 -2.016 25.825 -12.516 64 2HB LEU 10 2HB LEU 10 -2.677 24.243 -12.877 65 HG LEU 10 HG LEU 10 -4.131 26.710 -11.930 66 1HD1 LEU 10 2HD1 LEU 10 -3.661 26.296 -14.379 67 2HD1 LEU 10 3HD1 LEU 10 -4.743 24.887 -14.264 68 3HD1 LEU 10 1HD1 LEU 10 -5.371 26.521 -13.941 69 1HD2 LEU 10 3HD2 LEU 10 -4.976 23.840 -11.685 70 2HD2 LEU 10 1HD2 LEU 10 -5.190 25.195 -10.550 71 3HD2 LEU 10 2HD2 LEU 10 -6.186 25.102 -12.022 72 H ALA 11 H ALA 11 0.107 24.815 -11.426 73 HA ALA 11 HA ALA 11 0.728 22.163 -11.890 74 1HB ALA 11 1HB ALA 11 2.220 24.691 -11.293 75 2HB ALA 11 2HB ALA 11 3.116 23.157 -11.178 76 3HB ALA 11 3HB ALA 11 2.321 23.611 -12.704 77 H GLN 12 H GLN 12 0.465 24.022 -8.866 78 HA GLN 12 HA GLN 12 1.915 22.286 -7.268 79 1HB GLN 12 1HB GLN 12 0.745 24.697 -6.882 80 2HB GLN 12 2HB GLN 12 -0.472 23.695 -6.115 81 1HG GLN 12 1HG GLN 12 0.866 23.244 -4.322 82 2HG GLN 12 2HG GLN 12 2.252 22.888 -5.335 83 1HE2 GLN 12 1HE2 GLN 12 0.320 25.476 -3.918 84 2HE2 GLN 12 2HE2 GLN 12 1.559 26.684 -3.849 85 H GLU 13 H GLU 13 -1.458 22.242 -8.450 86 HA GLU 13 HA GLU 13 -1.951 19.895 -6.820 87 1HB GLU 13 1HB GLU 13 -3.770 21.736 -8.418 88 2HB GLU 13 2HB GLU 13 -4.342 20.215 -7.761 89 1HG GLU 13 1HG GLU 13 -4.640 21.190 -5.739 90 2HG GLU 13 2HG GLU 13 -2.925 21.541 -5.648 91 HE2 GLU 13 HE GLU 13 -5.342 24.430 -7.083 92 H ALA 14 H ALA 14 -1.473 21.013 -10.158 93 HA ALA 14 HA ALA 14 -2.446 18.653 -11.394 94 1HB ALA 14 3HB ALA 14 -1.822 21.182 -12.213 95 2HB ALA 14 1HB ALA 14 -0.386 20.291 -12.774 96 3HB ALA 14 2HB ALA 14 -2.008 19.797 -13.315 97 H GLY 15 H GLY 15 0.775 19.843 -10.290 98 1HA GLY 15 2HA GLY 15 2.655 18.706 -9.796 99 2HA GLY 15 1HA GLY 15 2.443 17.969 -11.372 100 H ASN 16 H ASN 16 0.149 17.614 -8.629 101 HA ASN 16 HA ASN 16 1.233 15.070 -7.946 102 1HB ASN 16 1HB ASN 16 -0.433 15.056 -6.190 103 2HB ASN 16 2HB ASN 16 0.117 16.716 -6.313 104 1HD2 ASN 16 1HD2 ASN 16 -1.509 18.016 -5.962 105 2HD2 ASN 16 2HD2 ASN 16 -3.100 17.915 -6.638 106 H PHE 17 H PHE 17 -1.299 16.472 -9.988 107 HA PHE 17 HA PHE 17 -2.866 14.103 -10.190 108 1HB PHE 17 1HB PHE 17 -3.728 16.430 -10.552 109 2HB PHE 17 2HB PHE 17 -2.564 16.684 -11.837 110 HD1 PHE 17 1HD PHE 17 -5.540 14.678 -10.904 111 HD2 PHE 17 2HD PHE 17 -3.077 16.098 -14.055 112 HE1 PHE 17 1HE PHE 17 -7.214 13.855 -12.584 113 HE2 PHE 17 2HE PHE 17 -4.751 15.276 -15.734 114 HZ PHE 17 HZ PHE 17 -6.800 14.164 -14.979 115 H GLU 18 H GLU 18 -0.621 15.853 -12.458 116 HA GLU 18 HA GLU 18 -0.717 14.303 -14.584 117 1HB GLU 18 1HB GLU 18 1.704 15.517 -13.211 118 2HB GLU 18 2HB GLU 18 1.856 14.701 -14.754 119 1HG GLU 18 1HG GLU 18 -0.326 16.341 -15.226 120 2HG GLU 18 2HG GLU 18 0.605 17.326 -14.115 121 HE2 GLU 18 HE GLU 18 1.037 15.592 -17.197 122 H ARG 19 H ARG 19 0.650 13.393 -11.428 123 HA ARG 19 HA ARG 19 1.978 11.118 -12.406 124 1HB ARG 19 1HB ARG 19 1.937 12.538 -10.008 125 2HB ARG 19 2HB ARG 19 1.098 11.066 -9.562 126 1HG ARG 19 1HG ARG 19 2.959 9.679 -10.155 127 2HG ARG 19 2HG ARG 19 3.715 10.945 -11.102 128 1HD ARG 19 1HD ARG 19 3.608 12.190 -8.656 129 2HD ARG 19 2HD ARG 19 3.738 10.521 -8.138 130 HE ARG 19 HE ARG 19 5.662 10.929 -10.199 131 2HH1 ARG 19 1HH ARG 19 8.368 11.821 -8.212 132 1HH2 ARG 19 2HH2 ARG 19 5.052 11.995 -6.875 133 2HH2 ARG 19 1HH2 ARG 19 6.727 12.253 -6.519 134 H ILE 20 H ILE 20 -1.240 11.807 -10.938 135 HA ILE 20 HA ILE 20 -2.004 9.106 -10.675 136 HB ILE 20 HB ILE 20 -3.726 11.575 -10.915 137 1HG1 ILE 20 1HG1 ILE 20 -2.815 10.339 -8.323 138 2HG1 ILE 20 2HG1 ILE 20 -1.821 11.527 -9.142 139 1HG2 ILE 20 3HG2 ILE 20 -4.521 8.951 -10.932 140 2HG2 ILE 20 1HG2 ILE 20 -4.602 9.357 -9.201 141 3HG2 ILE 20 2HG2 ILE 20 -5.507 10.328 -10.387 142 1HD1 ILE 20 1HD1 ILE 20 -4.212 12.820 -9.269 143 2HD1 ILE 20 2HD1 ILE 20 -4.465 11.868 -7.786 144 3HD1 ILE 20 3HD1 ILE 20 -3.090 12.993 -7.898 145 H SER 21 H SER 21 -2.361 11.583 -13.263 146 HA SER 21 HA SER 21 -4.063 10.092 -14.849 147 1HB SER 21 1HB SER 21 -3.855 12.378 -15.404 148 2HB SER 21 2HB SER 21 -2.104 12.337 -15.359 149 HG SER 21 HG SER 21 -3.535 12.228 -17.528 150 H GLY 22 H GLY 22 -0.447 10.491 -14.984 151 1HA GLY 22 2HA GLY 22 1.167 9.181 -15.834 152 2HA GLY 22 1HA GLY 22 0.031 8.728 -17.089 153 H ASP 23 H ASP 23 -0.250 8.176 -13.525 154 HA ASP 23 HA ASP 23 0.606 5.534 -13.634 155 1HB ASP 23 1HB ASP 23 -0.921 7.257 -11.692 156 2HB ASP 23 2HB ASP 23 -0.981 5.525 -11.435 157 HD2 ASP 23 HD ASP 23 1.474 5.364 -9.650 158 H LEU 24 H LEU 24 -2.610 7.171 -13.826 159 HA LEU 24 HA LEU 24 -4.225 4.926 -13.659 160 1HB LEU 24 1HB LEU 24 -4.452 7.719 -14.446 161 2HB LEU 24 2HB LEU 24 -5.505 6.684 -15.389 162 HG LEU 24 HG LEU 24 -5.436 6.803 -12.361 163 1HD1 LEU 24 3HD1 LEU 24 -6.995 8.297 -14.408 164 2HD1 LEU 24 1HD1 LEU 24 -7.867 7.733 -12.962 165 3HD1 LEU 24 2HD1 LEU 24 -6.446 8.790 -12.788 166 1HD2 LEU 24 3HD2 LEU 24 -6.530 4.857 -14.170 167 2HD2 LEU 24 1HD2 LEU 24 -6.540 4.882 -12.390 168 3HD2 LEU 24 2HD2 LEU 24 -7.848 5.677 -13.299 169 H LYS 25 H LYS 25 -2.673 6.502 -16.523 170 HA LYS 25 HA LYS 25 -3.772 4.661 -18.360 171 1HB LYS 25 1HB LYS 25 -3.125 6.784 -19.178 172 2HB LYS 25 2HB LYS 25 -1.526 6.675 -18.472 173 1HG LYS 25 1HG LYS 25 -0.807 5.025 -20.058 174 2HG LYS 25 2HG LYS 25 -2.448 4.656 -20.549 175 1HD LYS 25 1HD LYS 25 -1.471 6.013 -22.300 176 2HD LYS 25 2HD LYS 25 -2.646 7.013 -21.470 177 1HE LYS 25 1HE LYS 25 -0.960 8.538 -21.272 178 2HE LYS 25 2HE LYS 25 -0.357 7.514 -19.984 179 H THR 26 H THR 26 -0.762 4.801 -16.413 180 HA THR 26 HA THR 26 0.588 2.711 -17.673 181 HB THR 26 HB THR 26 0.602 4.010 -14.926 182 HG1 THR 26 1HG THR 26 1.681 5.108 -16.629 183 1HG2 THR 26 2HG2 THR 26 1.615 1.349 -15.521 184 2HG2 THR 26 3HG2 THR 26 2.987 2.469 -15.340 185 3HG2 THR 26 1HG2 THR 26 1.803 2.291 -14.022 186 H GLN 27 H GLN 27 -1.810 2.669 -14.978 187 HA GLN 27 HA GLN 27 -1.561 -0.093 -14.600 188 1HB GLN 27 1HB GLN 27 -3.860 1.787 -13.896 189 2HB GLN 27 2HB GLN 27 -3.667 0.161 -13.272 190 1HG GLN 27 1HG GLN 27 -1.493 2.271 -12.950 191 2HG GLN 27 2HG GLN 27 -2.800 2.108 -11.794 192 1HE2 GLN 27 1HE2 GLN 27 0.270 1.167 -12.593 193 2HE2 GLN 27 2HE2 GLN 27 0.438 -0.261 -11.626 194 H ILE 28 H ILE 28 -3.769 1.983 -16.552 195 HA ILE 28 HA ILE 28 -5.526 -0.029 -17.333 196 HB ILE 28 HB ILE 28 -4.822 2.704 -18.178 197 1HG1 ILE 28 1HG1 ILE 28 -7.506 1.325 -17.920 198 2HG1 ILE 28 2HG1 ILE 28 -6.647 2.030 -16.565 199 1HG2 ILE 28 2HG2 ILE 28 -5.861 0.660 -20.112 200 2HG2 ILE 28 3HG2 ILE 28 -6.443 2.340 -20.198 201 3HG2 ILE 28 1HG2 ILE 28 -4.705 1.990 -20.366 202 1HD1 ILE 28 2HD1 ILE 28 -6.557 4.222 -17.896 203 2HD1 ILE 28 3HD1 ILE 28 -7.686 3.463 -19.044 204 3HD1 ILE 28 1HD1 ILE 28 -8.174 3.716 -17.351 205 H ASP 29 H ASP 29 -2.580 1.287 -19.002 206 HA ASP 29 HA ASP 29 -2.689 -0.387 -21.151 207 1HB ASP 29 1HB ASP 29 -0.984 1.575 -20.240 208 2HB ASP 29 2HB ASP 29 0.026 0.160 -20.024 209 HD2 ASP 29 HD ASP 29 0.765 1.695 -23.030 210 H GLN 30 H GLN 30 -1.297 -0.815 -17.851 211 HA GLN 30 HA GLN 30 0.137 -3.102 -18.285 212 1HB GLN 30 1HB GLN 30 -1.060 -1.707 -15.961 213 2HB GLN 30 2HB GLN 30 -0.843 -3.427 -15.706 214 1HG GLN 30 1HG GLN 30 1.163 -2.052 -15.033 215 2HG GLN 30 2HG GLN 30 1.534 -3.291 -16.215 216 1HE2 GLN 30 1HE2 GLN 30 2.769 -0.666 -15.526 217 2HE2 GLN 30 2HE2 GLN 30 2.906 0.211 -17.013 218 H VAL 31 H VAL 31 -3.347 -2.710 -17.368 219 HA VAL 31 HA VAL 31 -3.876 -5.457 -17.190 220 HB VAL 31 HB VAL 31 -5.511 -2.963 -17.544 221 1HG1 VAL 31 2HG1 VAL 31 -6.680 -4.692 -18.834 222 2HG1 VAL 31 3HG1 VAL 31 -6.613 -5.792 -17.437 223 3HG1 VAL 31 1HG1 VAL 31 -7.569 -4.294 -17.344 224 1HG2 VAL 31 3HG2 VAL 31 -4.507 -4.506 -15.340 225 2HG2 VAL 31 1HG2 VAL 31 -5.424 -2.981 -15.317 226 3HG2 VAL 31 2HG2 VAL 31 -6.286 -4.539 -15.309 227 H GLU 32 H GLU 32 -4.452 -3.057 -19.858 228 HA GLU 32 HA GLU 32 -5.553 -4.742 -21.652 229 1HB GLU 32 1HB GLU 32 -3.922 -2.245 -21.812 230 2HB GLU 32 2HB GLU 32 -4.045 -3.160 -23.302 231 1HG GLU 32 1HG GLU 32 -6.630 -3.251 -22.733 232 2HG GLU 32 2HG GLU 32 -6.271 -1.907 -21.669 233 HE2 GLU 32 HE GLU 32 -7.426 -0.675 -22.880 234 H SER 33 H SER 33 -2.052 -4.251 -20.927 235 HA SER 33 HA SER 33 -1.209 -5.967 -22.988 236 1HB SER 33 1HB SER 33 -0.006 -4.163 -21.200 237 2HB SER 33 2HB SER 33 0.648 -5.716 -20.719 238 HG SER 33 HG SER 33 1.074 -4.234 -23.069 239 H THR 34 H THR 34 -1.405 -6.303 -19.368 240 HA THR 34 HA THR 34 -0.585 -8.943 -19.218 241 HB THR 34 HB THR 34 -2.131 -6.976 -17.556 242 HG1 THR 34 1HG THR 34 -0.385 -8.040 -16.105 243 1HG2 THR 34 3HG2 THR 34 -3.390 -9.223 -17.336 244 2HG2 THR 34 1HG2 THR 34 -1.860 -9.908 -16.736 245 3HG2 THR 34 2HG2 THR 34 -2.663 -8.600 -15.835 246 H ALA 35 H ALA 35 -3.878 -7.594 -19.791 247 HA ALA 35 HA ALA 35 -5.262 -9.979 -19.644 248 1HB ALA 35 2HB ALA 35 -7.021 -8.770 -20.576 249 2HB ALA 35 3HB ALA 35 -5.992 -7.461 -19.948 250 3HB ALA 35 1HB ALA 35 -5.956 -7.868 -21.680 251 H GLY 36 H GLY 36 -2.926 -8.839 -21.991 252 1HA GLY 36 2HA GLY 36 -2.000 -9.885 -23.758 253 2HA GLY 36 1HA GLY 36 -3.647 -10.029 -24.337 254 H SER 37 H SER 37 -1.891 -11.573 -21.551 255 HA SER 37 HA SER 37 -1.749 -14.056 -22.829 256 1HB SER 37 1HB SER 37 -1.064 -12.899 -20.205 257 2HB SER 37 2HB SER 37 -1.594 -14.564 -20.077 258 HG SER 37 HG SER 37 0.821 -13.810 -20.702 259 H LEU 38 H LEU 38 -4.095 -12.484 -20.623 260 HA LEU 38 HA LEU 38 -5.545 -14.748 -19.913 261 1HB LEU 38 1HB LEU 38 -6.121 -11.813 -20.064 262 2HB LEU 38 2HB LEU 38 -7.423 -12.936 -19.724 263 HG LEU 38 HG LEU 38 -6.806 -12.428 -17.595 264 1HD1 LEU 38 3HD1 LEU 38 -6.419 -14.899 -18.069 265 2HD1 LEU 38 1HD1 LEU 38 -4.679 -14.526 -18.035 266 3HD1 LEU 38 2HD1 LEU 38 -5.680 -14.236 -16.592 267 1HD2 LEU 38 3HD2 LEU 38 -4.323 -11.573 -18.858 268 2HD2 LEU 38 1HD2 LEU 38 -5.152 -10.949 -17.412 269 3HD2 LEU 38 2HD2 LEU 38 -4.052 -12.341 -17.275 270 H GLN 39 H GLN 39 -6.596 -12.242 -22.325 271 HA GLN 39 HA GLN 39 -8.560 -13.730 -23.434 272 1HB GLN 39 1HB GLN 39 -8.066 -12.295 -25.546 273 2HB GLN 39 2HB GLN 39 -8.477 -11.460 -24.061 274 1HG GLN 39 1HG GLN 39 -5.643 -11.858 -23.996 275 2HG GLN 39 2HG GLN 39 -6.023 -11.309 -25.616 276 1HE2 GLN 39 1HE2 GLN 39 -7.588 -10.640 -22.496 277 2HE2 GLN 39 2HE2 GLN 39 -7.388 -8.920 -22.509 278 H GLY 40 H GLY 40 -5.042 -13.884 -24.006 279 1HA GLY 40 2HA GLY 40 -3.815 -15.119 -25.475 280 2HA GLY 40 1HA GLY 40 -5.276 -15.592 -26.319 281 H GLN 41 H GLN 41 -6.003 -16.120 -23.107 282 HA GLN 41 HA GLN 41 -5.403 -18.922 -23.426 283 1HB GLN 41 1HB GLN 41 -3.526 -17.727 -22.086 284 2HB GLN 41 2HB GLN 41 -4.711 -17.541 -20.809 285 1HG GLN 41 1HG GLN 41 -3.683 -20.147 -22.009 286 2HG GLN 41 2HG GLN 41 -3.476 -19.582 -20.363 287 1HE2 GLN 41 1HE2 GLN 41 -5.614 -19.012 -19.241 288 2HE2 GLN 41 2HE2 GLN 41 -6.892 -20.173 -19.372 289 H TRP 42 H TRP 42 -7.459 -19.743 -23.368 290 HA TRP 42 HA TRP 42 -8.976 -19.460 -20.976 291 1HB TRP 42 1HB TRP 42 -9.984 -18.098 -23.477 292 2HB TRP 42 2HB TRP 42 -11.007 -18.536 -22.123 293 HD1 TRP 42 HD TRP 42 -9.201 -15.617 -23.342 294 HE1 TRP 42 1HE TRP 42 -8.726 -13.781 -21.508 295 HE3 TRP 42 3HE TRP 42 -10.181 -18.605 -19.346 296 HZ2 TRP 42 2HZ TRP 42 -8.811 -13.784 -18.655 297 HZ3 TRP 42 3HZ TRP 42 -9.962 -17.610 -17.071 298 HH2 TRP 42 HH TRP 42 -9.303 -15.287 -16.691 299 H ARG 43 H ARG 43 -11.066 -20.816 -21.235 300 HA ARG 43 HA ARG 43 -10.342 -23.073 -22.869 301 1HB ARG 43 1HB ARG 43 -12.342 -22.651 -20.606 302 2HB ARG 43 2HB ARG 43 -12.351 -24.121 -21.561 303 1HG ARG 43 1HG ARG 43 -10.946 -24.697 -19.754 304 2HG ARG 43 2HG ARG 43 -9.797 -24.269 -21.006 305 1HD ARG 43 1HD ARG 43 -8.944 -22.615 -19.705 306 2HD ARG 43 2HD ARG 43 -10.515 -21.845 -19.604 307 HE ARG 43 HE ARG 43 -9.314 -23.653 -17.613 308 2HH1 ARG 43 1HH ARG 43 -11.961 -23.315 -15.390 309 1HH2 ARG 43 2HH2 ARG 43 -12.292 -22.097 -18.739 310 2HH2 ARG 43 1HH2 ARG 43 -13.102 -22.266 -17.218 311 H GLY 44 H GLY 44 -13.687 -22.178 -21.904 312 1HA GLY 44 2HA GLY 44 -14.999 -22.869 -24.155 313 2HA GLY 44 1HA GLY 44 -14.404 -21.269 -24.554 314 H ALA 45 H ALA 45 -14.472 -20.386 -21.647 315 HA ALA 45 HA ALA 45 -17.267 -19.642 -21.658 316 1HB ALA 45 1HB ALA 45 -17.746 -21.380 -20.254 317 2HB ALA 45 2HB ALA 45 -16.052 -21.576 -19.746 318 3HB ALA 45 3HB ALA 45 -17.053 -20.292 -19.028 319 H ALA 46 H ALA 46 -14.125 -19.611 -19.837 320 HA ALA 46 HA ALA 46 -14.646 -17.026 -18.761 321 1HB ALA 46 1HB ALA 46 -12.229 -17.241 -18.051 322 2HB ALA 46 2HB ALA 46 -13.272 -18.588 -17.536 323 3HB ALA 46 3HB ALA 46 -12.175 -18.792 -18.923 324 H GLY 47 H GLY 47 -13.317 -18.326 -21.750 325 1HA GLY 47 2HA GLY 47 -12.492 -17.338 -23.591 326 2HA GLY 47 1HA GLY 47 -11.648 -16.228 -22.530 327 H THR 48 H THR 48 -15.001 -16.878 -23.781 328 HA THR 48 HA THR 48 -15.307 -14.370 -24.937 329 HB THR 48 HB THR 48 -17.765 -15.066 -24.889 330 HG1 THR 48 1HG THR 48 -17.479 -16.157 -22.761 331 1HG2 THR 48 1HG2 THR 48 -15.828 -17.350 -25.539 332 2HG2 THR 48 2HG2 THR 48 -17.488 -17.173 -26.156 333 3HG2 THR 48 3HG2 THR 48 -16.226 -16.022 -26.655 334 H ALA 49 H ALA 49 -15.639 -15.410 -21.575 335 HA ALA 49 HA ALA 49 -17.202 -13.192 -20.761 336 1HB ALA 49 2HB ALA 49 -15.444 -15.216 -19.333 337 2HB ALA 49 3HB ALA 49 -16.341 -13.943 -18.470 338 3HB ALA 49 1HB ALA 49 -17.221 -15.166 -19.417 339 H ALA 50 H ALA 50 -13.661 -13.982 -20.539 340 HA ALA 50 HA ALA 50 -13.028 -11.405 -19.524 341 1HB ALA 50 2HB ALA 50 -11.126 -12.495 -19.035 342 2HB ALA 50 3HB ALA 50 -11.775 -13.933 -19.860 343 3HB ALA 50 1HB ALA 50 -10.792 -12.756 -20.764 344 H GLN 51 H GLN 51 -12.508 -13.048 -22.728 345 HA GLN 51 HA GLN 51 -11.315 -11.113 -24.083 346 1HB GLN 51 1HB GLN 51 -11.822 -13.181 -25.178 347 2HB GLN 51 2HB GLN 51 -13.547 -12.984 -24.944 348 1HG GLN 51 1HG GLN 51 -12.280 -10.753 -26.447 349 2HG GLN 51 2HG GLN 51 -12.162 -12.305 -27.253 350 1HE2 GLN 51 1HE2 GLN 51 -14.196 -9.727 -26.251 351 2HE2 GLN 51 2HE2 GLN 51 -15.687 -10.265 -26.950 352 H ALA 52 H ALA 52 -14.924 -11.361 -23.689 353 HA ALA 52 HA ALA 52 -15.492 -8.972 -25.015 354 1HB ALA 52 1HB ALA 52 -17.248 -10.531 -24.710 355 2HB ALA 52 3HB ALA 52 -17.657 -9.185 -23.619 356 3HB ALA 52 2HB ALA 52 -16.934 -10.674 -22.964 357 H ALA 53 H ALA 53 -15.091 -9.717 -21.484 358 HA ALA 53 HA ALA 53 -15.555 -7.162 -20.549 359 1HB ALA 53 3HB ALA 53 -13.511 -9.054 -19.359 360 2HB ALA 53 2HB ALA 53 -15.252 -9.421 -19.318 361 3HB ALA 53 1HB ALA 53 -14.633 -7.954 -18.523 362 H VAL 54 H VAL 54 -12.742 -8.575 -22.190 363 HA VAL 54 HA VAL 54 -10.945 -6.508 -21.424 364 HB VAL 54 HB VAL 54 -10.859 -8.515 -23.686 365 1HG1 VAL 54 3HG1 VAL 54 -9.340 -6.512 -23.917 366 2HG1 VAL 54 1HG1 VAL 54 -8.541 -7.030 -22.413 367 3HG1 VAL 54 2HG1 VAL 54 -8.511 -8.086 -23.846 368 1HG2 VAL 54 1HG2 VAL 54 -10.866 -9.034 -20.973 369 2HG2 VAL 54 2HG2 VAL 54 -10.191 -10.092 -22.235 370 3HG2 VAL 54 3HG2 VAL 54 -9.130 -8.964 -21.358 371 H VAL 55 H VAL 55 -12.693 -7.303 -24.513 372 HA VAL 55 HA VAL 55 -11.911 -5.115 -25.950 373 HB VAL 55 HB VAL 55 -14.472 -6.706 -25.907 374 1HG1 VAL 55 2HG1 VAL 55 -14.156 -4.169 -27.089 375 2HG1 VAL 55 3HG1 VAL 55 -14.008 -5.344 -28.419 376 3HG1 VAL 55 1HG1 VAL 55 -15.455 -5.350 -27.382 377 1HG2 VAL 55 3HG2 VAL 55 -11.848 -7.200 -26.886 378 2HG2 VAL 55 1HG2 VAL 55 -13.307 -8.202 -27.078 379 3HG2 VAL 55 2HG2 VAL 55 -12.907 -6.969 -28.298 380 H ARG 56 H ARG 56 -14.853 -5.421 -23.837 381 HA ARG 56 HA ARG 56 -15.757 -2.888 -24.201 382 1HB ARG 56 1HB ARG 56 -16.011 -4.974 -22.065 383 2HB ARG 56 2HB ARG 56 -16.451 -3.350 -21.576 384 1HG ARG 56 1HG ARG 56 -18.489 -4.179 -22.415 385 2HG ARG 56 2HG ARG 56 -17.863 -3.290 -23.790 386 1HD ARG 56 1HD ARG 56 -16.755 -5.589 -24.473 387 2HD ARG 56 2HD ARG 56 -17.901 -6.296 -23.351 388 HE ARG 56 HE ARG 56 -19.465 -4.609 -24.918 389 2HH1 ARG 56 1HH ARG 56 -20.036 -6.555 -27.738 390 1HH2 ARG 56 2HH2 ARG 56 -17.256 -7.293 -25.607 391 2HH2 ARG 56 1HH2 ARG 56 -18.092 -7.774 -27.046 392 H PHE 57 H PHE 57 -13.488 -4.150 -21.657 393 HA PHE 57 HA PHE 57 -13.131 -1.734 -20.333 394 1HB PHE 57 1HB PHE 57 -12.288 -3.638 -19.209 395 2HB PHE 57 2HB PHE 57 -11.759 -4.397 -20.698 396 HD1 PHE 57 1HD PHE 57 -10.892 -1.711 -18.289 397 HD2 PHE 57 2HD PHE 57 -9.510 -4.294 -21.359 398 HE1 PHE 57 1HE PHE 57 -8.527 -1.030 -17.797 399 HE2 PHE 57 2HE PHE 57 -7.145 -3.613 -20.867 400 HZ PHE 57 HZ PHE 57 -6.681 -1.989 -19.092 401 H GLN 58 H GLN 58 -11.333 -3.234 -23.091 402 HA GLN 58 HA GLN 58 -9.284 -1.430 -23.194 403 1HB GLN 58 1HB GLN 58 -10.683 -2.984 -25.408 404 2HB GLN 58 2HB GLN 58 -9.213 -2.068 -25.679 405 1HG GLN 58 1HG GLN 58 -8.492 -3.505 -23.445 406 2HG GLN 58 2HG GLN 58 -9.607 -4.631 -24.194 407 1HE2 GLN 58 1HE2 GLN 58 -7.305 -2.244 -25.495 408 2HE2 GLN 58 2HE2 GLN 58 -6.395 -3.334 -26.488 409 H GLU 59 H GLU 59 -12.378 -1.376 -25.115 410 HA GLU 59 HA GLU 59 -11.928 1.013 -26.347 411 1HB GLU 59 1HB GLU 59 -14.427 -0.490 -25.551 412 2HB GLU 59 2HB GLU 59 -14.581 1.101 -26.269 413 1HG GLU 59 1HG GLU 59 -12.952 -1.152 -27.531 414 2HG GLU 59 2HG GLU 59 -14.633 -0.847 -27.922 415 HE2 GLU 59 HE GLU 59 -11.871 1.273 -29.693 416 H ALA 60 H ALA 60 -13.058 0.312 -23.038 417 HA ALA 60 HA ALA 60 -13.897 2.993 -22.524 418 1HB ALA 60 1HB ALA 60 -13.431 0.498 -20.868 419 2HB ALA 60 3HB ALA 60 -14.969 1.301 -21.265 420 3HB ALA 60 2HB ALA 60 -13.843 2.057 -20.113 421 H ALA 61 H ALA 61 -10.883 1.131 -22.379 422 HA ALA 61 HA ALA 61 -9.475 2.667 -20.557 423 1HB ALA 61 2HB ALA 61 -9.010 0.480 -22.199 424 2HB ALA 61 3HB ALA 61 -7.920 1.718 -22.869 425 3HB ALA 61 1HB ALA 61 -7.803 1.265 -21.152 426 H ASN 62 H ASN 62 -9.631 2.971 -24.178 427 HA ASN 62 HA ASN 62 -8.057 5.180 -24.369 428 1HB ASN 62 1HB ASN 62 -10.529 4.934 -26.110 429 2HB ASN 62 2HB ASN 62 -8.903 5.384 -26.583 430 1HD2 ASN 62 1HD2 ASN 62 -10.958 2.736 -25.502 431 2HD2 ASN 62 2HD2 ASN 62 -10.046 1.433 -26.188 432 H LYS 63 H LYS 63 -11.673 4.916 -24.033 433 HA LYS 63 HA LYS 63 -12.322 7.569 -24.132 434 1HB LYS 63 1HB LYS 63 -13.551 5.311 -22.528 435 2HB LYS 63 2HB LYS 63 -14.288 6.891 -22.701 436 1HG LYS 63 1HG LYS 63 -13.401 5.632 -25.260 437 2HG LYS 63 2HG LYS 63 -14.698 4.791 -24.436 438 1HD LYS 63 1HD LYS 63 -14.708 7.761 -25.156 439 2HD LYS 63 2HD LYS 63 -15.559 6.508 -26.036 440 1HE LYS 63 1HE LYS 63 -16.545 5.995 -23.558 441 2HE LYS 63 2HE LYS 63 -16.178 7.695 -23.343 442 H GLN 64 H GLN 64 -10.991 5.654 -21.399 443 HA GLN 64 HA GLN 64 -11.285 7.790 -19.577 444 1HB GLN 64 1HB GLN 64 -10.625 5.032 -19.464 445 2HB GLN 64 2HB GLN 64 -9.223 5.867 -18.825 446 1HG GLN 64 1HG GLN 64 -11.842 6.915 -17.854 447 2HG GLN 64 2HG GLN 64 -11.486 5.271 -17.362 448 1HE2 GLN 64 1HE2 GLN 64 -10.496 8.612 -17.244 449 2HE2 GLN 64 2HE2 GLN 64 -9.379 8.497 -15.925 450 H LYS 65 H LYS 65 -8.724 6.602 -21.776 451 HA LYS 65 HA LYS 65 -6.683 8.233 -20.676 452 1HB LYS 65 1HB LYS 65 -7.015 6.348 -22.914 453 2HB LYS 65 2HB LYS 65 -5.898 7.655 -23.249 454 1HG LYS 65 1HG LYS 65 -4.386 6.320 -22.158 455 2HG LYS 65 2HG LYS 65 -5.094 7.016 -20.714 456 1HD LYS 65 1HD LYS 65 -5.316 4.759 -20.198 457 2HD LYS 65 2HD LYS 65 -6.857 5.027 -20.987 458 1HE LYS 65 1HE LYS 65 -5.962 3.037 -21.987 459 2HE LYS 65 2HE LYS 65 -5.749 4.298 -23.185 460 H GLN 66 H GLN 66 -9.211 8.625 -23.166 461 HA GLN 66 HA GLN 66 -8.121 10.925 -24.300 462 1HB GLN 66 1HB GLN 66 -10.283 9.259 -24.813 463 2HB GLN 66 2HB GLN 66 -11.078 10.736 -24.307 464 1HG GLN 66 1HG GLN 66 -10.810 11.211 -26.565 465 2HG GLN 66 2HG GLN 66 -9.311 11.884 -25.956 466 1HE2 GLN 66 1HE2 GLN 66 -10.793 9.559 -27.948 467 2HE2 GLN 66 2HE2 GLN 66 -9.385 8.724 -28.514 468 H GLU 67 H GLU 67 -10.771 10.476 -21.848 469 HA GLU 67 HA GLU 67 -11.018 13.230 -21.407 470 1HB GLU 67 1HB GLU 67 -12.057 10.716 -20.150 471 2HB GLU 67 2HB GLU 67 -12.106 12.160 -19.159 472 1HG GLU 67 1HG GLU 67 -14.195 11.770 -20.552 473 2HG GLU 67 2HG GLU 67 -13.462 13.346 -20.772 474 HE2 GLU 67 HE GLU 67 -12.794 13.691 -23.194 475 H LEU 68 H LEU 68 -8.885 10.708 -20.156 476 HA LEU 68 HA LEU 68 -8.135 12.156 -17.813 477 1HB LEU 68 1HB LEU 68 -8.058 9.759 -17.835 478 2HB LEU 68 2HB LEU 68 -6.988 9.748 -19.223 479 HG LEU 68 HG LEU 68 -5.411 11.137 -17.592 480 1HD1 LEU 68 1HD1 LEU 68 -7.525 10.130 -15.837 481 2HD1 LEU 68 2HD1 LEU 68 -5.890 9.650 -15.321 482 3HD1 LEU 68 3HD1 LEU 68 -6.281 11.371 -15.551 483 1HD2 LEU 68 3HD2 LEU 68 -5.428 8.601 -18.611 484 2HD2 LEU 68 1HD2 LEU 68 -4.114 9.311 -17.642 485 3HD2 LEU 68 2HD2 LEU 68 -5.344 8.289 -16.861 486 H ASP 69 H ASP 69 -6.750 11.607 -21.107 487 HA ASP 69 HA ASP 69 -4.438 13.068 -20.597 488 1HB ASP 69 1HB ASP 69 -4.917 11.433 -22.521 489 2HB ASP 69 2HB ASP 69 -5.841 12.712 -23.283 490 HD2 ASP 69 HD ASP 69 -3.378 14.638 -24.222 491 H GLU 70 H GLU 70 -7.577 13.841 -22.273 492 HA GLU 70 HA GLU 70 -7.016 16.387 -23.026 493 1HB GLU 70 1HB GLU 70 -9.299 16.593 -23.452 494 2HB GLU 70 2HB GLU 70 -9.131 14.850 -23.379 495 1HG GLU 70 1HG GLU 70 -9.866 14.847 -21.009 496 2HG GLU 70 2HG GLU 70 -9.956 16.597 -21.012 497 HE2 GLU 70 HE GLU 70 -11.448 17.179 -23.254 498 H ILE 71 H ILE 71 -8.362 15.220 -19.871 499 HA ILE 71 HA ILE 71 -8.658 17.771 -18.755 500 HB ILE 71 HB ILE 71 -8.502 14.975 -17.694 501 1HG1 ILE 71 1HG1 ILE 71 -10.703 17.047 -17.509 502 2HG1 ILE 71 2HG1 ILE 71 -10.549 15.923 -18.844 503 1HG2 ILE 71 2HG2 ILE 71 -7.949 17.419 -16.184 504 2HG2 ILE 71 3HG2 ILE 71 -9.311 16.479 -15.528 505 3HG2 ILE 71 1HG2 ILE 71 -7.719 15.711 -15.738 506 1HD1 ILE 71 3HD1 ILE 71 -10.506 14.849 -16.017 507 2HD1 ILE 71 1HD1 ILE 71 -12.058 15.297 -16.764 508 3HD1 ILE 71 2HD1 ILE 71 -11.036 14.048 -17.516 509 H SER 72 H SER 72 -6.003 15.312 -18.493 510 HA SER 72 HA SER 72 -4.414 16.859 -16.852 511 1HB SER 72 1HB SER 72 -2.684 15.278 -17.314 512 2HB SER 72 2HB SER 72 -4.182 14.376 -17.417 513 HG SER 72 HG SER 72 -3.888 15.199 -19.876 514 H THR 73 H THR 73 -5.239 17.184 -20.212 515 HA THR 73 HA THR 73 -2.845 18.752 -20.801 516 HB THR 73 HB THR 73 -5.177 17.645 -22.440 517 HG1 THR 73 1HG THR 73 -3.310 16.438 -23.274 518 1HG2 THR 73 2HG2 THR 73 -3.883 19.984 -23.126 519 2HG2 THR 73 3HG2 THR 73 -2.760 18.773 -23.790 520 3HG2 THR 73 1HG2 THR 73 -4.460 18.793 -24.317 521 H ASN 74 H ASN 74 -6.314 19.085 -20.104 522 HA ASN 74 HA ASN 74 -6.807 21.534 -21.094 523 1HB ASN 74 1HB ASN 74 -7.760 19.946 -18.752 524 2HB ASN 74 2HB ASN 74 -8.053 21.667 -18.607 525 1HD2 ASN 74 1HD2 ASN 74 -8.720 18.752 -20.374 526 2HD2 ASN 74 2HD2 ASN 74 -10.062 19.319 -21.310 527 H ILE 75 H ILE 75 -5.449 20.707 -17.810 528 HA ILE 75 HA ILE 75 -5.079 23.283 -16.906 529 HB ILE 75 HB ILE 75 -3.314 20.913 -16.303 530 1HG1 ILE 75 1HG1 ILE 75 -5.343 21.095 -14.366 531 2HG1 ILE 75 2HG1 ILE 75 -6.171 21.234 -15.904 532 1HG2 ILE 75 2HG2 ILE 75 -2.899 23.386 -15.460 533 2HG2 ILE 75 3HG2 ILE 75 -4.164 22.948 -14.287 534 3HG2 ILE 75 1HG2 ILE 75 -2.672 21.983 -14.389 535 1HD1 ILE 75 1HD1 ILE 75 -4.752 19.197 -16.671 536 2HD1 ILE 75 2HD1 ILE 75 -4.366 18.984 -14.946 537 3HD1 ILE 75 3HD1 ILE 75 -6.056 18.890 -15.498 538 H ARG 76 H ARG 76 -2.847 21.160 -18.808 539 HA ARG 76 HA ARG 76 -0.696 22.791 -18.820 540 1HB ARG 76 1HB ARG 76 -1.779 21.055 -21.096 541 2HB ARG 76 2HB ARG 76 -0.154 21.710 -21.061 542 1HG ARG 76 1HG ARG 76 -0.116 20.550 -18.630 543 2HG ARG 76 2HG ARG 76 -1.370 19.552 -19.340 544 1HD ARG 76 1HD ARG 76 0.926 19.925 -21.164 545 2HD ARG 76 2HD ARG 76 1.397 19.187 -19.646 546 HE ARG 76 HE ARG 76 -0.829 17.731 -20.275 547 2HH1 ARG 76 1HH ARG 76 0.185 15.603 -22.827 548 1HH2 ARG 76 2HH2 ARG 76 2.001 18.625 -22.210 549 2HH2 ARG 76 1HH2 ARG 76 1.920 17.212 -23.208 550 H GLN 77 H GLN 77 -3.651 22.906 -20.881 551 HA GLN 77 HA GLN 77 -2.621 24.995 -22.494 552 1HB GLN 77 1HB GLN 77 -5.436 23.871 -22.161 553 2HB GLN 77 2HB GLN 77 -5.005 25.077 -23.357 554 1HG GLN 77 1HG GLN 77 -3.115 22.851 -23.459 555 2HG GLN 77 2HG GLN 77 -4.756 22.250 -23.590 556 1HE2 GLN 77 1HE2 GLN 77 -5.143 21.875 -25.637 557 2HE2 GLN 77 2HE2 GLN 77 -4.863 22.947 -26.969 558 H ALA 78 H ALA 78 -4.070 24.775 -19.353 559 HA ALA 78 HA ALA 78 -5.455 27.215 -19.295 560 1HB ALA 78 2HB ALA 78 -4.137 26.207 -16.819 561 2HB ALA 78 3HB ALA 78 -5.835 26.651 -17.112 562 3HB ALA 78 1HB ALA 78 -5.223 25.070 -17.653 563 H GLY 79 H GLY 79 -2.056 26.389 -19.338 564 1HA GLY 79 2HA GLY 79 -1.407 29.209 -18.719 565 2HA GLY 79 1HA GLY 79 -0.590 28.233 -19.924 566 H VAL 80 H VAL 80 -0.951 25.824 -17.915 567 HA VAL 80 HA VAL 80 1.047 26.640 -15.948 568 HB VAL 80 HB VAL 80 -0.318 23.973 -16.033 569 1HG1 VAL 80 2HG1 VAL 80 1.320 25.492 -14.175 570 2HG1 VAL 80 3HG1 VAL 80 -0.222 25.006 -13.429 571 3HG1 VAL 80 1HG1 VAL 80 0.850 23.776 -14.139 572 1HG2 VAL 80 3HG2 VAL 80 -1.582 26.623 -15.405 573 2HG2 VAL 80 1HG2 VAL 80 -2.267 25.194 -16.216 574 3HG2 VAL 80 2HG2 VAL 80 -2.040 25.191 -14.451 575 H GLN 81 H GLN 81 2.943 26.718 -17.214 576 HA GLN 81 HA GLN 81 3.882 24.080 -17.931 577 1HB GLN 81 1HB GLN 81 4.942 25.310 -20.039 578 2HB GLN 81 2HB GLN 81 3.326 24.636 -20.111 579 1HG GLN 81 1HG GLN 81 2.312 26.704 -20.181 580 2HG GLN 81 2HG GLN 81 3.451 27.422 -19.060 581 1HE2 GLN 81 1HE2 GLN 81 5.127 28.572 -19.778 582 2HE2 GLN 81 2HE2 GLN 81 5.539 28.833 -21.440 583 H TYR 82 H TYR 82 4.242 26.572 -15.969 584 HA TYR 82 HA TYR 82 7.115 26.262 -15.846 585 1HB TYR 82 1HB TYR 82 7.441 28.729 -15.948 586 2HB TYR 82 2HB TYR 82 6.594 28.228 -17.398 587 HD1 TYR 82 1HD TYR 82 3.975 28.386 -17.325 588 HD2 TYR 82 2HD TYR 82 6.575 30.461 -14.636 589 HE1 TYR 82 1HE TYR 82 2.125 30.051 -16.810 590 HE2 TYR 82 2HE TYR 82 4.716 32.120 -14.130 591 HH TYR 82 HH TYR 82 1.854 31.743 -14.368 592 H SER 83 H SER 83 6.467 25.119 -13.877 593 HA SER 83 HA SER 83 5.879 27.043 -11.776 594 1HB SER 83 1HB SER 83 3.956 25.341 -12.562 595 2HB SER 83 2HB SER 83 4.829 24.230 -11.526 596 HG SER 83 HG SER 83 3.683 25.136 -9.956 597 H ARG 84 H ARG 84 6.782 23.558 -12.357 598 HA ARG 84 HA ARG 84 8.517 23.697 -10.082 599 1HB ARG 84 1HB ARG 84 7.282 21.575 -11.751 600 2HB ARG 84 2HB ARG 84 8.933 21.206 -11.292 601 1HG ARG 84 1HG ARG 84 8.306 21.751 -8.880 602 2HG ARG 84 2HG ARG 84 6.641 21.913 -9.402 603 1HD ARG 84 1HD ARG 84 8.243 19.384 -9.970 604 2HD ARG 84 2HD ARG 84 7.385 19.602 -8.458 605 HE ARG 84 HE ARG 84 5.323 19.390 -9.593 606 2HH1 ARG 84 1HH ARG 84 4.670 18.681 -12.930 607 1HH2 ARG 84 2HH2 ARG 84 7.974 19.629 -11.932 608 2HH2 ARG 84 1HH2 ARG 84 6.990 19.172 -13.282 609 H ALA 85 H ALA 85 8.960 25.172 -12.781 610 HA ALA 85 HA ALA 85 11.194 23.888 -13.987 611 1HB ALA 85 1HB ALA 85 10.066 26.711 -14.155 612 2HB ALA 85 3HB ALA 85 9.742 25.359 -15.267 613 3HB ALA 85 2HB ALA 85 11.368 26.081 -15.193 614 H ASP 86 H ASP 86 11.978 23.623 -11.500 615 HA ASP 86 HA ASP 86 13.490 25.977 -10.771 616 1HB ASP 86 1HB ASP 86 12.835 23.351 -9.381 617 2HB ASP 86 2HB ASP 86 14.072 24.419 -8.746 618 HD2 ASP 86 HD ASP 86 10.230 25.522 -8.444 619 H GLU 87 H GLU 87 13.771 22.518 -11.740 620 HA GLU 87 HA GLU 87 16.637 22.643 -11.555 621 1HB GLU 87 1HB GLU 87 14.765 20.599 -11.269 622 2HB GLU 87 2HB GLU 87 15.444 20.266 -12.850 623 1HG GLU 87 1HG GLU 87 17.775 20.604 -11.707 624 2HG GLU 87 2HG GLU 87 16.907 20.463 -10.191 625 HE2 GLU 87 HE GLU 87 17.953 17.132 -11.045 626 H GLU 88 H GLU 88 14.620 24.050 -13.622 627 HA GLU 88 HA GLU 88 15.062 23.061 -16.107 628 1HB GLU 88 1HB GLU 88 13.700 25.159 -15.179 629 2HB GLU 88 2HB GLU 88 15.126 26.048 -15.677 630 1HG GLU 88 1HG GLU 88 13.810 24.081 -17.580 631 2HG GLU 88 2HG GLU 88 13.165 25.700 -17.401 632 HE2 GLU 88 HE GLU 88 14.599 25.471 -20.048 633 H GLN 89 H GLN 89 17.264 24.866 -13.978 634 HA GLN 89 HA GLN 89 19.144 25.186 -16.142 635 1HB GLN 89 1HB GLN 89 18.596 26.914 -14.231 636 2HB GLN 89 2HB GLN 89 19.670 25.934 -13.253 637 1HG GLN 89 1HG GLN 89 21.457 26.195 -15.025 638 2HG GLN 89 2HG GLN 89 20.384 27.258 -15.912 639 1HE2 GLN 89 1HE2 GLN 89 20.426 29.340 -15.501 640 2HE2 GLN 89 2HE2 GLN 89 21.139 30.115 -14.127 641 H GLN 90 H GLN 90 18.271 22.510 -14.862 642 HA GLN 90 HA GLN 90 20.047 21.419 -13.218 643 1HB GLN 90 1HB GLN 90 19.684 19.255 -14.529 644 2HB GLN 90 2HB GLN 90 18.229 20.091 -14.023 645 1HG GLN 90 1HG GLN 90 18.615 21.281 -16.459 646 2HG GLN 90 2HG GLN 90 19.349 19.722 -16.777 647 1HE2 GLN 90 1HE2 GLN 90 18.091 18.147 -17.409 648 2HE2 GLN 90 2HE2 GLN 90 16.376 18.026 -17.199 649 H GLN 91 H GLN 91 20.562 22.216 -16.674 650 HA GLN 91 HA GLN 91 22.760 20.822 -17.263 651 1HB GLN 91 1HB GLN 91 21.425 23.024 -18.335 652 2HB GLN 91 2HB GLN 91 23.034 23.657 -18.049 653 1HG GLN 91 1HG GLN 91 23.867 21.434 -19.190 654 2HG GLN 91 2HG GLN 91 22.223 21.298 -19.782 655 1HE2 GLN 91 1HE2 GLN 91 23.659 21.427 -21.782 656 2HE2 GLN 91 2HE2 GLN 91 23.861 22.988 -22.505 657 H ALA 92 H ALA 92 22.717 24.022 -15.538 658 HA ALA 92 HA ALA 92 25.332 24.487 -15.197 659 1HB ALA 92 1HB ALA 92 24.687 25.544 -13.031 660 2HB ALA 92 2HB ALA 92 23.552 25.931 -14.347 661 3HB ALA 92 3HB ALA 92 23.114 24.715 -13.123 662 H LEU 93 H LEU 93 23.353 22.443 -12.925 663 HA LEU 93 HA LEU 93 25.716 21.485 -11.646 664 1HB LEU 93 1HB LEU 93 23.405 21.860 -10.641 665 2HB LEU 93 2HB LEU 93 22.926 20.368 -11.426 666 HG LEU 93 HG LEU 93 25.385 20.154 -9.804 667 1HD1 LEU 93 2HD1 LEU 93 22.740 20.884 -8.533 668 2HD1 LEU 93 3HD1 LEU 93 24.046 20.043 -7.664 669 3HD1 LEU 93 1HD1 LEU 93 24.323 21.672 -8.326 670 1HD2 LEU 93 3HD2 LEU 93 22.886 18.546 -10.278 671 2HD2 LEU 93 1HD2 LEU 93 24.583 18.131 -10.618 672 3HD2 LEU 93 2HD2 LEU 93 23.992 18.154 -8.940 673 H SER 94 H SER 94 26.553 20.954 -14.005 674 HA SER 94 HA SER 94 25.532 18.416 -14.897 675 1HB SER 94 1HB SER 94 26.987 20.643 -16.074 676 2HB SER 94 2HB SER 94 27.853 19.151 -16.383 677 HG SER 94 HG SER 94 26.399 18.694 -17.873 678 H SER 95 H SER 95 28.605 19.900 -13.672 679 HA SER 95 HA SER 95 30.069 17.546 -13.752 680 1HB SER 95 1HB SER 95 31.609 18.746 -12.170 681 2HB SER 95 2HB SER 95 31.180 19.695 -13.579 682 HG SER 95 HG SER 95 29.624 20.852 -12.303 683 H GLN 96 H GLN 96 28.038 19.092 -11.200 684 HA GLN 96 HA GLN 96 28.617 16.887 -9.434 685 1HB GLN 96 1HB GLN 96 28.284 19.529 -8.918 686 2HB GLN 96 2HB GLN 96 26.628 19.005 -8.692 687 1HG GLN 96 1HG GLN 96 27.481 17.194 -7.122 688 2HG GLN 96 2HG GLN 96 29.086 17.881 -7.270 689 1HE2 GLN 96 1HE2 GLN 96 26.356 17.817 -5.455 690 2HE2 GLN 96 2HE2 GLN 96 26.477 19.319 -4.601 691 H MET 97 H MET 97 27.118 16.473 -11.983 692 HA MET 97 HA MET 97 24.449 16.400 -11.774 693 1HB MET 97 1HB MET 97 24.607 14.371 -13.300 694 2HB MET 97 2HB MET 97 25.670 15.676 -13.788 695 1HG MET 97 1HG MET 97 27.470 14.456 -12.287 696 2HG MET 97 2HG MET 97 26.400 13.073 -12.404 697 1HE MET 97 2HE MET 97 28.395 11.780 -13.484 698 2HE MET 97 3HE MET 97 29.206 12.245 -15.000 699 3HE MET 97 1HE MET 97 29.452 13.211 -13.525 700 H GLY 98 H GLY 98 22.997 14.343 -11.514 701 1HA GLY 98 2HA GLY 98 22.019 13.153 -9.818 702 2HA GLY 98 1HA GLY 98 23.457 13.334 -8.833 703 H PHE 99 H PHE 99 22.126 11.610 -11.714 704 HA PHE 99 HA PHE 99 23.788 9.332 -10.947 705 1HB PHE 99 1HB PHE 99 21.092 9.568 -11.372 706 2HB PHE 99 2HB PHE 99 21.581 9.296 -13.032 707 HD1 PHE 99 1HD PHE 99 23.614 7.301 -12.949 708 HD2 PHE 99 2HD PHE 99 20.179 7.654 -10.484 709 HE1 PHE 99 1HE PHE 99 23.662 4.827 -12.529 710 HE2 PHE 99 2HE PHE 99 20.226 5.180 -10.064 711 HZ PHE 99 HZ PHE 99 21.967 3.796 -11.092 712 H MET 601 H MET 601 7.457 -18.241 -21.894 713 HA MET 601 HA MET 601 9.191 -18.740 -23.167 714 1HB MET 601 1HB MET 601 9.695 -20.782 -20.966 715 2HB MET 601 2HB MET 601 10.580 -20.924 -22.472 716 1HG MET 601 1HG MET 601 11.982 -19.233 -21.884 717 2HG MET 601 2HG MET 601 10.637 -18.149 -21.589 718 1HE MET 601 3HE MET 601 13.631 -19.373 -20.097 719 2HE MET 601 1HE MET 601 13.065 -17.701 -19.867 720 3HE MET 601 2HE MET 601 13.328 -18.753 -18.456 721 H THR 602 H THR 602 7.667 -21.778 -21.863 722 HA THR 602 HA THR 602 7.825 -23.323 -24.113 723 HB THR 602 HB THR 602 7.057 -24.213 -21.986 724 HG1 THR 602 1HG THR 602 4.665 -23.998 -23.637 725 1HG2 THR 602 1HG2 THR 602 4.659 -22.334 -22.334 726 2HG2 THR 602 2HG2 THR 602 4.799 -23.595 -21.085 727 3HG2 THR 602 3HG2 THR 602 5.904 -22.200 -21.068 728 H GLU 603 H GLU 603 5.511 -20.679 -23.407 729 HA GLU 603 HA GLU 603 4.838 -20.769 -26.221 730 1HB GLU 603 1HB GLU 603 2.937 -21.151 -23.931 731 2HB GLU 603 2HB GLU 603 2.384 -20.149 -25.258 732 1HG GLU 603 1HG GLU 603 2.683 -21.929 -26.864 733 2HG GLU 603 2HG GLU 603 3.617 -22.892 -25.737 734 HE2 GLU 603 HE GLU 603 2.556 -24.204 -24.518 735 H GLN 604 H GLN 604 5.485 -18.791 -26.955 736 HA GLN 604 HA GLN 604 5.781 -16.629 -25.193 737 1HB GLN 604 1HB GLN 604 6.252 -15.350 -27.347 738 2HB GLN 604 2HB GLN 604 7.259 -16.759 -27.076 739 1HG GLN 604 1HG GLN 604 6.552 -17.680 -29.021 740 2HG GLN 604 2HG GLN 604 4.890 -17.636 -28.468 741 1HE2 GLN 604 1HE2 GLN 604 3.501 -16.182 -29.254 742 2HE2 GLN 604 2HE2 GLN 604 3.873 -14.953 -30.417 743 H GLN 605 H GLN 605 3.212 -17.750 -27.384 744 HA GLN 605 HA GLN 605 1.828 -15.418 -27.706 745 1HB GLN 605 1HB GLN 605 -0.189 -16.936 -27.982 746 2HB GLN 605 2HB GLN 605 1.199 -17.372 -28.958 747 1HG GLN 605 1HG GLN 605 1.835 -19.146 -27.401 748 2HG GLN 605 2HG GLN 605 0.641 -18.621 -26.231 749 1HE2 GLN 605 1HE2 GLN 605 0.904 -21.210 -27.379 750 2HE2 GLN 605 2HE2 GLN 605 -0.546 -21.584 -28.250 751 H TRP 606 H TRP 606 1.958 -17.669 -24.925 752 HA TRP 606 HA TRP 606 1.022 -15.667 -23.166 753 1HB TRP 606 1HB TRP 606 -1.077 -16.550 -22.493 754 2HB TRP 606 2HB TRP 606 -1.132 -16.259 -24.220 755 HD1 TRP 606 HD TRP 606 -1.451 -18.423 -25.807 756 HE1 TRP 606 1HE TRP 606 -2.119 -20.948 -25.429 757 HE3 TRP 606 3HE TRP 606 -0.746 -18.403 -20.771 758 HZ2 TRP 606 2HZ TRP 606 -2.274 -22.616 -23.118 759 HZ3 TRP 606 3HZ TRP 606 -1.178 -20.521 -19.529 760 HH2 TRP 606 HH TRP 606 -1.916 -22.579 -20.622 761 H ASN 607 H ASN 607 2.802 -16.151 -21.876 762 HA ASN 607 HA ASN 607 3.648 -18.785 -21.469 763 1HB ASN 607 1HB ASN 607 5.196 -16.882 -21.218 764 2HB ASN 607 2HB ASN 607 4.207 -16.186 -19.949 765 1HD2 ASN 607 1HD2 ASN 607 5.880 -16.192 -18.483 766 2HD2 ASN 607 2HD2 ASN 607 6.473 -17.625 -17.711 767 H PHE 608 H PHE 608 3.565 -19.996 -19.374 768 HA PHE 608 HA PHE 608 1.012 -19.899 -18.196 769 1HB PHE 608 1HB PHE 608 3.144 -21.672 -18.466 770 2HB PHE 608 2HB PHE 608 3.342 -21.195 -16.792 771 HD1 PHE 608 1HD PHE 608 2.074 -23.689 -18.692 772 HD2 PHE 608 2HD PHE 608 0.813 -21.070 -15.600 773 HE1 PHE 608 1HE PHE 608 0.310 -25.341 -18.012 774 HE2 PHE 608 2HE PHE 608 -0.951 -22.722 -14.921 775 HZ PHE 608 HZ PHE 608 -1.182 -24.837 -16.135 776 H ALA 609 H ALA 609 4.309 -19.334 -16.754 777 HA ALA 609 HA ALA 609 3.371 -18.411 -14.314 778 1HB ALA 609 2HB ALA 609 5.924 -17.533 -15.708 779 2HB ALA 609 1HB ALA 609 5.719 -19.146 -14.984 780 3HB ALA 609 3HB ALA 609 5.629 -17.693 -13.960 781 H GLY 610 H GLY 610 3.263 -16.971 -17.473 782 1HA GLY 610 2HA GLY 610 3.001 -14.801 -18.158 783 2HA GLY 610 1HA GLY 610 3.194 -14.236 -16.511 784 H ILE 611 H ILE 611 0.901 -16.322 -18.422 785 HA ILE 611 HA ILE 611 -1.288 -14.661 -18.009 786 HB ILE 611 HB ILE 611 -0.937 -16.469 -19.738 787 1HG1 ILE 611 1HG1 ILE 611 -3.137 -15.194 -19.005 788 2HG1 ILE 611 2HG1 ILE 611 -3.165 -16.463 -20.213 789 1HG2 ILE 611 1HG2 ILE 611 -1.789 -18.215 -17.417 790 2HG2 ILE 611 2HG2 ILE 611 -1.881 -18.711 -19.124 791 3HG2 ILE 611 3HG2 ILE 611 -0.303 -18.333 -18.391 792 1HD1 ILE 611 2HD1 ILE 611 -3.659 -16.965 -17.244 793 2HD1 ILE 611 3HD1 ILE 611 -4.953 -16.688 -18.434 794 3HD1 ILE 611 1HD1 ILE 611 -3.900 -18.115 -18.581 795 H GLU 612 H GLU 612 0.306 -16.990 -15.920 796 HA GLU 612 HA GLU 612 -1.912 -17.520 -14.293 797 1HB GLU 612 1HB GLU 612 0.008 -19.014 -14.297 798 2HB GLU 612 2HB GLU 612 1.088 -17.724 -13.809 799 1HG GLU 612 1HG GLU 612 0.725 -18.659 -11.725 800 2HG GLU 612 2HG GLU 612 -0.628 -17.546 -11.740 801 HE2 GLU 612 HE GLU 612 -0.419 -20.783 -10.851 802 H ALA 613 H ALA 613 0.957 -15.320 -13.876 803 HA ALA 613 HA ALA 613 -0.259 -14.091 -11.583 804 1HB ALA 613 3HB ALA 613 1.807 -13.069 -11.300 805 2HB ALA 613 2HB ALA 613 2.117 -12.969 -13.050 806 3HB ALA 613 1HB ALA 613 2.279 -14.527 -12.205 807 H ALA 614 H ALA 614 -0.473 -13.794 -15.018 808 HA ALA 614 HA ALA 614 -0.687 -11.123 -15.479 809 1HB ALA 614 2HB ALA 614 -2.453 -13.353 -16.570 810 2HB ALA 614 3HB ALA 614 -2.183 -11.764 -17.327 811 3HB ALA 614 1HB ALA 614 -0.837 -12.920 -17.178 812 H ALA 615 H ALA 615 -3.305 -13.355 -14.310 813 HA ALA 615 HA ALA 615 -5.271 -11.411 -14.085 814 1HB ALA 615 1HB ALA 615 -6.501 -13.103 -13.121 815 2HB ALA 615 2HB ALA 615 -5.197 -14.080 -13.838 816 3HB ALA 615 3HB ALA 615 -5.147 -13.660 -12.109 817 H SER 616 H SER 616 -2.840 -12.610 -11.679 818 HA SER 616 HA SER 616 -3.701 -11.154 -9.549 819 1HB SER 616 1HB SER 616 -1.516 -12.790 -10.156 820 2HB SER 616 2HB SER 616 -0.759 -11.256 -9.775 821 HG SER 616 HG SER 616 -1.248 -12.850 -7.949 822 H ALA 617 H ALA 617 -1.941 -10.132 -12.457 823 HA ALA 617 HA ALA 617 -1.070 -7.643 -11.367 824 1HB ALA 617 3HB ALA 617 -0.432 -9.212 -13.554 825 2HB ALA 617 2HB ALA 617 0.103 -7.533 -13.300 826 3HB ALA 617 1HB ALA 617 -1.333 -7.868 -14.296 827 H ILE 618 H ILE 618 -3.872 -8.850 -13.268 828 HA ILE 618 HA ILE 618 -4.931 -6.350 -13.906 829 HB ILE 618 HB ILE 618 -6.277 -9.024 -13.509 830 1HG1 ILE 618 1HG1 ILE 618 -4.502 -9.115 -15.172 831 2HG1 ILE 618 2HG1 ILE 618 -6.074 -9.246 -15.935 832 1HG2 ILE 618 1HG2 ILE 618 -7.676 -6.797 -13.503 833 2HG2 ILE 618 2HG2 ILE 618 -7.387 -6.863 -15.258 834 3HG2 ILE 618 3HG2 ILE 618 -8.209 -8.213 -14.441 835 1HD1 ILE 618 2HD1 ILE 618 -5.553 -6.466 -15.862 836 2HD1 ILE 618 3HD1 ILE 618 -4.007 -7.221 -16.319 837 3HD1 ILE 618 1HD1 ILE 618 -5.470 -7.531 -17.286 838 H GLN 619 H GLN 619 -5.382 -8.514 -11.052 839 HA GLN 619 HA GLN 619 -7.374 -7.064 -9.855 840 1HB GLN 619 1HB GLN 619 -5.499 -9.174 -9.122 841 2HB GLN 619 2HB GLN 619 -5.729 -8.080 -7.773 842 1HG GLN 619 1HG GLN 619 -8.014 -9.350 -9.354 843 2HG GLN 619 2HG GLN 619 -7.395 -9.985 -7.842 844 1HE2 GLN 619 1HE2 GLN 619 -9.779 -8.226 -9.157 845 2HE2 GLN 619 2HE2 GLN 619 -10.240 -7.202 -7.839 846 H GLY 620 H GLY 620 -3.800 -6.913 -9.160 847 1HA GLY 620 2HA GLY 620 -2.507 -5.235 -8.413 848 2HA GLY 620 1HA GLY 620 -3.862 -4.773 -7.403 849 H ASN 621 H ASN 621 -3.979 -4.862 -10.987 850 HA ASN 621 HA ASN 621 -3.429 -2.107 -11.243 851 1HB ASN 621 1HB ASN 621 -4.447 -4.302 -13.082 852 2HB ASN 621 2HB ASN 621 -4.525 -2.637 -13.623 853 1HD2 ASN 621 1HD2 ASN 621 -2.493 -1.346 -13.336 854 2HD2 ASN 621 2HD2 ASN 621 -0.985 -2.105 -13.722 855 H VAL 622 H VAL 622 -6.320 -4.232 -11.025 856 HA VAL 622 HA VAL 622 -8.241 -2.388 -11.843 857 HB VAL 622 HB VAL 622 -8.289 -4.800 -10.034 858 1HG1 VAL 622 1HG1 VAL 622 -10.525 -2.923 -10.781 859 2HG1 VAL 622 2HG1 VAL 622 -10.847 -4.654 -10.517 860 3HG1 VAL 622 3HG1 VAL 622 -10.149 -3.669 -9.209 861 1HG2 VAL 622 2HG2 VAL 622 -8.033 -4.601 -12.762 862 2HG2 VAL 622 3HG2 VAL 622 -8.677 -6.013 -11.890 863 3HG2 VAL 622 1HG2 VAL 622 -9.791 -4.801 -12.568 864 H THR 623 H THR 623 -7.171 -3.304 -8.489 865 HA THR 623 HA THR 623 -8.696 -1.341 -7.207 866 HB THR 623 HB THR 623 -7.118 -1.876 -5.305 867 HG1 THR 623 1HG THR 623 -5.137 -2.554 -6.014 868 1HG2 THR 623 3HG2 THR 623 -8.128 -4.170 -7.047 869 2HG2 THR 623 1HG2 THR 623 -7.286 -4.468 -5.508 870 3HG2 THR 623 2HG2 THR 623 -8.820 -3.567 -5.522 871 H SER 624 H SER 624 -5.500 -1.214 -8.782 872 HA SER 624 HA SER 624 -4.581 1.090 -7.651 873 1HB SER 624 1HB SER 624 -4.090 -0.456 -10.114 874 2HB SER 624 2HB SER 624 -3.764 1.253 -10.325 875 HG SER 624 HG SER 624 -1.882 0.766 -9.412 876 H ILE 625 H ILE 625 -6.635 0.661 -10.618 877 HA ILE 625 HA ILE 625 -6.888 3.434 -11.081 878 HB ILE 625 HB ILE 625 -8.040 0.919 -12.141 879 1HG1 ILE 625 1HG1 ILE 625 -7.520 2.862 -14.136 880 2HG1 ILE 625 2HG1 ILE 625 -6.227 3.008 -12.962 881 1HG2 ILE 625 2HG2 ILE 625 -9.431 3.593 -12.373 882 2HG2 ILE 625 3HG2 ILE 625 -9.651 2.274 -13.548 883 3HG2 ILE 625 1HG2 ILE 625 -10.106 2.033 -11.845 884 1HD1 ILE 625 1HD1 ILE 625 -7.132 0.373 -14.213 885 2HD1 ILE 625 2HD1 ILE 625 -5.719 1.320 -14.738 886 3HD1 ILE 625 3HD1 ILE 625 -5.750 0.595 -13.113 887 H HIS 626 H HIS 626 -8.568 1.073 -9.033 888 HA HIS 626 HA HIS 626 -10.938 2.431 -8.658 889 1HB HIS 626 1HB HIS 626 -10.366 0.100 -7.932 890 2HB HIS 626 2HB HIS 626 -9.434 0.778 -6.612 891 HD1 HIS 626 1HD HIS 626 -11.083 -0.439 -4.936 892 HD2 HIS 626 2HD HIS 626 -12.842 2.532 -7.319 893 HE1 HIS 626 1HE HIS 626 -13.351 0.072 -3.884 894 H SER 627 H SER 627 -7.841 2.632 -6.773 895 HA SER 627 HA SER 627 -8.886 4.773 -5.227 896 1HB SER 627 1HB SER 627 -6.368 3.176 -5.346 897 2HB SER 627 2HB SER 627 -6.182 4.812 -4.747 898 HG SER 627 HG SER 627 -7.667 4.400 -3.076 899 H LEU 628 H LEU 628 -6.462 4.359 -7.885 900 HA LEU 628 HA LEU 628 -5.406 6.825 -8.061 901 1HB LEU 628 1HB LEU 628 -6.057 4.673 -9.971 902 2HB LEU 628 2HB LEU 628 -5.790 6.248 -10.689 903 HG LEU 628 HG LEU 628 -3.801 5.117 -8.733 904 1HD1 LEU 628 3HD1 LEU 628 -4.452 4.027 -11.355 905 2HD1 LEU 628 1HD1 LEU 628 -2.758 4.562 -11.243 906 3HD1 LEU 628 2HD1 LEU 628 -3.399 3.385 -10.072 907 1HD2 LEU 628 2HD2 LEU 628 -3.855 7.553 -9.666 908 2HD2 LEU 628 3HD2 LEU 628 -2.315 6.664 -9.586 909 3HD2 LEU 628 1HD2 LEU 628 -3.181 6.807 -11.135 910 H LEU 629 H LEU 629 -8.563 5.799 -9.533 911 HA LEU 629 HA LEU 629 -9.244 8.212 -10.637 912 1HB LEU 629 1HB LEU 629 -10.506 5.717 -9.985 913 2HB LEU 629 2HB LEU 629 -11.600 7.034 -9.610 914 HG LEU 629 HG LEU 629 -11.852 6.072 -11.902 915 1HD1 LEU 629 1HD1 LEU 629 -11.507 8.927 -11.239 916 2HD1 LEU 629 2HD1 LEU 629 -11.494 8.542 -12.977 917 3HD1 LEU 629 3HD1 LEU 629 -12.883 8.067 -11.970 918 1HD2 LEU 629 2HD2 LEU 629 -9.018 6.512 -11.982 919 2HD2 LEU 629 3HD2 LEU 629 -10.068 5.689 -13.160 920 3HD2 LEU 629 1HD2 LEU 629 -9.799 7.445 -13.281 921 H ASP 630 H ASP 630 -9.705 7.039 -7.254 922 HA ASP 630 HA ASP 630 -11.117 9.302 -6.448 923 1HB ASP 630 1HB ASP 630 -9.678 7.023 -5.129 924 2HB ASP 630 2HB ASP 630 -9.956 8.436 -4.130 925 HD2 ASP 630 HD ASP 630 -11.878 8.952 -3.641 926 H GLU 631 H GLU 631 -7.696 8.517 -6.922 927 HA GLU 631 HA GLU 631 -6.707 10.554 -5.232 928 1HB GLU 631 1HB GLU 631 -5.643 8.406 -6.873 929 2HB GLU 631 2HB GLU 631 -4.748 9.878 -7.194 930 1HG GLU 631 1HG GLU 631 -5.223 8.599 -4.463 931 2HG GLU 631 2HG GLU 631 -3.699 8.683 -5.325 932 HE2 GLU 631 HE GLU 631 -4.911 10.125 -2.759 933 H GLY 632 H GLY 632 -7.235 10.177 -8.792 934 1HA GLY 632 2HA GLY 632 -7.135 11.678 -10.477 935 2HA GLY 632 1HA GLY 632 -6.214 12.758 -9.449 936 H LYS 633 H LYS 633 -9.457 11.373 -8.703 937 HA LYS 633 HA LYS 633 -11.013 13.458 -9.607 938 1HB LYS 633 1HB LYS 633 -11.712 11.165 -8.755 939 2HB LYS 633 2HB LYS 633 -11.573 11.809 -7.132 940 1HG LYS 633 1HG LYS 633 -13.881 12.079 -7.775 941 2HG LYS 633 2HG LYS 633 -13.167 13.679 -7.812 942 1HD LYS 633 1HD LYS 633 -12.670 12.810 -10.395 943 2HD LYS 633 2HD LYS 633 -14.192 12.011 -10.055 944 1HE LYS 633 1HE LYS 633 -15.089 14.283 -9.255 945 2HE LYS 633 2HE LYS 633 -13.617 15.003 -9.875 946 H GLN 634 H GLN 634 -9.022 13.147 -6.661 947 HA GLN 634 HA GLN 634 -10.149 15.346 -5.358 948 1HB GLN 634 1HB GLN 634 -7.350 14.166 -5.065 949 2HB GLN 634 2HB GLN 634 -8.141 15.217 -3.906 950 1HG GLN 634 1HG GLN 634 -9.756 12.841 -4.679 951 2HG GLN 634 2HG GLN 634 -8.251 12.446 -3.871 952 1HE2 GLN 634 1HE2 GLN 634 -9.576 11.646 -2.164 953 2HE2 GLN 634 2HE2 GLN 634 -10.229 12.707 -0.961 954 H SER 635 H SER 635 -7.823 14.996 -7.977 955 HA SER 635 HA SER 635 -6.760 17.620 -7.590 956 1HB SER 635 1HB SER 635 -6.042 15.251 -9.061 957 2HB SER 635 2HB SER 635 -6.168 16.569 -10.209 958 HG SER 635 HG SER 635 -4.642 17.779 -9.010 959 H LEU 636 H LEU 636 -9.219 15.944 -9.568 960 HA LEU 636 HA LEU 636 -9.635 17.659 -11.611 961 1HB LEU 636 1HB LEU 636 -11.130 15.659 -10.178 962 2HB LEU 636 2HB LEU 636 -12.193 16.972 -10.645 963 HG LEU 636 HG LEU 636 -12.027 15.048 -12.264 964 1HD1 LEU 636 1HD1 LEU 636 -12.722 17.489 -12.765 965 2HD1 LEU 636 2HD1 LEU 636 -11.157 17.597 -13.606 966 3HD1 LEU 636 3HD1 LEU 636 -12.366 16.398 -14.125 967 1HD2 LEU 636 1HD2 LEU 636 -9.294 15.361 -11.928 968 2HD2 LEU 636 2HD2 LEU 636 -10.106 14.368 -13.162 969 3HD2 LEU 636 3HD2 LEU 636 -9.601 16.030 -13.549 970 H THR 637 H THR 637 -10.993 17.977 -8.261 971 HA THR 637 HA THR 637 -12.255 20.441 -8.777 972 HB THR 637 HB THR 637 -13.066 19.271 -6.896 973 HG1 THR 637 1HG THR 637 -12.671 20.904 -5.425 974 1HG2 THR 637 2HG2 THR 637 -10.141 18.640 -6.428 975 2HG2 THR 637 3HG2 THR 637 -11.235 18.687 -5.024 976 3HG2 THR 637 1HG2 THR 637 -11.548 17.551 -6.358 977 H LYS 638 H LYS 638 -8.914 19.559 -8.051 978 HA LYS 638 HA LYS 638 -8.197 22.206 -7.244 979 1HB LYS 638 1HB LYS 638 -6.447 19.868 -8.063 980 2HB LYS 638 2HB LYS 638 -5.916 21.323 -7.246 981 1HG LYS 638 1HG LYS 638 -7.103 20.781 -5.241 982 2HG LYS 638 2HG LYS 638 -8.123 19.610 -6.053 983 1HD LYS 638 1HD LYS 638 -6.639 17.943 -5.650 984 2HD LYS 638 2HD LYS 638 -5.346 18.843 -6.417 985 1HE LYS 638 1HE LYS 638 -5.216 20.208 -4.196 986 2HE LYS 638 2HE LYS 638 -6.213 18.946 -3.500 987 H LEU 639 H LEU 639 -7.958 20.209 -10.242 988 HA LEU 639 HA LEU 639 -6.668 22.321 -11.671 989 1HB LEU 639 1HB LEU 639 -7.867 19.676 -12.488 990 2HB LEU 639 2HB LEU 639 -7.135 20.789 -13.626 991 HG LEU 639 HG LEU 639 -5.366 19.406 -13.236 992 1HD1 LEU 639 1HD1 LEU 639 -4.835 21.782 -12.515 993 2HD1 LEU 639 2HD1 LEU 639 -4.938 21.194 -10.838 994 3HD1 LEU 639 3HD1 LEU 639 -3.726 20.510 -11.948 995 1HD2 LEU 639 2HD2 LEU 639 -6.694 18.064 -11.545 996 2HD2 LEU 639 3HD2 LEU 639 -4.931 18.114 -11.304 997 3HD2 LEU 639 1HD2 LEU 639 -5.996 19.121 -10.294 998 H ALA 640 H ALA 640 -9.903 21.597 -10.694 999 HA ALA 640 HA ALA 640 -11.469 22.377 -12.762 1000 1HB ALA 640 1HB ALA 640 -12.078 21.626 -10.384 1001 2HB ALA 640 2HB ALA 640 -11.889 23.332 -9.912 1002 3HB ALA 640 3HB ALA 640 -13.116 22.873 -11.116 1003 H ALA 641 H ALA 641 -9.393 24.400 -10.661 1004 HA ALA 641 HA ALA 641 -10.433 26.878 -11.420 1005 1HB ALA 641 2HB ALA 641 -8.733 27.700 -10.126 1006 2HB ALA 641 3HB ALA 641 -8.624 26.001 -9.606 1007 3HB ALA 641 1HB ALA 641 -7.515 26.623 -10.851 1008 H ALA 642 H ALA 642 -8.265 24.570 -13.019 1009 HA ALA 642 HA ALA 642 -7.098 26.354 -14.838 1010 1HB ALA 642 2HB ALA 642 -6.639 23.815 -14.160 1011 2HB ALA 642 1HB ALA 642 -6.177 24.445 -15.759 1012 3HB ALA 642 3HB ALA 642 -7.674 23.501 -15.574 1013 H TRP 643 H TRP 643 -10.296 24.889 -14.592 1014 HA TRP 643 HA TRP 643 -10.918 25.383 -17.365 1015 1HB TRP 643 1HB TRP 643 -12.400 24.266 -15.005 1016 2HB TRP 643 2HB TRP 643 -13.267 24.755 -16.447 1017 HD1 TRP 643 HD TRP 643 -13.070 23.137 -18.581 1018 HE1 TRP 643 1HE TRP 643 -12.079 20.738 -19.058 1019 HE3 TRP 643 3HE TRP 643 -10.403 22.804 -14.265 1020 HZ2 TRP 643 2HZ TRP 643 -10.331 19.009 -17.609 1021 HZ3 TRP 643 3HZ TRP 643 -9.082 20.727 -13.873 1022 HH2 TRP 643 HH TRP 643 -9.018 18.870 -15.461 1023 H GLY 644 H GLY 644 -11.348 26.847 -14.122 1024 1HA GLY 644 2HA GLY 644 -12.821 29.087 -15.356 1025 2HA GLY 644 1HA GLY 644 -11.370 29.372 -14.415 1026 H GLY 645 H GLY 645 -11.715 27.350 -12.382 1027 1HA GLY 645 2HA GLY 645 -14.084 28.440 -10.984 1028 2HA GLY 645 1HA GLY 645 -12.563 28.036 -10.213 1029 H SER 646 H SER 646 -13.890 26.634 -8.776 1030 HA SER 646 HA SER 646 -14.216 24.043 -10.042 1031 1HB SER 646 1HB SER 646 -14.328 23.323 -7.521 1032 2HB SER 646 2HB SER 646 -12.780 23.761 -8.216 1033 HG SER 646 HG SER 646 -14.330 25.848 -7.042 1034 H GLY 647 H GLY 647 -16.291 25.428 -10.873 1035 1HA GLY 647 2HA GLY 647 -18.433 25.983 -9.223 1036 2HA GLY 647 1HA GLY 647 -18.542 24.269 -9.571 1037 H SER 648 H SER 648 -17.158 26.773 -11.759 1038 HA SER 648 HA SER 648 -19.291 27.451 -13.214 1039 1HB SER 648 1HB SER 648 -16.389 27.215 -13.698 1040 2HB SER 648 2HB SER 648 -17.327 27.088 -15.173 1041 HG SER 648 HG SER 648 -18.103 29.156 -13.399 1042 H GLU 649 H GLU 649 -20.369 26.646 -15.137 1043 HA GLU 649 HA GLU 649 -20.952 23.983 -15.080 1044 1HB GLU 649 1HB GLU 649 -22.007 24.374 -17.316 1045 2HB GLU 649 2HB GLU 649 -22.420 25.610 -16.144 1046 1HG GLU 649 1HG GLU 649 -20.625 27.090 -17.085 1047 2HG GLU 649 2HG GLU 649 -20.236 25.857 -18.268 1048 HE2 GLU 649 HE GLU 649 -23.222 27.197 -17.096 1049 H ALA 650 H ALA 650 -18.355 25.729 -16.780 1050 HA ALA 650 HA ALA 650 -17.671 23.864 -18.687 1051 1HB ALA 650 3HB ALA 650 -16.496 26.182 -17.354 1052 2HB ALA 650 2HB ALA 650 -16.303 25.620 -19.032 1053 3HB ALA 650 1HB ALA 650 -15.265 24.958 -17.746 1054 H TYR 651 H TYR 651 -15.857 24.288 -15.569 1055 HA TYR 651 HA TYR 651 -14.549 21.888 -15.648 1056 1HB TYR 651 1HB TYR 651 -13.920 23.471 -13.967 1057 2HB TYR 651 2HB TYR 651 -15.585 23.853 -13.577 1058 HD1 TYR 651 1HD TYR 651 -13.338 20.839 -13.436 1059 HD2 TYR 651 2HD TYR 651 -16.302 23.218 -11.472 1060 HE1 TYR 651 1HE TYR 651 -13.217 19.322 -11.400 1061 HE2 TYR 651 2HE TYR 651 -16.172 21.692 -9.443 1062 HH TYR 651 HH TYR 651 -14.624 18.681 -9.550 1063 H GLN 652 H GLN 652 -17.902 22.594 -14.628 1064 HA GLN 652 HA GLN 652 -18.363 20.276 -13.223 1065 1HB GLN 652 1HB GLN 652 -20.185 22.084 -14.850 1066 2HB GLN 652 2HB GLN 652 -20.813 20.708 -13.965 1067 1HG GLN 652 1HG GLN 652 -19.066 22.115 -12.173 1068 2HG GLN 652 2HG GLN 652 -20.065 23.324 -12.955 1069 1HE2 GLN 652 1HE2 GLN 652 -21.578 23.845 -11.560 1070 2HE2 GLN 652 2HE2 GLN 652 -22.641 22.762 -10.725 1071 H GLY 653 H GLY 653 -18.995 21.009 -16.729 1072 1HA GLY 653 2HA GLY 653 -19.161 19.662 -18.519 1073 2HA GLY 653 1HA GLY 653 -19.976 18.521 -17.468 1074 H VAL 654 H VAL 654 -16.710 19.518 -16.586 1075 HA VAL 654 HA VAL 654 -15.461 17.347 -18.002 1076 HB VAL 654 HB VAL 654 -14.552 19.510 -16.119 1077 1HG1 VAL 654 2HG1 VAL 654 -13.324 17.364 -15.635 1078 2HG1 VAL 654 3HG1 VAL 654 -12.738 17.394 -17.316 1079 3HG1 VAL 654 1HG1 VAL 654 -12.296 18.705 -16.195 1080 1HG2 VAL 654 2HG2 VAL 654 -14.931 19.431 -18.868 1081 2HG2 VAL 654 3HG2 VAL 654 -13.955 20.619 -17.972 1082 3HG2 VAL 654 1HG2 VAL 654 -13.179 19.182 -18.681 1083 H GLN 655 H GLN 655 -16.466 18.171 -14.643 1084 HA GLN 655 HA GLN 655 -15.256 16.110 -13.345 1085 1HB GLN 655 1HB GLN 655 -17.516 17.930 -12.866 1086 2HB GLN 655 2HB GLN 655 -17.746 16.385 -12.072 1087 1HG GLN 655 1HG GLN 655 -14.996 17.148 -11.683 1088 2HG GLN 655 2HG GLN 655 -15.984 18.548 -11.314 1089 1HE2 GLN 655 1HE2 GLN 655 -14.409 16.750 -9.599 1090 2HE2 GLN 655 2HE2 GLN 655 -15.481 16.146 -8.380 1091 H GLN 656 H GLN 656 -18.532 16.163 -14.909 1092 HA GLN 656 HA GLN 656 -19.108 13.518 -14.257 1093 1HB GLN 656 1HB GLN 656 -20.965 13.746 -15.831 1094 2HB GLN 656 2HB GLN 656 -20.806 15.226 -14.906 1095 1HG GLN 656 1HG GLN 656 -19.267 16.016 -16.910 1096 2HG GLN 656 2HG GLN 656 -20.040 14.716 -17.796 1097 1HE2 GLN 656 1HE2 GLN 656 -20.813 17.428 -15.626 1098 2HE2 GLN 656 2HE2 GLN 656 -22.261 17.945 -16.424 1099 H LYS 657 H LYS 657 -17.556 15.074 -17.109 1100 HA LYS 657 HA LYS 657 -17.494 12.790 -18.720 1101 1HB LYS 657 1HB LYS 657 -16.014 15.401 -18.644 1102 2HB LYS 657 2HB LYS 657 -15.457 14.133 -19.716 1103 1HG LYS 657 1HG LYS 657 -17.989 13.968 -20.448 1104 2HG LYS 657 2HG LYS 657 -18.139 15.552 -19.713 1105 1HD LYS 657 1HD LYS 657 -16.151 16.298 -21.157 1106 2HD LYS 657 2HD LYS 657 -16.274 14.764 -21.995 1107 1HE LYS 657 1HE LYS 657 -18.557 15.270 -22.731 1108 2HE LYS 657 2HE LYS 657 -18.612 16.710 -21.733 1109 H TRP 658 H TRP 658 -15.518 13.882 -15.982 1110 HA TRP 658 HA TRP 658 -13.368 12.094 -16.506 1111 1HB TRP 658 1HB TRP 658 -12.852 14.012 -15.262 1112 2HB TRP 658 2HB TRP 658 -14.202 13.789 -14.168 1113 HD1 TRP 658 HD TRP 658 -13.786 12.197 -12.047 1114 HE1 TRP 658 1HE TRP 658 -11.705 10.998 -10.952 1115 HE3 TRP 658 3HE TRP 658 -10.661 12.859 -16.002 1116 HZ2 TRP 658 2HZ TRP 658 -9.045 10.473 -11.844 1117 HZ3 TRP 658 3HZ TRP 658 -8.338 11.974 -15.809 1118 HH2 TRP 658 HH TRP 658 -7.516 10.815 -13.820 1119 H ASP 659 H ASP 659 -16.157 12.169 -14.170 1120 HA ASP 659 HA ASP 659 -15.636 9.673 -13.110 1121 1HB ASP 659 1HB ASP 659 -17.574 11.725 -12.822 1122 2HB ASP 659 2HB ASP 659 -18.501 10.298 -13.240 1123 HD2 ASP 659 HD ASP 659 -18.724 8.804 -11.768 1124 H ALA 660 H ALA 660 -17.316 10.803 -16.045 1125 HA ALA 660 HA ALA 660 -18.917 8.646 -16.630 1126 1HB ALA 660 3HB ALA 660 -19.311 10.144 -18.263 1127 2HB ALA 660 1HB ALA 660 -17.744 10.944 -17.990 1128 3HB ALA 660 2HB ALA 660 -17.848 9.535 -19.073 1129 H THR 661 H THR 661 -15.986 9.107 -18.644 1130 HA THR 661 HA THR 661 -15.664 6.447 -19.240 1131 HB THR 661 HB THR 661 -13.408 7.181 -19.988 1132 HG1 THR 661 1HG THR 661 -12.618 9.151 -19.095 1133 1HG2 THR 661 3HG2 THR 661 -15.824 8.470 -20.742 1134 2HG2 THR 661 1HG2 THR 661 -14.671 9.791 -20.437 1135 3HG2 THR 661 2HG2 THR 661 -14.278 8.524 -21.624 1136 H ALA 662 H ALA 662 -14.887 8.130 -16.259 1137 HA ALA 662 HA ALA 662 -12.883 6.487 -15.289 1138 1HB ALA 662 3HB ALA 662 -13.189 8.296 -13.926 1139 2HB ALA 662 2HB ALA 662 -14.247 7.169 -13.042 1140 3HB ALA 662 1HB ALA 662 -14.949 8.333 -14.191 1141 H THR 663 H THR 663 -16.189 6.311 -13.871 1142 HA THR 663 HA THR 663 -16.003 3.751 -12.961 1143 HB THR 663 HB THR 663 -17.860 4.997 -12.209 1144 HG1 THR 663 1HG THR 663 -19.559 3.642 -12.929 1145 1HG2 THR 663 3HG2 THR 663 -17.860 6.017 -14.980 1146 2HG2 THR 663 1HG2 THR 663 -19.496 5.589 -14.424 1147 3HG2 THR 663 2HG2 THR 663 -18.524 6.766 -13.508 1148 H GLU 664 H GLU 664 -16.447 4.824 -16.293 1149 HA GLU 664 HA GLU 664 -17.539 2.473 -17.270 1150 1HB GLU 664 1HB GLU 664 -17.575 4.499 -18.598 1151 2HB GLU 664 2HB GLU 664 -15.827 4.628 -18.572 1152 1HG GLU 664 1HG GLU 664 -16.370 3.715 -20.723 1153 2HG GLU 664 2HG GLU 664 -15.740 2.372 -19.790 1154 HE2 GLU 664 HE GLU 664 -17.929 0.432 -19.873 1155 H LEU 665 H LEU 665 -14.100 3.599 -17.016 1156 HA LEU 665 HA LEU 665 -13.103 1.133 -18.055 1157 1HB LEU 665 1HB LEU 665 -12.064 3.432 -18.261 1158 2HB LEU 665 2HB LEU 665 -11.594 3.287 -16.579 1159 HG LEU 665 HG LEU 665 -9.847 2.720 -18.344 1160 1HD1 LEU 665 2HD1 LEU 665 -10.548 0.953 -16.013 1161 2HD1 LEU 665 3HD1 LEU 665 -9.119 0.615 -17.020 1162 3HD1 LEU 665 1HD1 LEU 665 -9.259 2.171 -16.168 1163 1HD2 LEU 665 3HD2 LEU 665 -11.307 1.411 -19.823 1164 2HD2 LEU 665 1HD2 LEU 665 -9.881 0.483 -19.301 1165 3HD2 LEU 665 2HD2 LEU 665 -11.468 0.168 -18.559 1166 H ASN 666 H ASN 666 -13.835 2.525 -14.858 1167 HA ASN 666 HA ASN 666 -12.347 0.732 -13.368 1168 1HB ASN 666 1HB ASN 666 -14.027 2.900 -12.847 1169 2HB ASN 666 2HB ASN 666 -14.954 1.566 -12.189 1170 1HD2 ASN 666 1HD2 ASN 666 -13.019 3.892 -11.281 1171 2HD2 ASN 666 2HD2 ASN 666 -12.109 3.173 -9.994 1172 H ASN 667 H ASN 667 -15.882 0.802 -14.265 1173 HA ASN 667 HA ASN 667 -16.594 -1.542 -13.074 1174 1HB ASN 667 1HB ASN 667 -17.627 -0.313 -15.684 1175 2HB ASN 667 2HB ASN 667 -18.459 -1.581 -14.807 1176 1HD2 ASN 667 1HD2 ASN 667 -19.068 1.288 -15.467 1177 2HD2 ASN 667 2HD2 ASN 667 -19.530 2.029 -13.971 1178 H ALA 668 H ALA 668 -15.530 -0.890 -16.498 1179 HA ALA 668 HA ALA 668 -15.706 -3.431 -17.501 1180 1HB ALA 668 1HB ALA 668 -14.908 -1.007 -18.425 1181 2HB ALA 668 2HB ALA 668 -13.328 -1.816 -18.289 1182 3HB ALA 668 3HB ALA 668 -14.611 -2.531 -19.295 1183 H LEU 669 H LEU 669 -13.047 -1.908 -15.589 1184 HA LEU 669 HA LEU 669 -11.262 -4.034 -15.799 1185 1HB LEU 669 1HB LEU 669 -11.562 -1.580 -14.266 1186 2HB LEU 669 2HB LEU 669 -10.822 -2.855 -13.320 1187 HG LEU 669 HG LEU 669 -9.787 -2.245 -16.077 1188 1HD1 LEU 669 1HD1 LEU 669 -10.023 -0.150 -14.513 1189 2HD1 LEU 669 2HD1 LEU 669 -8.599 -0.851 -13.707 1190 3HD1 LEU 669 3HD1 LEU 669 -8.528 -0.434 -15.436 1191 1HD2 LEU 669 2HD2 LEU 669 -9.138 -4.204 -14.344 1192 2HD2 LEU 669 3HD2 LEU 669 -7.993 -3.491 -15.505 1193 3HD2 LEU 669 1HD2 LEU 669 -8.005 -2.939 -13.813 1194 H GLN 670 H GLN 670 -13.948 -3.359 -13.493 1195 HA GLN 670 HA GLN 670 -13.400 -5.404 -11.747 1196 1HB GLN 670 1HB GLN 670 -15.925 -3.944 -12.547 1197 2HB GLN 670 2HB GLN 670 -16.025 -5.288 -11.427 1198 1HG GLN 670 1HG GLN 670 -15.094 -4.089 -9.719 1199 2HG GLN 670 2HG GLN 670 -13.833 -3.434 -10.744 1200 1HE2 GLN 670 1HE2 GLN 670 -13.849 -1.331 -10.784 1201 2HE2 GLN 670 2HE2 GLN 670 -15.229 -0.284 -10.815 1202 H ASN 671 H ASN 671 -15.576 -5.378 -14.657 1203 HA ASN 671 HA ASN 671 -16.232 -8.081 -14.384 1204 1HB ASN 671 1HB ASN 671 -17.068 -5.923 -15.976 1205 2HB ASN 671 2HB ASN 671 -16.312 -6.988 -17.145 1206 1HD2 ASN 671 1HD2 ASN 671 -17.791 -8.116 -18.140 1207 2HD2 ASN 671 2HD2 ASN 671 -19.140 -8.940 -17.432 1208 H LEU 672 H LEU 672 -13.523 -6.276 -15.739 1209 HA LEU 672 HA LEU 672 -12.666 -8.324 -17.535 1210 1HB LEU 672 1HB LEU 672 -12.191 -6.022 -18.011 1211 2HB LEU 672 2HB LEU 672 -11.371 -5.813 -16.477 1212 HG LEU 672 HG LEU 672 -9.927 -6.030 -18.564 1213 1HD1 LEU 672 1HD1 LEU 672 -9.104 -6.222 -16.226 1214 2HD1 LEU 672 2HD1 LEU 672 -9.341 -7.984 -16.325 1215 3HD1 LEU 672 3HD1 LEU 672 -8.168 -7.182 -17.397 1216 1HD2 LEU 672 3HD2 LEU 672 -11.306 -8.002 -19.429 1217 2HD2 LEU 672 1HD2 LEU 672 -9.534 -8.117 -19.559 1218 3HD2 LEU 672 2HD2 LEU 672 -10.391 -8.997 -18.271 1219 H ALA 673 H ALA 673 -11.764 -7.189 -14.225 1220 HA ALA 673 HA ALA 673 -9.787 -9.263 -13.986 1221 1HB ALA 673 3HB ALA 673 -10.286 -6.771 -12.809 1222 2HB ALA 673 1HB ALA 673 -10.624 -7.944 -11.514 1223 3HB ALA 673 2HB ALA 673 -9.038 -7.943 -12.321 1224 H ARG 674 H ARG 674 -13.224 -8.810 -13.388 1225 HA ARG 674 HA ARG 674 -13.500 -10.683 -11.366 1226 1HB ARG 674 1HB ARG 674 -15.317 -9.386 -13.390 1227 2HB ARG 674 2HB ARG 674 -15.930 -10.814 -12.580 1228 1HG ARG 674 1HG ARG 674 -14.624 -8.852 -10.761 1229 2HG ARG 674 2HG ARG 674 -16.058 -8.240 -11.563 1230 1HD ARG 674 1HD ARG 674 -17.477 -9.805 -10.541 1231 2HD ARG 674 2HD ARG 674 -16.210 -11.001 -10.356 1232 HE ARG 674 HE ARG 674 -16.839 -8.822 -8.501 1233 2HH1 ARG 674 1HH ARG 674 -14.284 -9.616 -6.287 1234 1HH2 ARG 674 2HH2 ARG 674 -14.327 -11.091 -9.548 1235 2HH2 ARG 674 1HH2 ARG 674 -13.461 -11.015 -8.050 1236 H THR 675 H THR 675 -13.074 -10.941 -14.867 1237 HA THR 675 HA THR 675 -13.694 -13.815 -14.735 1238 HB THR 675 HB THR 675 -13.446 -11.962 -17.162 1239 HG1 THR 675 1HG THR 675 -15.201 -11.481 -15.570 1240 1HG2 THR 675 1HG2 THR 675 -13.376 -14.656 -17.261 1241 2HG2 THR 675 2HG2 THR 675 -15.128 -14.468 -17.007 1242 3HG2 THR 675 3HG2 THR 675 -14.348 -13.723 -18.424 1243 H ILE 676 H ILE 676 -11.134 -11.573 -14.649 1244 HA ILE 676 HA ILE 676 -9.311 -13.444 -15.952 1245 HB ILE 676 HB ILE 676 -9.205 -10.545 -15.217 1246 1HG1 ILE 676 1HG1 ILE 676 -8.750 -12.159 -17.735 1247 2HG1 ILE 676 2HG1 ILE 676 -10.040 -11.020 -17.405 1248 1HG2 ILE 676 2HG2 ILE 676 -6.960 -12.427 -15.108 1249 2HG2 ILE 676 3HG2 ILE 676 -6.692 -11.053 -16.209 1250 3HG2 ILE 676 1HG2 ILE 676 -7.100 -10.759 -14.501 1251 1HD1 ILE 676 1HD1 ILE 676 -8.013 -9.320 -17.014 1252 2HD1 ILE 676 2HD1 ILE 676 -7.145 -10.482 -18.046 1253 3HD1 ILE 676 3HD1 ILE 676 -8.609 -9.672 -18.654 1254 H SER 677 H SER 677 -9.675 -11.564 -12.865 1255 HA SER 677 HA SER 677 -7.623 -12.511 -11.481 1256 1HB SER 677 1HB SER 677 -9.167 -10.925 -10.506 1257 2HB SER 677 2HB SER 677 -10.492 -12.071 -10.567 1258 HG SER 677 HG SER 677 -8.356 -13.114 -9.148 1259 H GLU 678 H GLU 678 -10.519 -14.309 -12.484 1260 HA GLU 678 HA GLU 678 -10.240 -16.428 -10.700 1261 1HB GLU 678 1HB GLU 678 -11.737 -17.642 -12.290 1262 2HB GLU 678 2HB GLU 678 -12.328 -16.039 -11.900 1263 1HG GLU 678 1HG GLU 678 -10.997 -15.285 -14.053 1264 2HG GLU 678 2HG GLU 678 -11.013 -16.988 -14.465 1265 HE2 GLU 678 HE GLU 678 -12.694 -17.181 -15.925 1266 H ALA 679 H ALA 679 -8.863 -15.734 -13.943 1267 HA ALA 679 HA ALA 679 -7.911 -18.107 -14.744 1268 1HB ALA 679 2HB ALA 679 -6.155 -15.636 -14.703 1269 2HB ALA 679 3HB ALA 679 -6.282 -16.889 -15.961 1270 3HB ALA 679 1HB ALA 679 -7.614 -15.735 -15.718 1271 H GLY 680 H GLY 680 -6.896 -16.246 -11.896 1272 1HA GLY 680 2HA GLY 680 -5.741 -16.978 -10.084 1273 2HA GLY 680 1HA GLY 680 -4.444 -17.101 -11.255 1274 H GLN 681 H GLN 681 -7.144 -18.909 -9.705 1275 HA GLN 681 HA GLN 681 -5.644 -21.337 -10.316 1276 1HB GLN 681 1HB GLN 681 -5.697 -20.624 -7.882 1277 2HB GLN 681 2HB GLN 681 -7.436 -20.840 -7.900 1278 1HG GLN 681 1HG GLN 681 -6.700 -23.252 -8.932 1279 2HG GLN 681 2HG GLN 681 -5.260 -22.907 -7.994 1280 1HE2 GLN 681 1HE2 GLN 681 -5.625 -24.506 -6.514 1281 2HE2 GLN 681 2HE2 GLN 681 -6.870 -24.449 -5.310 1282 H ALA 682 H ALA 682 -8.812 -19.706 -10.142 1283 HA ALA 682 HA ALA 682 -10.563 -21.748 -10.428 1284 1HB ALA 682 1HB ALA 682 -10.959 -19.432 -12.259 1285 2HB ALA 682 3HB ALA 682 -10.678 -19.037 -10.546 1286 3HB ALA 682 2HB ALA 682 -12.033 -20.097 -11.004 1287 H MET 683 H MET 683 -9.286 -19.928 -13.305 1288 HA MET 683 HA MET 683 -10.108 -21.495 -15.246 1289 1HB MET 683 1HB MET 683 -8.766 -19.576 -15.795 1290 2HB MET 683 2HB MET 683 -7.429 -20.113 -14.797 1291 1HG MET 683 1HG MET 683 -8.244 -21.878 -17.105 1292 2HG MET 683 2HG MET 683 -7.397 -20.391 -17.480 1293 1HE MET 683 3HE MET 683 -6.997 -23.513 -17.675 1294 2HE MET 683 1HE MET 683 -5.428 -22.936 -18.286 1295 3HE MET 683 2HE MET 683 -5.486 -24.099 -16.940 1296 H ALA 684 H ALA 684 -7.603 -22.344 -12.876 1297 HA ALA 684 HA ALA 684 -6.803 -24.682 -14.380 1298 1HB ALA 684 3HB ALA 684 -5.240 -25.000 -12.506 1299 2HB ALA 684 1HB ALA 684 -5.159 -23.329 -13.114 1300 3HB ALA 684 2HB ALA 684 -6.035 -23.686 -11.606 1301 H SER 685 H SER 685 -8.527 -23.851 -11.303 1302 HA SER 685 HA SER 685 -8.964 -26.194 -10.218 1303 1HB SER 685 1HB SER 685 -11.044 -24.027 -10.735 1304 2HB SER 685 2HB SER 685 -11.307 -25.359 -9.627 1305 HG SER 685 HG SER 685 -9.058 -23.548 -9.427 1306 H THR 686 H THR 686 -11.467 -24.908 -12.529 1307 HA THR 686 HA THR 686 -11.466 -27.320 -14.063 1308 HB THR 686 HB THR 686 -13.326 -26.954 -11.750 1309 HG1 THR 686 1HG THR 686 -11.841 -28.752 -12.015 1310 1HG2 THR 686 1HG2 THR 686 -14.797 -26.620 -13.862 1311 2HG2 THR 686 2HG2 THR 686 -14.304 -28.265 -14.330 1312 3HG2 THR 686 3HG2 THR 686 -15.219 -28.004 -12.826 1313 H GLU 687 H GLU 687 -12.862 -27.193 -15.931 1314 HA GLU 687 HA GLU 687 -13.121 -24.467 -16.728 1315 1HB GLU 687 1HB GLU 687 -13.714 -25.441 -18.941 1316 2HB GLU 687 2HB GLU 687 -12.224 -26.111 -18.307 1317 1HG GLU 687 1HG GLU 687 -14.228 -27.805 -17.267 1318 2HG GLU 687 2HG GLU 687 -14.770 -27.462 -18.898 1319 HE2 GLU 687 HE GLU 687 -13.143 -29.742 -20.157 1320 H GLY 688 H GLY 688 -14.963 -23.243 -16.655 1321 1HA GLY 688 2HA GLY 688 -17.558 -24.612 -16.648 1322 2HA GLY 688 1HA GLY 688 -17.255 -22.920 -16.987 1323 H ASN 689 H ASN 689 -15.257 -23.592 -14.401 1324 HA ASN 689 HA ASN 689 -17.353 -23.299 -12.430 1325 1HB ASN 689 1HB ASN 689 -15.623 -24.995 -11.957 1326 2HB ASN 689 2HB ASN 689 -14.344 -23.822 -12.200 1327 1HD2 ASN 689 1HD2 ASN 689 -17.086 -24.720 -10.187 1328 2HD2 ASN 689 2HD2 ASN 689 -16.589 -23.918 -8.735 1329 H VAL 690 H VAL 690 -15.780 -21.295 -14.477 1330 HA VAL 690 HA VAL 690 -14.694 -19.380 -12.639 1331 HB VAL 690 HB VAL 690 -14.618 -18.010 -14.808 1332 1HG1 VAL 690 3HG1 VAL 690 -13.128 -20.635 -14.501 1333 2HG1 VAL 690 1HG1 VAL 690 -12.681 -19.363 -15.663 1334 3HG1 VAL 690 2HG1 VAL 690 -12.633 -19.028 -13.916 1335 1HG2 VAL 690 2HG2 VAL 690 -16.351 -19.886 -15.760 1336 2HG2 VAL 690 3HG2 VAL 690 -15.309 -18.867 -16.782 1337 3HG2 VAL 690 1HG2 VAL 690 -14.801 -20.520 -16.363 1338 H THR 691 H THR 691 -15.590 -16.928 -13.548 1339 HA THR 691 HA THR 691 -17.751 -16.364 -12.059 1340 HB THR 691 HB THR 691 -16.303 -14.697 -13.194 1341 HG1 THR 691 1HG THR 691 -18.261 -13.444 -14.054 1342 1HG2 THR 691 3HG2 THR 691 -16.218 -15.887 -15.457 1343 2HG2 THR 691 1HG2 THR 691 -17.906 -15.382 -15.711 1344 3HG2 THR 691 2HG2 THR 691 -16.623 -14.157 -15.560 1345 H GLY 692 H GLY 692 -17.784 -17.887 -15.281 1346 1HA GLY 692 2HA GLY 692 -19.437 -19.002 -16.327 1347 2HA GLY 692 1HA GLY 692 -20.384 -17.554 -16.048 1348 H MET 693 H MET 693 -19.082 -19.562 -13.388 1349 HA MET 693 HA MET 693 -21.744 -20.659 -13.000 1350 1HB MET 693 1HB MET 693 -19.298 -21.894 -12.981 1351 2HB MET 693 2HB MET 693 -19.391 -21.459 -11.286 1352 1HG MET 693 1HG MET 693 -21.612 -22.958 -12.754 1353 2HG MET 693 2HG MET 693 -20.339 -23.761 -11.858 1354 1HE MET 693 1HE MET 693 -19.841 -23.711 -9.721 1355 2HE MET 693 2HE MET 693 -20.713 -23.001 -8.341 1356 3HE MET 693 3HE MET 693 -21.303 -24.505 -9.088 1357 H PHE 694 H PHE 694 -19.005 -19.285 -11.029 1358 HA PHE 694 HA PHE 694 -20.155 -18.977 -8.654 1359 1HB PHE 694 1HB PHE 694 -18.621 -16.857 -10.277 1360 2HB PHE 694 2HB PHE 694 -18.740 -16.857 -8.528 1361 HD1 PHE 694 1HD PHE 694 -18.303 -19.702 -7.892 1362 HD2 PHE 694 2HD PHE 694 -16.372 -17.209 -10.732 1363 HE1 PHE 694 1HE PHE 694 -16.247 -21.135 -7.752 1364 HE2 PHE 694 2HE PHE 694 -14.316 -18.643 -10.593 1365 HZ PHE 694 HZ PHE 694 -14.278 -20.588 -9.104 1366 H ALA 695 H ALA 695 -21.908 -17.986 -7.759 1367 HA ALA 695 HA ALA 695 -23.285 -16.015 -9.445 1368 1HB ALA 695 1HB ALA 695 -24.200 -18.380 -8.329 1369 2HB ALA 695 2HB ALA 695 -24.742 -17.158 -7.154 1370 3HB ALA 695 3HB ALA 695 -25.223 -17.025 -8.862 No H/Q in entry = 1370 Start of MODEL 9 1 H ALA 1 H ALA 1 -2.980 30.477 1.512 2 HA ALA 1 HA ALA 1 -1.593 30.460 -0.239 3 1HB ALA 1 3HB ALA 1 -3.063 28.278 -0.822 4 2HB ALA 1 1HB ALA 1 -3.568 29.319 -2.174 5 3HB ALA 1 2HB ALA 1 -1.845 28.938 -1.940 6 H GLU 2 H GLU 2 -1.471 31.529 -2.543 7 HA GLU 2 HA GLU 2 -2.641 34.035 -2.274 8 1HB GLU 2 1HB GLU 2 -0.615 32.843 -3.838 9 2HB GLU 2 2HB GLU 2 -1.778 33.435 -5.009 10 1HG GLU 2 1HG GLU 2 -1.683 35.694 -4.063 11 2HG GLU 2 2HG GLU 2 -0.704 35.143 -2.718 12 HE2 GLU 2 HE GLU 2 -0.403 36.023 -6.125 13 H MET 3 H MET 3 -3.040 31.834 -5.139 14 HA MET 3 HA MET 3 -5.874 32.514 -5.057 15 1HB MET 3 1HB MET 3 -3.830 32.858 -7.222 16 2HB MET 3 2HB MET 3 -5.336 32.142 -7.761 17 1HG MET 3 1HG MET 3 -6.552 34.077 -7.397 18 2HG MET 3 2HG MET 3 -5.643 34.510 -5.963 19 1HE MET 3 1HE MET 3 -4.448 36.314 -5.805 20 2HE MET 3 2HE MET 3 -3.653 37.295 -7.060 21 3HE MET 3 3HE MET 3 -5.429 37.264 -6.947 22 H LYS 4 H LYS 4 -7.212 30.939 -6.489 23 HA LYS 4 HA LYS 4 -6.158 28.257 -5.992 24 1HB LYS 4 1HB LYS 4 -8.432 27.517 -5.943 25 2HB LYS 4 2HB LYS 4 -8.300 28.930 -4.915 26 1HG LYS 4 1HG LYS 4 -8.942 30.189 -7.228 27 2HG LYS 4 2HG LYS 4 -9.675 28.635 -7.574 28 1HD LYS 4 1HD LYS 4 -11.086 28.752 -5.608 29 2HD LYS 4 2HD LYS 4 -10.189 30.109 -4.957 30 1HE LYS 4 1HE LYS 4 -10.905 31.429 -7.058 31 2HE LYS 4 2HE LYS 4 -11.994 30.104 -7.416 32 H THR 5 H THR 5 -6.761 30.592 -8.475 33 HA THR 5 HA THR 5 -6.820 28.481 -10.516 34 HB THR 5 HB THR 5 -7.717 30.251 -11.965 35 HG1 THR 5 1HG THR 5 -7.299 32.354 -11.351 36 1HG2 THR 5 1HG2 THR 5 -8.910 29.835 -9.258 37 2HG2 THR 5 2HG2 THR 5 -9.428 31.326 -10.080 38 3HG2 THR 5 3HG2 THR 5 -9.684 29.746 -10.858 39 H ASP 6 H ASP 6 -4.745 30.734 -8.918 40 HA ASP 6 HA ASP 6 -3.096 31.671 -10.756 41 1HB ASP 6 1HB ASP 6 -2.881 30.823 -7.979 42 2HB ASP 6 2HB ASP 6 -1.378 30.463 -8.805 43 HD2 ASP 6 HD ASP 6 -1.309 32.748 -10.477 44 H ALA 7 H ALA 7 -1.415 30.862 -12.132 45 HA ALA 7 HA ALA 7 -1.607 28.200 -12.957 46 1HB ALA 7 1HB ALA 7 0.188 30.549 -13.474 47 2HB ALA 7 2HB ALA 7 0.733 28.942 -14.013 48 3HB ALA 7 3HB ALA 7 -0.809 29.604 -14.607 49 H ALA 8 H ALA 8 0.229 29.797 -10.400 50 HA ALA 8 HA ALA 8 2.208 27.773 -10.160 51 1HB ALA 8 1HB ALA 8 2.180 29.012 -7.742 52 2HB ALA 8 3HB ALA 8 1.336 30.233 -8.725 53 3HB ALA 8 2HB ALA 8 2.969 29.694 -9.185 54 H THR 9 H THR 9 -0.918 28.534 -8.501 55 HA THR 9 HA THR 9 -0.728 26.318 -6.732 56 HB THR 9 HB THR 9 -2.046 28.482 -6.401 57 HG1 THR 9 1HG THR 9 -2.938 26.984 -5.034 58 1HG2 THR 9 2HG2 THR 9 -3.665 27.173 -8.614 59 2HG2 THR 9 3HG2 THR 9 -4.498 28.107 -7.348 60 3HG2 THR 9 1HG2 THR 9 -3.284 28.897 -8.383 61 H LEU 10 H LEU 10 -1.919 26.776 -10.043 62 HA LEU 10 HA LEU 10 -3.434 24.380 -10.076 63 1HB LEU 10 1HB LEU 10 -2.385 26.267 -12.167 64 2HB LEU 10 2HB LEU 10 -3.175 24.768 -12.613 65 HG LEU 10 HG LEU 10 -4.405 27.001 -10.973 66 1HD1 LEU 10 3HD1 LEU 10 -4.868 26.142 -13.841 67 2HD1 LEU 10 1HD1 LEU 10 -5.858 27.324 -12.951 68 3HD1 LEU 10 2HD1 LEU 10 -4.142 27.666 -13.279 69 1HD2 LEU 10 3HD2 LEU 10 -5.365 24.251 -11.686 70 2HD2 LEU 10 1HD2 LEU 10 -5.513 25.155 -10.159 71 3HD2 LEU 10 2HD2 LEU 10 -6.532 25.588 -11.552 72 H ALA 11 H ALA 11 -0.106 25.300 -11.165 73 HA ALA 11 HA ALA 11 0.522 22.738 -12.137 74 1HB ALA 11 2HB ALA 11 1.803 25.332 -11.720 75 2HB ALA 11 1HB ALA 11 2.125 24.093 -12.956 76 3HB ALA 11 3HB ALA 11 2.910 23.984 -11.362 77 H GLN 12 H GLN 12 0.451 24.205 -8.916 78 HA GLN 12 HA GLN 12 2.207 22.425 -7.697 79 1HB GLN 12 1HB GLN 12 1.078 24.693 -6.883 80 2HB GLN 12 2HB GLN 12 -0.137 23.621 -6.214 81 1HG GLN 12 1HG GLN 12 1.230 23.001 -4.508 82 2HG GLN 12 2HG GLN 12 2.530 22.596 -5.611 83 1HE2 GLN 12 1HE2 GLN 12 4.248 23.862 -5.756 84 2HE2 GLN 12 2HE2 GLN 12 4.445 25.416 -5.016 85 H GLU 13 H GLU 13 -1.282 22.291 -8.475 86 HA GLU 13 HA GLU 13 -1.452 19.754 -7.085 87 1HB GLU 13 1HB GLU 13 -3.633 21.440 -8.394 88 2HB GLU 13 2HB GLU 13 -3.906 19.970 -7.480 89 1HG GLU 13 1HG GLU 13 -2.695 22.563 -6.411 90 2HG GLU 13 2HG GLU 13 -4.289 21.935 -6.043 91 HE2 GLU 13 HE GLU 13 -2.099 19.114 -4.626 92 H ALA 14 H ALA 14 -1.542 21.260 -10.322 93 HA ALA 14 HA ALA 14 -2.547 19.089 -11.747 94 1HB ALA 14 3HB ALA 14 -2.237 21.476 -12.525 95 2HB ALA 14 1HB ALA 14 -0.497 21.134 -12.680 96 3HB ALA 14 2HB ALA 14 -1.671 20.243 -13.678 97 H GLY 15 H GLY 15 0.859 20.050 -10.944 98 1HA GLY 15 2HA GLY 15 2.720 18.801 -10.744 99 2HA GLY 15 1HA GLY 15 2.229 18.078 -12.263 100 H ASN 16 H ASN 16 0.293 17.858 -9.255 101 HA ASN 16 HA ASN 16 1.350 15.329 -8.569 102 1HB ASN 16 1HB ASN 16 0.466 16.381 -6.677 103 2HB ASN 16 2HB ASN 16 -0.818 17.162 -7.579 104 1HD2 ASN 16 1HD2 ASN 16 -2.611 16.578 -6.585 105 2HD2 ASN 16 2HD2 ASN 16 -3.140 14.958 -6.276 106 H PHE 17 H PHE 17 -1.351 16.645 -10.489 107 HA PHE 17 HA PHE 17 -2.838 14.228 -10.593 108 1HB PHE 17 1HB PHE 17 -3.785 16.523 -10.944 109 2HB PHE 17 2HB PHE 17 -2.696 16.790 -12.291 110 HD1 PHE 17 1HD PHE 17 -3.257 16.066 -14.473 111 HD2 PHE 17 2HD PHE 17 -5.610 14.804 -11.175 112 HE1 PHE 17 1HE PHE 17 -4.990 15.171 -16.052 113 HE2 PHE 17 2HE PHE 17 -7.343 13.909 -12.754 114 HZ PHE 17 HZ PHE 17 -7.013 14.103 -15.174 115 H GLU 18 H GLU 18 -0.756 15.999 -12.995 116 HA GLU 18 HA GLU 18 -0.921 14.416 -15.093 117 1HB GLU 18 1HB GLU 18 1.417 15.856 -13.854 118 2HB GLU 18 2HB GLU 18 1.724 14.833 -15.243 119 1HG GLU 18 1HG GLU 18 -0.645 16.392 -15.797 120 2HG GLU 18 2HG GLU 18 0.587 17.483 -15.194 121 HE2 GLU 18 HE GLU 18 1.621 14.691 -17.423 122 H ARG 19 H ARG 19 0.669 13.602 -12.008 123 HA ARG 19 HA ARG 19 2.006 11.355 -13.004 124 1HB ARG 19 1HB ARG 19 2.114 12.782 -10.670 125 2HB ARG 19 2HB ARG 19 1.165 11.416 -10.121 126 1HG ARG 19 1HG ARG 19 2.890 9.860 -10.553 127 2HG ARG 19 2HG ARG 19 3.666 10.890 -11.740 128 1HD ARG 19 1HD ARG 19 4.969 11.881 -10.156 129 2HD ARG 19 2HD ARG 19 3.588 12.227 -9.136 130 HE ARG 19 HE ARG 19 4.370 9.404 -9.094 131 2HH1 ARG 19 1HH ARG 19 5.721 9.553 -5.898 132 1HH2 ARG 19 2HH2 ARG 19 4.942 12.582 -7.637 133 2HH2 ARG 19 1HH2 ARG 19 5.575 11.930 -6.163 134 H ILE 20 H ILE 20 -1.121 11.882 -11.252 135 HA ILE 20 HA ILE 20 -1.815 9.214 -10.950 136 HB ILE 20 HB ILE 20 -3.571 11.646 -11.304 137 1HG1 ILE 20 1HG1 ILE 20 -2.788 10.382 -8.683 138 2HG1 ILE 20 2HG1 ILE 20 -1.751 11.570 -9.447 139 1HG2 ILE 20 3HG2 ILE 20 -4.175 8.863 -10.284 140 2HG2 ILE 20 1HG2 ILE 20 -5.210 10.277 -9.969 141 3HG2 ILE 20 2HG2 ILE 20 -4.935 9.730 -11.640 142 1HD1 ILE 20 3HD1 ILE 20 -4.047 12.942 -9.668 143 2HD1 ILE 20 1HD1 ILE 20 -4.507 11.913 -8.289 144 3HD1 ILE 20 2HD1 ILE 20 -3.087 12.979 -8.169 145 H SER 21 H SER 21 -2.595 11.544 -13.618 146 HA SER 21 HA SER 21 -4.075 9.775 -15.103 147 1HB SER 21 1HB SER 21 -2.536 12.290 -15.658 148 2HB SER 21 2HB SER 21 -3.000 11.333 -17.051 149 HG SER 21 HG SER 21 -4.967 11.893 -15.044 150 H GLY 22 H GLY 22 -0.523 10.456 -15.081 151 1HA GLY 22 2HA GLY 22 1.227 9.297 -15.880 152 2HA GLY 22 1HA GLY 22 0.222 8.879 -17.253 153 H ASP 23 H ASP 23 0.365 8.033 -13.711 154 HA ASP 23 HA ASP 23 1.109 5.445 -14.069 155 1HB ASP 23 1HB ASP 23 -0.539 6.843 -11.936 156 2HB ASP 23 2HB ASP 23 -0.222 5.124 -11.810 157 HD2 ASP 23 HD ASP 23 2.276 6.742 -9.874 158 H LEU 24 H LEU 24 -2.140 7.000 -14.102 159 HA LEU 24 HA LEU 24 -3.725 4.744 -13.981 160 1HB LEU 24 1HB LEU 24 -3.983 7.541 -14.816 161 2HB LEU 24 2HB LEU 24 -5.082 6.459 -15.649 162 HG LEU 24 HG LEU 24 -4.833 6.542 -12.635 163 1HD1 LEU 24 1HD1 LEU 24 -5.738 8.648 -14.177 164 2HD1 LEU 24 2HD1 LEU 24 -7.232 7.774 -13.760 165 3HD1 LEU 24 3HD1 LEU 24 -6.143 8.340 -12.471 166 1HD2 LEU 24 3HD2 LEU 24 -6.235 4.844 -14.475 167 2HD2 LEU 24 1HD2 LEU 24 -6.163 4.770 -12.698 168 3HD2 LEU 24 2HD2 LEU 24 -7.409 5.759 -13.498 169 H LYS 25 H LYS 25 -2.121 6.325 -16.803 170 HA LYS 25 HA LYS 25 -3.247 4.570 -18.697 171 1HB LYS 25 1HB LYS 25 -0.689 6.182 -18.908 172 2HB LYS 25 2HB LYS 25 -1.643 5.542 -20.232 173 1HG LYS 25 1HG LYS 25 -3.418 7.058 -18.541 174 2HG LYS 25 2HG LYS 25 -1.990 8.036 -18.814 175 1HD LYS 25 1HD LYS 25 -3.186 6.616 -21.190 176 2HD LYS 25 2HD LYS 25 -4.048 8.004 -20.555 177 1HE LYS 25 1HE LYS 25 -1.121 7.983 -21.437 178 2HE LYS 25 2HE LYS 25 -2.452 8.677 -22.340 179 H THR 26 H THR 26 -0.146 4.598 -16.846 180 HA THR 26 HA THR 26 1.061 2.436 -18.065 181 HB THR 26 HB THR 26 1.172 3.858 -15.419 182 HG1 THR 26 1HG THR 26 3.050 2.831 -17.431 183 1HG2 THR 26 1HG2 THR 26 1.949 1.001 -15.809 184 2HG2 THR 26 2HG2 THR 26 3.255 2.052 -15.214 185 3HG2 THR 26 3HG2 THR 26 1.735 1.916 -14.298 186 H GLN 27 H GLN 27 -1.073 2.384 -15.129 187 HA GLN 27 HA GLN 27 -1.032 -0.322 -14.812 188 1HB GLN 27 1HB GLN 27 -3.314 1.626 -14.257 189 2HB GLN 27 2HB GLN 27 -3.219 0.001 -13.608 190 1HG GLN 27 1HG GLN 27 -1.078 2.135 -13.166 191 2HG GLN 27 2HG GLN 27 -2.375 1.807 -12.034 192 1HE2 GLN 27 1HE2 GLN 27 0.548 0.631 -13.516 193 2HE2 GLN 27 2HE2 GLN 27 0.876 -0.677 -12.429 194 H ILE 28 H ILE 28 -3.360 1.696 -16.731 195 HA ILE 28 HA ILE 28 -5.020 -0.312 -17.579 196 HB ILE 28 HB ILE 28 -4.176 2.333 -18.670 197 1HG1 ILE 28 1HG1 ILE 28 -6.943 1.319 -18.002 198 2HG1 ILE 28 2HG1 ILE 28 -5.857 1.926 -16.769 199 1HG2 ILE 28 3HG2 ILE 28 -4.396 0.897 -20.658 200 2HG2 ILE 28 1HG2 ILE 28 -6.034 0.439 -20.135 201 3HG2 ILE 28 2HG2 ILE 28 -5.678 2.129 -20.567 202 1HD1 ILE 28 3HD1 ILE 28 -5.604 3.957 -18.540 203 2HD1 ILE 28 1HD1 ILE 28 -7.235 3.401 -18.986 204 3HD1 ILE 28 2HD1 ILE 28 -6.896 3.917 -17.316 205 H ASP 29 H ASP 29 -1.819 0.711 -18.871 206 HA ASP 29 HA ASP 29 -1.895 -0.875 -21.126 207 1HB ASP 29 1HB ASP 29 0.086 0.640 -19.577 208 2HB ASP 29 2HB ASP 29 0.798 -0.820 -20.235 209 HD2 ASP 29 HD ASP 29 1.914 1.085 -21.230 210 H GLN 30 H GLN 30 -0.804 -1.453 -17.727 211 HA GLN 30 HA GLN 30 0.431 -3.862 -18.085 212 1HB GLN 30 1HB GLN 30 -1.237 -2.955 -15.696 213 2HB GLN 30 2HB GLN 30 -0.048 -4.242 -15.668 214 1HG GLN 30 1HG GLN 30 0.453 -1.277 -16.164 215 2HG GLN 30 2HG GLN 30 1.026 -2.239 -14.816 216 1HE2 GLN 30 1HE2 GLN 30 2.562 -0.653 -16.640 217 2HE2 GLN 30 2HE2 GLN 30 3.687 -1.689 -17.452 218 H VAL 31 H VAL 31 -3.045 -3.220 -17.231 219 HA VAL 31 HA VAL 31 -3.818 -5.897 -17.227 220 HB VAL 31 HB VAL 31 -5.280 -3.296 -17.660 221 1HG1 VAL 31 1HG1 VAL 31 -6.513 -5.086 -18.826 222 2HG1 VAL 31 2HG1 VAL 31 -6.515 -6.052 -17.332 223 3HG1 VAL 31 3HG1 VAL 31 -7.390 -4.504 -17.391 224 1HG2 VAL 31 2HG2 VAL 31 -4.187 -4.366 -15.390 225 2HG2 VAL 31 3HG2 VAL 31 -5.562 -3.236 -15.423 226 3HG2 VAL 31 1HG2 VAL 31 -5.853 -4.988 -15.310 227 H GLU 32 H GLU 32 -4.203 -3.370 -19.817 228 HA GLU 32 HA GLU 32 -5.307 -4.921 -21.709 229 1HB GLU 32 1HB GLU 32 -3.480 -2.543 -21.755 230 2HB GLU 32 2HB GLU 32 -3.712 -3.381 -23.277 231 1HG GLU 32 1HG GLU 32 -6.267 -3.254 -22.749 232 2HG GLU 32 2HG GLU 32 -5.831 -2.084 -21.519 233 HE2 GLU 32 HE GLU 32 -6.917 -0.556 -22.740 234 H SER 33 H SER 33 -1.833 -4.722 -20.788 235 HA SER 33 HA SER 33 -1.043 -6.431 -22.905 236 1HB SER 33 1HB SER 33 0.235 -4.934 -20.704 237 2HB SER 33 2HB SER 33 1.005 -6.480 -21.003 238 HG SER 33 HG SER 33 0.736 -5.622 -23.421 239 H THR 34 H THR 34 -1.256 -6.754 -19.284 240 HA THR 34 HA THR 34 -0.577 -9.429 -19.125 241 HB THR 34 HB THR 34 -2.106 -7.418 -17.476 242 HG1 THR 34 1HG THR 34 -0.239 -7.876 -16.206 243 1HG2 THR 34 3HG2 THR 34 -3.352 -9.623 -17.171 244 2HG2 THR 34 1HG2 THR 34 -1.802 -10.367 -16.709 245 3HG2 THR 34 2HG2 THR 34 -2.501 -9.073 -15.707 246 H ALA 35 H ALA 35 -3.835 -7.942 -19.614 247 HA ALA 35 HA ALA 35 -5.306 -10.262 -19.515 248 1HB ALA 35 2HB ALA 35 -7.018 -8.978 -20.457 249 2HB ALA 35 3HB ALA 35 -5.952 -7.729 -19.768 250 3HB ALA 35 1HB ALA 35 -5.902 -8.079 -21.513 251 H GLY 36 H GLY 36 -3.009 -9.121 -21.932 252 1HA GLY 36 2HA GLY 36 -2.146 -10.160 -23.734 253 2HA GLY 36 1HA GLY 36 -3.814 -10.336 -24.242 254 H SER 37 H SER 37 -1.971 -11.828 -21.487 255 HA SER 37 HA SER 37 -1.788 -14.314 -22.751 256 1HB SER 37 1HB SER 37 -1.748 -14.039 -19.745 257 2HB SER 37 2HB SER 37 -0.747 -15.045 -20.772 258 HG SER 37 HG SER 37 -0.245 -12.530 -19.837 259 H LEU 38 H LEU 38 -4.202 -12.737 -20.655 260 HA LEU 38 HA LEU 38 -5.591 -15.077 -19.933 261 1HB LEU 38 1HB LEU 38 -6.137 -12.139 -19.902 262 2HB LEU 38 2HB LEU 38 -7.471 -13.249 -19.657 263 HG LEU 38 HG LEU 38 -6.893 -12.964 -17.490 264 1HD1 LEU 38 3HD1 LEU 38 -6.475 -15.363 -18.073 265 2HD1 LEU 38 1HD1 LEU 38 -4.738 -14.983 -18.159 266 3HD1 LEU 38 2HD1 LEU 38 -5.616 -14.790 -16.623 267 1HD2 LEU 38 2HD2 LEU 38 -4.083 -12.396 -18.447 268 2HD2 LEU 38 3HD2 LEU 38 -5.264 -11.271 -17.733 269 3HD2 LEU 38 1HD2 LEU 38 -4.513 -12.532 -16.725 270 H GLN 39 H GLN 39 -6.521 -12.480 -22.307 271 HA GLN 39 HA GLN 39 -8.588 -13.831 -23.418 272 1HB GLN 39 1HB GLN 39 -7.938 -12.428 -25.540 273 2HB GLN 39 2HB GLN 39 -8.404 -11.592 -24.072 274 1HG GLN 39 1HG GLN 39 -5.581 -12.105 -23.887 275 2HG GLN 39 2HG GLN 39 -5.882 -11.474 -25.494 276 1HE2 GLN 39 1HE2 GLN 39 -7.610 -10.874 -22.454 277 2HE2 GLN 39 2HE2 GLN 39 -7.330 -9.167 -22.367 278 H GLY 40 H GLY 40 -5.121 -14.366 -23.809 279 1HA GLY 40 2HA GLY 40 -3.963 -15.618 -25.351 280 2HA GLY 40 1HA GLY 40 -5.452 -16.003 -26.191 281 H GLN 41 H GLN 41 -6.135 -16.432 -22.931 282 HA GLN 41 HA GLN 41 -5.717 -19.279 -23.232 283 1HB GLN 41 1HB GLN 41 -4.596 -17.551 -21.020 284 2HB GLN 41 2HB GLN 41 -5.066 -19.200 -20.660 285 1HG GLN 41 1HG GLN 41 -2.912 -19.659 -21.333 286 2HG GLN 41 2HG GLN 41 -3.644 -19.672 -22.925 287 1HE2 GLN 41 1HE2 GLN 41 -1.642 -17.970 -20.671 288 2HE2 GLN 41 2HE2 GLN 41 -1.037 -16.742 -21.733 289 H TRP 42 H TRP 42 -7.842 -19.931 -23.266 290 HA TRP 42 HA TRP 42 -9.378 -19.609 -20.890 291 1HB TRP 42 1HB TRP 42 -10.254 -18.126 -23.372 292 2HB TRP 42 2HB TRP 42 -11.321 -18.522 -22.040 293 HD1 TRP 42 HD TRP 42 -9.329 -15.700 -23.175 294 HE1 TRP 42 1HE TRP 42 -8.746 -13.942 -21.296 295 HE3 TRP 42 3HE TRP 42 -10.508 -18.716 -19.255 296 HZ2 TRP 42 2HZ TRP 42 -8.842 -14.008 -18.444 297 HZ3 TRP 42 3HZ TRP 42 -10.234 -17.792 -16.956 298 HH2 TRP 42 HH TRP 42 -9.433 -15.524 -16.518 299 H ARG 43 H ARG 43 -11.028 -21.219 -20.831 300 HA ARG 43 HA ARG 43 -10.593 -23.312 -22.660 301 1HB ARG 43 1HB ARG 43 -12.534 -22.868 -20.354 302 2HB ARG 43 2HB ARG 43 -12.639 -24.310 -21.345 303 1HG ARG 43 1HG ARG 43 -11.179 -25.098 -19.725 304 2HG ARG 43 2HG ARG 43 -10.004 -24.443 -20.848 305 1HD ARG 43 1HD ARG 43 -9.650 -22.482 -19.536 306 2HD ARG 43 2HD ARG 43 -11.159 -22.674 -18.667 307 HE ARG 43 HE ARG 43 -10.072 -24.090 -17.160 308 2HH1 ARG 43 1HH ARG 43 -6.965 -25.640 -17.222 309 1HH2 ARG 43 2HH2 ARG 43 -8.150 -23.926 -20.132 310 2HH2 ARG 43 1HH2 ARG 43 -6.833 -24.843 -19.478 311 H GLY 44 H GLY 44 -13.914 -22.408 -21.652 312 1HA GLY 44 2HA GLY 44 -15.254 -23.009 -23.905 313 2HA GLY 44 1HA GLY 44 -14.635 -21.411 -24.273 314 H ALA 45 H ALA 45 -14.696 -20.193 -21.692 315 HA ALA 45 HA ALA 45 -17.481 -19.592 -21.546 316 1HB ALA 45 3HB ALA 45 -17.308 -21.712 -20.198 317 2HB ALA 45 1HB ALA 45 -16.179 -20.870 -19.109 318 3HB ALA 45 2HB ALA 45 -17.860 -20.303 -19.261 319 H ALA 46 H ALA 46 -14.381 -19.508 -19.642 320 HA ALA 46 HA ALA 46 -14.877 -16.864 -18.736 321 1HB ALA 46 3HB ALA 46 -12.400 -17.093 -18.067 322 2HB ALA 46 1HB ALA 46 -13.539 -18.265 -17.362 323 3HB ALA 46 2HB ALA 46 -12.497 -18.745 -18.723 324 H GLY 47 H GLY 47 -13.563 -18.310 -21.652 325 1HA GLY 47 2HA GLY 47 -12.717 -17.417 -23.531 326 2HA GLY 47 1HA GLY 47 -11.824 -16.306 -22.511 327 H THR 48 H THR 48 -15.203 -16.863 -23.735 328 HA THR 48 HA THR 48 -15.407 -14.375 -24.963 329 HB THR 48 HB THR 48 -17.849 -14.982 -25.015 330 HG1 THR 48 1HG THR 48 -17.026 -17.325 -23.515 331 1HG2 THR 48 2HG2 THR 48 -16.185 -16.245 -26.518 332 2HG2 THR 48 3HG2 THR 48 -16.148 -17.512 -25.268 333 3HG2 THR 48 1HG2 THR 48 -17.668 -17.145 -26.119 334 H ALA 49 H ALA 49 -15.785 -15.316 -21.580 335 HA ALA 49 HA ALA 49 -17.267 -13.010 -20.840 336 1HB ALA 49 3HB ALA 49 -15.685 -15.141 -19.378 337 2HB ALA 49 2HB ALA 49 -17.447 -14.896 -19.423 338 3HB ALA 49 1HB ALA 49 -16.414 -13.765 -18.516 339 H ALA 50 H ALA 50 -13.779 -13.982 -20.509 340 HA ALA 50 HA ALA 50 -13.031 -11.416 -19.547 341 1HB ALA 50 2HB ALA 50 -11.032 -12.436 -19.170 342 2HB ALA 50 3HB ALA 50 -11.944 -13.926 -19.508 343 3HB ALA 50 1HB ALA 50 -10.980 -13.162 -20.795 344 H GLN 51 H GLN 51 -12.471 -13.168 -22.687 345 HA GLN 51 HA GLN 51 -11.175 -11.291 -24.042 346 1HB GLN 51 1HB GLN 51 -11.624 -13.351 -25.136 347 2HB GLN 51 2HB GLN 51 -13.356 -13.205 -24.914 348 1HG GLN 51 1HG GLN 51 -12.083 -10.999 -26.480 349 2HG GLN 51 2HG GLN 51 -12.048 -12.575 -27.246 350 1HE2 GLN 51 1HE2 GLN 51 -13.907 -9.854 -26.403 351 2HE2 GLN 51 2HE2 GLN 51 -15.453 -10.368 -26.991 352 H ALA 52 H ALA 52 -14.794 -11.470 -23.744 353 HA ALA 52 HA ALA 52 -15.254 -9.101 -25.179 354 1HB ALA 52 2HB ALA 52 -16.971 -10.795 -24.883 355 2HB ALA 52 1HB ALA 52 -17.523 -9.284 -24.121 356 3HB ALA 52 3HB ALA 52 -16.901 -10.613 -23.114 357 H ALA 53 H ALA 53 -14.854 -9.840 -21.665 358 HA ALA 53 HA ALA 53 -15.453 -7.294 -20.724 359 1HB ALA 53 1HB ALA 53 -13.476 -9.306 -19.581 360 2HB ALA 53 3HB ALA 53 -15.242 -9.414 -19.392 361 3HB ALA 53 2HB ALA 53 -14.354 -8.039 -18.691 362 H VAL 54 H VAL 54 -12.545 -8.658 -22.258 363 HA VAL 54 HA VAL 54 -10.837 -6.528 -21.470 364 HB VAL 54 HB VAL 54 -10.580 -8.502 -23.747 365 1HG1 VAL 54 2HG1 VAL 54 -9.057 -6.422 -23.629 366 2HG1 VAL 54 3HG1 VAL 54 -8.326 -7.207 -22.209 367 3HG1 VAL 54 1HG1 VAL 54 -8.284 -8.017 -23.793 368 1HG2 VAL 54 2HG2 VAL 54 -10.800 -9.096 -21.034 369 2HG2 VAL 54 3HG2 VAL 54 -10.108 -10.142 -22.298 370 3HG2 VAL 54 1HG2 VAL 54 -9.045 -9.088 -21.334 371 H VAL 55 H VAL 55 -12.491 -7.411 -24.585 372 HA VAL 55 HA VAL 55 -11.712 -5.248 -26.056 373 HB VAL 55 HB VAL 55 -14.227 -6.902 -26.009 374 1HG1 VAL 55 3HG1 VAL 55 -13.875 -4.351 -27.309 375 2HG1 VAL 55 1HG1 VAL 55 -14.015 -5.638 -28.531 376 3HG1 VAL 55 2HG1 VAL 55 -15.290 -5.431 -27.305 377 1HG2 VAL 55 1HG2 VAL 55 -11.623 -7.353 -26.952 378 2HG2 VAL 55 2HG2 VAL 55 -13.078 -8.318 -27.298 379 3HG2 VAL 55 3HG2 VAL 55 -12.592 -7.012 -28.405 380 H ARG 56 H ARG 56 -14.672 -5.529 -23.965 381 HA ARG 56 HA ARG 56 -15.579 -3.001 -24.403 382 1HB ARG 56 1HB ARG 56 -15.770 -4.838 -21.976 383 2HB ARG 56 2HB ARG 56 -16.599 -3.295 -22.014 384 1HG ARG 56 1HG ARG 56 -17.443 -4.215 -24.405 385 2HG ARG 56 2HG ARG 56 -17.106 -5.767 -23.664 386 1HD ARG 56 1HD ARG 56 -19.080 -5.646 -22.552 387 2HD ARG 56 2HD ARG 56 -18.494 -4.242 -21.684 388 HE ARG 56 HE ARG 56 -19.269 -3.200 -24.137 389 2HH1 ARG 56 1HH ARG 56 -22.708 -2.883 -23.772 390 1HH2 ARG 56 2HH2 ARG 56 -20.903 -5.149 -21.671 391 2HH2 ARG 56 1HH2 ARG 56 -22.474 -4.517 -22.035 392 H PHE 57 H PHE 57 -13.355 -4.230 -21.807 393 HA PHE 57 HA PHE 57 -13.038 -1.814 -20.480 394 1HB PHE 57 1HB PHE 57 -12.159 -3.681 -19.337 395 2HB PHE 57 2HB PHE 57 -11.656 -4.466 -20.821 396 HD1 PHE 57 1HD PHE 57 -10.749 -1.679 -18.533 397 HD2 PHE 57 2HD PHE 57 -9.409 -4.453 -21.452 398 HE1 PHE 57 1HE PHE 57 -8.373 -1.002 -18.086 399 HE2 PHE 57 2HE PHE 57 -7.034 -3.776 -21.005 400 HZ PHE 57 HZ PHE 57 -6.544 -2.059 -19.327 401 H GLN 58 H GLN 58 -11.198 -3.275 -23.229 402 HA GLN 58 HA GLN 58 -9.185 -1.413 -23.296 403 1HB GLN 58 1HB GLN 58 -10.465 -2.945 -25.603 404 2HB GLN 58 2HB GLN 58 -8.921 -2.122 -25.694 405 1HG GLN 58 1HG GLN 58 -8.742 -3.721 -23.360 406 2HG GLN 58 2HG GLN 58 -9.559 -4.738 -24.531 407 1HE2 GLN 58 1HE2 GLN 58 -7.160 -2.158 -24.984 408 2HE2 GLN 58 2HE2 GLN 58 -5.939 -3.119 -25.750 409 H GLU 59 H GLU 59 -12.251 -1.494 -25.260 410 HA GLU 59 HA GLU 59 -11.872 0.855 -26.568 411 1HB GLU 59 1HB GLU 59 -14.375 -0.581 -25.631 412 2HB GLU 59 2HB GLU 59 -14.492 0.920 -26.529 413 1HG GLU 59 1HG GLU 59 -12.855 -1.452 -27.527 414 2HG GLU 59 2HG GLU 59 -14.553 -1.258 -27.913 415 HE2 GLU 59 HE GLU 59 -14.378 -0.671 -30.025 416 H ALA 60 H ALA 60 -13.004 0.271 -23.226 417 HA ALA 60 HA ALA 60 -13.881 2.934 -22.790 418 1HB ALA 60 3HB ALA 60 -13.298 0.503 -21.097 419 2HB ALA 60 2HB ALA 60 -14.845 1.337 -21.376 420 3HB ALA 60 1HB ALA 60 -13.612 2.076 -20.326 421 H ALA 61 H ALA 61 -10.792 1.168 -22.538 422 HA ALA 61 HA ALA 61 -9.413 2.926 -20.907 423 1HB ALA 61 2HB ALA 61 -8.845 0.580 -22.039 424 2HB ALA 61 3HB ALA 61 -8.052 1.621 -23.245 425 3HB ALA 61 1HB ALA 61 -7.556 1.700 -21.538 426 H ASN 62 H ASN 62 -9.630 2.854 -24.537 427 HA ASN 62 HA ASN 62 -8.099 4.997 -25.063 428 1HB ASN 62 1HB ASN 62 -10.773 4.421 -26.440 429 2HB ASN 62 2HB ASN 62 -9.393 5.231 -27.154 430 1HD2 ASN 62 1HD2 ASN 62 -10.661 2.202 -25.938 431 2HD2 ASN 62 2HD2 ASN 62 -9.554 1.135 -26.735 432 H LYS 63 H LYS 63 -11.694 4.938 -24.452 433 HA LYS 63 HA LYS 63 -12.232 7.598 -24.683 434 1HB LYS 63 1HB LYS 63 -13.410 5.450 -22.915 435 2HB LYS 63 2HB LYS 63 -14.055 7.079 -22.943 436 1HG LYS 63 1HG LYS 63 -14.360 6.906 -25.429 437 2HG LYS 63 2HG LYS 63 -13.738 5.268 -25.384 438 1HD LYS 63 1HD LYS 63 -16.163 5.133 -25.383 439 2HD LYS 63 2HD LYS 63 -15.605 4.644 -23.795 440 1HE LYS 63 1HE LYS 63 -16.821 6.294 -22.825 441 2HE LYS 63 2HE LYS 63 -15.958 7.508 -23.749 442 H GLN 64 H GLN 64 -10.749 5.833 -21.929 443 HA GLN 64 HA GLN 64 -10.832 8.061 -20.222 444 1HB GLN 64 1HB GLN 64 -9.811 5.305 -20.172 445 2HB GLN 64 2HB GLN 64 -8.736 6.410 -19.338 446 1HG GLN 64 1HG GLN 64 -11.256 7.241 -18.460 447 2HG GLN 64 2HG GLN 64 -11.455 5.505 -18.589 448 1HE2 GLN 64 1HE2 GLN 64 -9.791 8.125 -17.033 449 2HE2 GLN 64 2HE2 GLN 64 -9.060 7.235 -15.739 450 H LYS 65 H LYS 65 -8.384 6.676 -22.475 451 HA LYS 65 HA LYS 65 -6.227 8.227 -21.750 452 1HB LYS 65 1HB LYS 65 -7.070 6.651 -24.098 453 2HB LYS 65 2HB LYS 65 -5.923 7.925 -24.461 454 1HG LYS 65 1HG LYS 65 -4.500 6.144 -23.884 455 2HG LYS 65 2HG LYS 65 -4.596 7.030 -22.376 456 1HD LYS 65 1HD LYS 65 -6.820 5.199 -22.440 457 2HD LYS 65 2HD LYS 65 -5.390 4.301 -22.909 458 1HE LYS 65 1HE LYS 65 -5.010 6.140 -20.586 459 2HE LYS 65 2HE LYS 65 -6.113 4.809 -20.299 460 H GLN 66 H GLN 66 -9.034 8.981 -23.867 461 HA GLN 66 HA GLN 66 -7.978 11.419 -24.745 462 1HB GLN 66 1HB GLN 66 -10.036 9.888 -25.559 463 2HB GLN 66 2HB GLN 66 -10.952 10.998 -24.560 464 1HG GLN 66 1HG GLN 66 -10.824 11.798 -26.910 465 2HG GLN 66 2HG GLN 66 -10.063 12.932 -25.812 466 1HE2 GLN 66 1HE2 GLN 66 -8.765 13.820 -27.369 467 2HE2 GLN 66 2HE2 GLN 66 -7.397 13.015 -28.063 468 H GLU 67 H GLU 67 -10.489 10.607 -22.240 469 HA GLU 67 HA GLU 67 -10.877 13.200 -21.409 470 1HB GLU 67 1HB GLU 67 -12.513 11.875 -20.514 471 2HB GLU 67 2HB GLU 67 -11.463 10.478 -20.387 472 1HG GLU 67 1HG GLU 67 -11.182 12.875 -18.526 473 2HG GLU 67 2HG GLU 67 -12.274 11.551 -18.171 474 HE2 GLU 67 HE GLU 67 -9.581 10.848 -16.349 475 H LEU 68 H LEU 68 -8.220 10.974 -20.852 476 HA LEU 68 HA LEU 68 -7.292 12.189 -18.456 477 1HB LEU 68 1HB LEU 68 -6.793 9.866 -19.859 478 2HB LEU 68 2HB LEU 68 -5.323 10.788 -20.102 479 HG LEU 68 HG LEU 68 -4.883 10.908 -17.764 480 1HD1 LEU 68 2HD1 LEU 68 -7.749 10.489 -17.517 481 2HD1 LEU 68 3HD1 LEU 68 -6.823 9.431 -16.425 482 3HD1 LEU 68 1HD1 LEU 68 -6.589 11.194 -16.366 483 1HD2 LEU 68 3HD2 LEU 68 -5.436 8.316 -19.020 484 2HD2 LEU 68 1HD2 LEU 68 -3.998 8.891 -18.143 485 3HD2 LEU 68 2HD2 LEU 68 -5.399 8.262 -17.242 486 H ASP 69 H ASP 69 -6.066 12.248 -21.881 487 HA ASP 69 HA ASP 69 -4.204 14.211 -21.410 488 1HB ASP 69 1HB ASP 69 -4.981 12.671 -23.561 489 2HB ASP 69 2HB ASP 69 -5.566 14.242 -24.071 490 HD2 ASP 69 HD ASP 69 -3.352 15.673 -24.965 491 H GLU 70 H GLU 70 -7.598 14.377 -22.720 492 HA GLU 70 HA GLU 70 -7.776 16.991 -23.283 493 1HB GLU 70 1HB GLU 70 -10.055 16.641 -23.373 494 2HB GLU 70 2HB GLU 70 -9.537 14.970 -23.272 495 1HG GLU 70 1HG GLU 70 -9.874 14.982 -20.813 496 2HG GLU 70 2HG GLU 70 -10.307 16.679 -20.860 497 HE2 GLU 70 HE GLU 70 -12.992 14.849 -23.069 498 H ILE 71 H ILE 71 -8.193 15.450 -20.033 499 HA ILE 71 HA ILE 71 -8.675 17.959 -18.764 500 HB ILE 71 HB ILE 71 -8.244 15.135 -17.843 501 1HG1 ILE 71 1HG1 ILE 71 -10.598 16.968 -17.364 502 2HG1 ILE 71 2HG1 ILE 71 -10.442 16.025 -18.833 503 1HG2 ILE 71 3HG2 ILE 71 -7.854 17.598 -16.285 504 2HG2 ILE 71 1HG2 ILE 71 -9.012 16.450 -15.571 505 3HG2 ILE 71 2HG2 ILE 71 -7.353 15.924 -15.946 506 1HD1 ILE 71 2HD1 ILE 71 -10.083 13.969 -17.287 507 2HD1 ILE 71 3HD1 ILE 71 -10.678 15.015 -15.975 508 3HD1 ILE 71 1HD1 ILE 71 -11.725 14.651 -17.368 509 H SER 72 H SER 72 -5.905 15.615 -18.858 510 HA SER 72 HA SER 72 -4.214 17.045 -17.281 511 1HB SER 72 1HB SER 72 -2.624 15.519 -17.944 512 2HB SER 72 2HB SER 72 -4.033 14.700 -18.589 513 HG SER 72 HG SER 72 -3.568 15.984 -20.635 514 H THR 73 H THR 73 -5.338 17.702 -20.548 515 HA THR 73 HA THR 73 -3.186 19.610 -21.036 516 HB THR 73 HB THR 73 -5.435 18.342 -22.646 517 HG1 THR 73 1HG THR 73 -3.535 17.209 -22.924 518 1HG2 THR 73 2HG2 THR 73 -4.453 21.031 -23.020 519 2HG2 THR 73 3HG2 THR 73 -3.706 20.002 -24.266 520 3HG2 THR 73 1HG2 THR 73 -5.479 20.083 -24.123 521 H ASN 74 H ASN 74 -6.642 19.462 -20.175 522 HA ASN 74 HA ASN 74 -7.402 21.975 -20.759 523 1HB ASN 74 1HB ASN 74 -8.146 19.926 -18.740 524 2HB ASN 74 2HB ASN 74 -8.541 21.555 -18.230 525 1HD2 ASN 74 1HD2 ASN 74 -9.321 18.927 -20.246 526 2HD2 ASN 74 2HD2 ASN 74 -10.662 19.610 -21.104 527 H ILE 75 H ILE 75 -5.118 20.820 -18.316 528 HA ILE 75 HA ILE 75 -5.218 23.110 -16.645 529 HB ILE 75 HB ILE 75 -2.977 21.113 -16.930 530 1HG1 ILE 75 1HG1 ILE 75 -5.071 19.883 -16.718 531 2HG1 ILE 75 2HG1 ILE 75 -4.112 19.744 -15.258 532 1HG2 ILE 75 3HG2 ILE 75 -2.774 23.297 -15.546 533 2HG2 ILE 75 1HG2 ILE 75 -3.862 22.476 -14.401 534 3HG2 ILE 75 2HG2 ILE 75 -2.290 21.750 -14.810 535 1HD1 ILE 75 3HD1 ILE 75 -6.335 21.805 -15.595 536 2HD1 ILE 75 1HD1 ILE 75 -6.582 20.200 -14.866 537 3HD1 ILE 75 2HD1 ILE 75 -5.487 21.370 -14.092 538 H ARG 76 H ARG 76 -2.861 21.957 -19.160 539 HA ARG 76 HA ARG 76 -1.247 24.148 -19.050 540 1HB ARG 76 1HB ARG 76 -1.961 22.265 -21.342 541 2HB ARG 76 2HB ARG 76 -0.743 23.511 -21.531 542 1HG ARG 76 1HG ARG 76 0.760 22.074 -20.626 543 2HG ARG 76 2HG ARG 76 -0.063 22.268 -19.092 544 1HD ARG 76 1HD ARG 76 -1.038 20.195 -19.210 545 2HD ARG 76 2HD ARG 76 -1.452 20.379 -20.903 546 HE ARG 76 HE ARG 76 0.971 19.143 -19.824 547 2HH1 ARG 76 1HH ARG 76 2.369 18.512 -22.940 548 1HH2 ARG 76 2HH2 ARG 76 -0.433 20.723 -22.668 549 2HH2 ARG 76 1HH2 ARG 76 0.685 19.999 -23.775 550 H GLN 77 H GLN 77 -4.422 23.686 -20.571 551 HA GLN 77 HA GLN 77 -4.191 25.982 -22.224 552 1HB GLN 77 1HB GLN 77 -6.632 24.338 -21.419 553 2HB GLN 77 2HB GLN 77 -6.619 25.564 -22.672 554 1HG GLN 77 1HG GLN 77 -4.414 23.786 -23.191 555 2HG GLN 77 2HG GLN 77 -5.818 22.791 -22.862 556 1HE2 GLN 77 1HE2 GLN 77 -4.392 23.200 -25.345 557 2HE2 GLN 77 2HE2 GLN 77 -5.518 23.811 -26.510 558 H ALA 78 H ALA 78 -5.113 25.284 -18.905 559 HA ALA 78 HA ALA 78 -6.811 27.473 -18.466 560 1HB ALA 78 2HB ALA 78 -4.960 26.156 -16.449 561 2HB ALA 78 3HB ALA 78 -6.535 26.930 -16.152 562 3HB ALA 78 1HB ALA 78 -6.455 25.387 -17.036 563 H GLY 79 H GLY 79 -3.336 27.160 -18.892 564 1HA GLY 79 2HA GLY 79 -3.046 30.012 -18.158 565 2HA GLY 79 1HA GLY 79 -2.217 29.231 -19.490 566 H VAL 80 H VAL 80 -2.048 26.702 -17.592 567 HA VAL 80 HA VAL 80 -0.072 27.683 -15.701 568 HB VAL 80 HB VAL 80 -0.867 24.816 -16.067 569 1HG1 VAL 80 2HG1 VAL 80 0.663 26.325 -14.183 570 2HG1 VAL 80 3HG1 VAL 80 -0.778 25.694 -13.351 571 3HG1 VAL 80 1HG1 VAL 80 0.321 24.578 -14.197 572 1HG2 VAL 80 2HG2 VAL 80 -2.692 26.997 -15.473 573 2HG2 VAL 80 3HG2 VAL 80 -3.029 25.269 -15.733 574 3HG2 VAL 80 1HG2 VAL 80 -2.586 25.854 -14.112 575 H GLN 81 H GLN 81 1.682 28.306 -17.018 576 HA GLN 81 HA GLN 81 3.068 26.023 -18.137 577 1HB GLN 81 1HB GLN 81 3.765 27.760 -20.042 578 2HB GLN 81 2HB GLN 81 2.322 26.778 -20.192 579 1HG GLN 81 1HG GLN 81 1.010 28.693 -19.117 580 2HG GLN 81 2HG GLN 81 2.464 29.667 -19.218 581 1HE2 GLN 81 1HE2 GLN 81 -0.336 29.421 -20.583 582 2HE2 GLN 81 2HE2 GLN 81 -0.005 29.696 -22.261 583 H TYR 82 H TYR 82 3.066 28.221 -15.818 584 HA TYR 82 HA TYR 82 5.945 28.423 -15.786 585 1HB TYR 82 1HB TYR 82 5.823 30.912 -15.540 586 2HB TYR 82 2HB TYR 82 5.089 30.449 -17.062 587 HD1 TYR 82 1HD TYR 82 2.476 30.076 -17.007 588 HD2 TYR 82 2HD TYR 82 4.656 32.317 -14.086 589 HE1 TYR 82 1HE TYR 82 0.347 31.297 -16.344 590 HE2 TYR 82 2HE TYR 82 2.520 33.530 -13.433 591 HH TYR 82 HH TYR 82 0.437 34.009 -14.140 592 H SER 83 H SER 83 5.768 27.051 -13.932 593 HA SER 83 HA SER 83 4.943 28.547 -11.601 594 1HB SER 83 1HB SER 83 2.973 27.246 -11.911 595 2HB SER 83 2HB SER 83 3.873 25.831 -12.418 596 HG SER 83 HG SER 83 3.062 25.653 -10.220 597 H ARG 84 H ARG 84 6.262 25.370 -12.795 598 HA ARG 84 HA ARG 84 7.995 25.286 -10.516 599 1HB ARG 84 1HB ARG 84 7.405 23.404 -12.833 600 2HB ARG 84 2HB ARG 84 8.779 23.108 -11.786 601 1HG ARG 84 1HG ARG 84 7.440 22.255 -10.165 602 2HG ARG 84 2HG ARG 84 6.456 23.705 -10.145 603 1HD ARG 84 1HD ARG 84 4.782 22.421 -11.007 604 2HD ARG 84 2HD ARG 84 5.657 22.474 -12.524 605 HE ARG 84 HE ARG 84 6.651 20.392 -10.729 606 2HH1 ARG 84 1HH ARG 84 5.211 17.776 -12.502 607 1HH2 ARG 84 2HH2 ARG 84 4.198 21.142 -13.173 608 2HH2 ARG 84 1HH2 ARG 84 3.950 19.485 -13.612 609 H ALA 85 H ALA 85 8.184 27.323 -12.861 610 HA ALA 85 HA ALA 85 10.568 26.640 -14.257 611 1HB ALA 85 3HB ALA 85 9.693 29.481 -13.991 612 2HB ALA 85 1HB ALA 85 10.130 28.550 -15.444 613 3HB ALA 85 2HB ALA 85 8.521 28.349 -14.708 614 H ASP 86 H ASP 86 11.412 26.006 -11.860 615 HA ASP 86 HA ASP 86 12.890 28.361 -10.978 616 1HB ASP 86 1HB ASP 86 11.096 27.107 -9.422 617 2HB ASP 86 2HB ASP 86 12.420 25.989 -9.166 618 HD2 ASP 86 HD ASP 86 12.282 26.894 -6.848 619 H GLU 87 H GLU 87 13.636 26.486 -13.114 620 HA GLU 87 HA GLU 87 15.552 24.734 -11.847 621 1HB GLU 87 1HB GLU 87 14.402 24.995 -14.629 622 2HB GLU 87 2HB GLU 87 15.928 24.159 -14.417 623 1HG GLU 87 1HG GLU 87 14.968 22.384 -13.279 624 2HG GLU 87 2HG GLU 87 13.763 23.389 -12.500 625 HE2 GLU 87 HE GLU 87 11.997 21.951 -13.318 626 H GLU 88 H GLU 88 15.561 27.899 -12.291 627 HA GLU 88 HA GLU 88 17.561 28.534 -14.027 628 1HB GLU 88 1HB GLU 88 15.982 29.926 -12.295 629 2HB GLU 88 2HB GLU 88 17.503 30.022 -11.430 630 1HG GLU 88 1HG GLU 88 17.706 30.550 -14.359 631 2HG GLU 88 2HG GLU 88 16.755 31.724 -13.471 632 HE2 GLU 88 HE GLU 88 20.546 31.222 -13.492 633 H GLN 89 H GLN 89 17.801 27.611 -10.529 634 HA GLN 89 HA GLN 89 20.674 27.604 -10.790 635 1HB GLN 89 1HB GLN 89 20.682 27.268 -8.351 636 2HB GLN 89 2HB GLN 89 19.653 28.620 -8.777 637 1HG GLN 89 1HG GLN 89 17.995 26.285 -8.861 638 2HG GLN 89 2HG GLN 89 18.947 26.163 -7.395 639 1HE2 GLN 89 1HE2 GLN 89 16.472 26.391 -6.854 640 2HE2 GLN 89 2HE2 GLN 89 15.967 27.979 -6.381 641 H GLN 90 H GLN 90 18.505 25.581 -11.940 642 HA GLN 90 HA GLN 90 19.410 23.175 -10.652 643 1HB GLN 90 1HB GLN 90 17.029 23.399 -11.264 644 2HB GLN 90 2HB GLN 90 17.454 23.638 -12.947 645 1HG GLN 90 1HG GLN 90 17.580 21.401 -13.298 646 2HG GLN 90 2HG GLN 90 18.735 21.212 -11.993 647 1HE2 GLN 90 1HE2 GLN 90 15.787 20.318 -13.094 648 2HE2 GLN 90 2HE2 GLN 90 14.997 19.848 -11.626 649 H GLN 91 H GLN 91 20.218 25.202 -13.365 650 HA GLN 91 HA GLN 91 21.394 23.068 -14.862 651 1HB GLN 91 1HB GLN 91 22.238 25.055 -16.283 652 2HB GLN 91 2HB GLN 91 20.506 24.798 -16.215 653 1HG GLN 91 1HG GLN 91 20.143 26.645 -14.788 654 2HG GLN 91 2HG GLN 91 21.782 26.625 -14.170 655 1HE2 GLN 91 1HE2 GLN 91 22.163 28.758 -14.596 656 2HE2 GLN 91 2HE2 GLN 91 22.378 29.407 -16.187 657 H ALA 92 H ALA 92 22.258 25.061 -12.187 658 HA ALA 92 HA ALA 92 25.085 25.067 -12.781 659 1HB ALA 92 2HB ALA 92 23.941 25.773 -10.096 660 2HB ALA 92 3HB ALA 92 25.250 26.552 -11.017 661 3HB ALA 92 1HB ALA 92 23.553 26.821 -11.482 662 H LEU 93 H LEU 93 22.672 23.141 -11.050 663 HA LEU 93 HA LEU 93 24.824 21.601 -9.800 664 1HB LEU 93 1HB LEU 93 22.693 22.599 -8.612 665 2HB LEU 93 2HB LEU 93 21.919 21.163 -9.251 666 HG LEU 93 HG LEU 93 24.419 20.466 -7.960 667 1HD1 LEU 93 2HD1 LEU 93 22.733 22.460 -6.589 668 2HD1 LEU 93 3HD1 LEU 93 23.135 21.017 -5.626 669 3HD1 LEU 93 1HD1 LEU 93 24.435 22.009 -6.329 670 1HD2 LEU 93 3HD2 LEU 93 21.977 19.306 -8.452 671 2HD2 LEU 93 1HD2 LEU 93 23.246 18.651 -7.389 672 3HD2 LEU 93 2HD2 LEU 93 21.914 19.609 -6.699 673 H SER 94 H SER 94 25.082 21.167 -12.370 674 HA SER 94 HA SER 94 23.876 18.558 -12.681 675 1HB SER 94 1HB SER 94 22.474 20.221 -13.966 676 2HB SER 94 2HB SER 94 23.888 20.638 -14.913 677 HG SER 94 HG SER 94 22.256 18.337 -15.018 678 H SER 95 H SER 95 25.931 20.953 -14.512 679 HA SER 95 HA SER 95 27.563 19.103 -15.665 680 1HB SER 95 1HB SER 95 29.244 21.044 -15.768 681 2HB SER 95 2HB SER 95 27.663 21.342 -16.463 682 HG SER 95 HG SER 95 27.835 23.103 -15.201 683 H GLN 96 H GLN 96 27.717 20.637 -12.420 684 HA GLN 96 HA GLN 96 30.279 19.760 -11.796 685 1HB GLN 96 1HB GLN 96 29.066 21.554 -10.572 686 2HB GLN 96 2HB GLN 96 27.927 20.375 -9.952 687 1HG GLN 96 1HG GLN 96 29.328 19.938 -8.227 688 2HG GLN 96 2HG GLN 96 30.531 19.350 -9.357 689 1HE2 GLN 96 1HE2 GLN 96 29.467 21.955 -7.362 690 2HE2 GLN 96 2HE2 GLN 96 30.835 23.004 -7.539 691 H MET 97 H MET 97 27.139 18.516 -10.431 692 HA MET 97 HA MET 97 28.154 16.271 -9.317 693 1HB MET 97 1HB MET 97 25.836 17.038 -8.966 694 2HB MET 97 2HB MET 97 25.447 16.795 -10.657 695 1HG MET 97 1HG MET 97 24.823 14.662 -10.200 696 2HG MET 97 2HG MET 97 26.462 14.291 -9.705 697 1HE MET 97 2HE MET 97 24.033 13.024 -8.975 698 2HE MET 97 3HE MET 97 24.213 12.696 -7.235 699 3HE MET 97 1HE MET 97 22.937 13.798 -7.805 700 H GLY 98 H GLY 98 29.418 14.713 -10.242 701 1HA GLY 98 2HA GLY 98 29.627 14.198 -12.961 702 2HA GLY 98 1HA GLY 98 28.422 13.088 -12.340 703 H PHE 99 H PHE 99 29.005 11.479 -10.749 704 HA PHE 99 HA PHE 99 31.876 11.284 -10.226 705 1HB PHE 99 1HB PHE 99 31.148 9.893 -8.348 706 2HB PHE 99 2HB PHE 99 30.064 11.269 -8.378 707 HD1 PHE 99 1HD PHE 99 27.760 10.999 -9.299 708 HD2 PHE 99 2HD PHE 99 30.340 7.683 -8.709 709 HE1 PHE 99 1HE PHE 99 25.792 9.446 -9.421 710 HE2 PHE 99 2HE PHE 99 28.372 6.130 -8.830 711 HZ PHE 99 HZ PHE 99 26.121 7.030 -9.185 712 H MET 601 H MET 601 7.133 -20.569 -20.147 713 HA MET 601 HA MET 601 9.509 -20.017 -20.593 714 1HB MET 601 1HB MET 601 9.551 -20.775 -17.792 715 2HB MET 601 2HB MET 601 10.547 -21.924 -18.664 716 1HG MET 601 1HG MET 601 11.473 -19.662 -19.829 717 2HG MET 601 2HG MET 601 10.926 -18.954 -18.322 718 1HE MET 601 2HE MET 601 13.418 -20.479 -20.238 719 2HE MET 601 3HE MET 601 14.316 -19.307 -19.244 720 3HE MET 601 1HE MET 601 14.704 -21.042 -19.144 721 H THR 602 H THR 602 8.082 -23.021 -19.143 722 HA THR 602 HA THR 602 9.417 -24.849 -20.753 723 HB THR 602 HB THR 602 8.070 -25.311 -18.663 724 HG1 THR 602 1HG THR 602 7.072 -27.254 -19.752 725 1HG2 THR 602 3HG2 THR 602 5.706 -25.063 -20.597 726 2HG2 THR 602 1HG2 THR 602 5.627 -25.637 -18.914 727 3HG2 THR 602 2HG2 THR 602 6.034 -23.938 -19.257 728 H GLU 603 H GLU 603 6.484 -22.893 -21.389 729 HA GLU 603 HA GLU 603 6.799 -23.664 -24.163 730 1HB GLU 603 1HB GLU 603 4.193 -23.828 -22.592 731 2HB GLU 603 2HB GLU 603 4.256 -23.834 -24.343 732 1HG GLU 603 1HG GLU 603 5.949 -25.799 -22.772 733 2HG GLU 603 2HG GLU 603 4.246 -26.127 -23.023 734 HE2 GLU 603 HE GLU 603 6.963 -27.008 -24.265 735 H GLN 604 H GLN 604 7.169 -21.766 -25.219 736 HA GLN 604 HA GLN 604 6.568 -19.310 -24.067 737 1HB GLN 604 1HB GLN 604 7.780 -20.319 -26.552 738 2HB GLN 604 2HB GLN 604 6.890 -18.832 -26.813 739 1HG GLN 604 1HG GLN 604 8.262 -17.583 -25.379 740 2HG GLN 604 2HG GLN 604 8.697 -18.972 -24.403 741 1HE2 GLN 604 1HE2 GLN 604 10.579 -17.196 -25.272 742 2HE2 GLN 604 2HE2 GLN 604 11.632 -17.926 -26.437 743 H GLN 605 H GLN 605 4.767 -21.491 -26.205 744 HA GLN 605 HA GLN 605 3.054 -19.888 -27.465 745 1HB GLN 605 1HB GLN 605 2.322 -22.456 -25.989 746 2HB GLN 605 2HB GLN 605 1.387 -21.739 -27.285 747 1HG GLN 605 1HG GLN 605 4.030 -21.897 -28.304 748 2HG GLN 605 2HG GLN 605 3.791 -23.406 -27.445 749 1HE2 GLN 605 1HE2 GLN 605 3.328 -24.902 -28.867 750 2HE2 GLN 605 2HE2 GLN 605 2.147 -24.815 -30.131 751 H TRP 606 H TRP 606 2.747 -20.998 -24.024 752 HA TRP 606 HA TRP 606 1.360 -18.555 -23.391 753 1HB TRP 606 1HB TRP 606 -0.683 -19.419 -22.722 754 2HB TRP 606 2HB TRP 606 -0.395 -20.160 -24.284 755 HD1 TRP 606 HD TRP 606 0.336 -22.854 -24.212 756 HE1 TRP 606 1HE TRP 606 -0.213 -24.810 -22.527 757 HE3 TRP 606 3HE TRP 606 -1.063 -19.847 -20.357 758 HZ2 TRP 606 2HZ TRP 606 -1.150 -24.878 -19.832 759 HZ3 TRP 606 3HZ TRP 606 -1.781 -20.939 -18.234 760 HH2 TRP 606 HH TRP 606 -1.839 -23.364 -17.937 761 H ASN 607 H ASN 607 2.843 -18.011 -21.811 762 HA ASN 607 HA ASN 607 4.102 -19.964 -20.249 763 1HB ASN 607 1HB ASN 607 5.261 -17.874 -20.567 764 2HB ASN 607 2HB ASN 607 3.864 -16.929 -20.092 765 1HD2 ASN 607 1HD2 ASN 607 5.447 -15.895 -18.696 766 2HD2 ASN 607 2HD2 ASN 607 5.777 -16.551 -17.127 767 H PHE 608 H PHE 608 2.706 -21.197 -18.916 768 HA PHE 608 HA PHE 608 0.359 -20.318 -17.792 769 1HB PHE 608 1HB PHE 608 0.455 -22.463 -16.817 770 2HB PHE 608 2HB PHE 608 1.748 -22.655 -17.983 771 HD1 PHE 608 1HD PHE 608 1.084 -21.753 -14.445 772 HD2 PHE 608 2HD PHE 608 3.935 -23.122 -17.275 773 HE1 PHE 608 1HE PHE 608 2.689 -22.260 -12.583 774 HE2 PHE 608 2HE PHE 608 5.540 -23.629 -15.413 775 HZ PHE 608 HZ PHE 608 4.898 -23.192 -13.089 776 H ALA 609 H ALA 609 3.712 -20.284 -16.437 777 HA ALA 609 HA ALA 609 2.923 -19.325 -13.906 778 1HB ALA 609 3HB ALA 609 5.570 -19.233 -15.408 779 2HB ALA 609 2HB ALA 609 5.034 -20.490 -14.267 780 3HB ALA 609 1HB ALA 609 5.367 -18.842 -13.683 781 H GLY 610 H GLY 610 2.907 -17.890 -17.012 782 1HA GLY 610 2HA GLY 610 3.273 -15.669 -17.652 783 2HA GLY 610 1HA GLY 610 3.367 -15.184 -15.970 784 H ILE 611 H ILE 611 0.929 -17.098 -17.880 785 HA ILE 611 HA ILE 611 -0.995 -15.025 -17.755 786 HB ILE 611 HB ILE 611 -0.886 -16.670 -19.551 787 1HG1 ILE 611 1HG1 ILE 611 -3.081 -15.519 -18.574 788 2HG1 ILE 611 2HG1 ILE 611 -3.120 -16.607 -19.947 789 1HG2 ILE 611 1HG2 ILE 611 -1.216 -18.584 -17.302 790 2HG2 ILE 611 2HG2 ILE 611 -2.073 -18.957 -18.816 791 3HG2 ILE 611 3HG2 ILE 611 -0.307 -18.736 -18.824 792 1HD1 ILE 611 3HD1 ILE 611 -3.303 -17.889 -17.243 793 2HD1 ILE 611 1HD1 ILE 611 -4.709 -16.937 -17.779 794 3HD1 ILE 611 2HD1 ILE 611 -4.137 -18.308 -18.759 795 H GLU 612 H GLU 612 0.083 -17.515 -15.554 796 HA GLU 612 HA GLU 612 -2.343 -17.757 -14.155 797 1HB GLU 612 1HB GLU 612 -0.755 -19.538 -13.946 798 2HB GLU 612 2HB GLU 612 0.545 -18.445 -13.514 799 1HG GLU 612 1HG GLU 612 -0.727 -17.860 -11.394 800 2HG GLU 612 2HG GLU 612 -1.914 -19.078 -11.815 801 HE2 GLU 612 HE GLU 612 0.967 -18.870 -10.013 802 H ALA 613 H ALA 613 0.678 -15.821 -13.670 803 HA ALA 613 HA ALA 613 -0.411 -14.552 -11.334 804 1HB ALA 613 1HB ALA 613 1.714 -13.487 -11.199 805 2HB ALA 613 3HB ALA 613 2.040 -13.744 -12.930 806 3HB ALA 613 2HB ALA 613 2.047 -15.126 -11.809 807 H ALA 614 H ALA 614 -0.444 -14.103 -14.811 808 HA ALA 614 HA ALA 614 -0.614 -11.410 -15.115 809 1HB ALA 614 1HB ALA 614 -1.778 -13.807 -16.471 810 2HB ALA 614 2HB ALA 614 -2.463 -12.221 -16.900 811 3HB ALA 614 3HB ALA 614 -0.723 -12.528 -17.117 812 H ALA 615 H ALA 615 -3.302 -13.684 -14.228 813 HA ALA 615 HA ALA 615 -5.318 -11.824 -14.071 814 1HB ALA 615 1HB ALA 615 -6.159 -13.929 -13.829 815 2HB ALA 615 2HB ALA 615 -4.721 -14.516 -12.960 816 3HB ALA 615 3HB ALA 615 -5.967 -13.587 -12.093 817 H SER 616 H SER 616 -3.094 -12.958 -11.427 818 HA SER 616 HA SER 616 -4.090 -11.362 -9.464 819 1HB SER 616 1HB SER 616 -1.906 -13.096 -9.797 820 2HB SER 616 2HB SER 616 -1.155 -11.573 -9.365 821 HG SER 616 HG SER 616 -3.425 -12.316 -7.834 822 H ALA 617 H ALA 617 -1.996 -10.566 -12.222 823 HA ALA 617 HA ALA 617 -1.086 -8.082 -11.192 824 1HB ALA 617 1HB ALA 617 -0.398 -9.753 -13.265 825 2HB ALA 617 3HB ALA 617 0.168 -8.076 -13.084 826 3HB ALA 617 2HB ALA 617 -1.229 -8.436 -14.126 827 H ILE 618 H ILE 618 -3.882 -9.208 -13.137 828 HA ILE 618 HA ILE 618 -4.754 -6.680 -13.946 829 HB ILE 618 HB ILE 618 -6.256 -9.260 -13.490 830 1HG1 ILE 618 1HG1 ILE 618 -4.364 -9.342 -15.118 831 2HG1 ILE 618 2HG1 ILE 618 -5.934 -9.695 -15.812 832 1HG2 ILE 618 3HG2 ILE 618 -7.556 -6.982 -13.583 833 2HG2 ILE 618 1HG2 ILE 618 -7.215 -7.095 -15.326 834 3HG2 ILE 618 2HG2 ILE 618 -8.122 -8.392 -14.511 835 1HD1 ILE 618 2HD1 ILE 618 -5.307 -6.814 -15.894 836 2HD1 ILE 618 3HD1 ILE 618 -4.119 -7.806 -16.773 837 3HD1 ILE 618 1HD1 ILE 618 -5.844 -7.895 -17.202 838 H GLN 619 H GLN 619 -5.386 -8.648 -10.994 839 HA GLN 619 HA GLN 619 -7.357 -7.052 -9.949 840 1HB GLN 619 1HB GLN 619 -5.603 -9.195 -9.040 841 2HB GLN 619 2HB GLN 619 -5.818 -8.015 -7.762 842 1HG GLN 619 1HG GLN 619 -8.095 -9.320 -9.329 843 2HG GLN 619 2HG GLN 619 -7.573 -9.811 -7.729 844 1HE2 GLN 619 1HE2 GLN 619 -9.732 -7.999 -9.423 845 2HE2 GLN 619 2HE2 GLN 619 -10.247 -6.869 -8.214 846 H GLY 620 H GLY 620 -3.799 -7.008 -9.166 847 1HA GLY 620 2HA GLY 620 -2.455 -5.348 -8.471 848 2HA GLY 620 1HA GLY 620 -3.816 -4.772 -7.529 849 H ASN 621 H ASN 621 -3.809 -5.061 -11.109 850 HA ASN 621 HA ASN 621 -3.142 -2.351 -11.499 851 1HB ASN 621 1HB ASN 621 -4.057 -4.665 -13.200 852 2HB ASN 621 2HB ASN 621 -4.318 -3.064 -13.863 853 1HD2 ASN 621 1HD2 ASN 621 -2.245 -1.598 -13.074 854 2HD2 ASN 621 2HD2 ASN 621 -0.736 -2.210 -13.664 855 H VAL 622 H VAL 622 -6.101 -4.298 -11.070 856 HA VAL 622 HA VAL 622 -7.922 -2.407 -12.100 857 HB VAL 622 HB VAL 622 -8.132 -4.776 -10.250 858 1HG1 VAL 622 2HG1 VAL 622 -10.257 -2.801 -11.060 859 2HG1 VAL 622 3HG1 VAL 622 -10.672 -4.510 -10.784 860 3HG1 VAL 622 1HG1 VAL 622 -9.948 -3.547 -9.474 861 1HG2 VAL 622 3HG2 VAL 622 -7.797 -4.660 -12.959 862 2HG2 VAL 622 1HG2 VAL 622 -8.587 -5.998 -12.092 863 3HG2 VAL 622 2HG2 VAL 622 -9.571 -4.712 -12.830 864 H THR 623 H THR 623 -6.936 -3.265 -8.707 865 HA THR 623 HA THR 623 -8.428 -1.228 -7.499 866 HB THR 623 HB THR 623 -6.963 -1.780 -5.548 867 HG1 THR 623 1HG THR 623 -5.111 -3.141 -6.053 868 1HG2 THR 623 1HG2 THR 623 -8.660 -3.571 -6.723 869 2HG2 THR 623 2HG2 THR 623 -7.123 -4.447 -6.923 870 3HG2 THR 623 3HG2 THR 623 -7.677 -3.981 -5.297 871 H SER 624 H SER 624 -5.164 -1.251 -8.960 872 HA SER 624 HA SER 624 -4.198 1.047 -7.902 873 1HB SER 624 1HB SER 624 -3.903 -0.125 -10.696 874 2HB SER 624 2HB SER 624 -2.980 1.267 -10.167 875 HG SER 624 HG SER 624 -2.644 -0.462 -8.202 876 H ILE 625 H ILE 625 -6.316 0.627 -10.819 877 HA ILE 625 HA ILE 625 -6.461 3.418 -11.317 878 HB ILE 625 HB ILE 625 -7.624 0.928 -12.413 879 1HG1 ILE 625 1HG1 ILE 625 -7.026 3.008 -14.310 880 2HG1 ILE 625 2HG1 ILE 625 -5.711 2.888 -13.158 881 1HG2 ILE 625 3HG2 ILE 625 -9.019 3.597 -12.569 882 2HG2 ILE 625 1HG2 ILE 625 -9.176 2.372 -13.852 883 3HG2 ILE 625 2HG2 ILE 625 -9.697 1.994 -12.192 884 1HD1 ILE 625 1HD1 ILE 625 -5.776 0.342 -13.524 885 2HD1 ILE 625 2HD1 ILE 625 -6.865 0.669 -14.894 886 3HD1 ILE 625 3HD1 ILE 625 -5.206 1.315 -14.901 887 H HIS 626 H HIS 626 -8.204 1.094 -9.288 888 HA HIS 626 HA HIS 626 -10.552 2.535 -8.961 889 1HB HIS 626 1HB HIS 626 -10.036 0.143 -8.291 890 2HB HIS 626 2HB HIS 626 -9.215 0.787 -6.883 891 HD1 HIS 626 1HD HIS 626 -11.121 -0.623 -5.560 892 HD2 HIS 626 2HD HIS 626 -12.426 2.764 -7.662 893 HE1 HIS 626 1HE HIS 626 -13.436 -0.062 -4.645 894 H SER 627 H SER 627 -7.435 2.603 -7.119 895 HA SER 627 HA SER 627 -8.427 4.683 -5.449 896 1HB SER 627 1HB SER 627 -5.932 3.056 -5.676 897 2HB SER 627 2HB SER 627 -5.728 4.654 -4.986 898 HG SER 627 HG SER 627 -6.908 2.389 -3.888 899 H LEU 628 H LEU 628 -6.084 4.329 -8.182 900 HA LEU 628 HA LEU 628 -4.972 6.788 -8.258 901 1HB LEU 628 1HB LEU 628 -5.661 4.714 -10.238 902 2HB LEU 628 2HB LEU 628 -5.385 6.312 -10.903 903 HG LEU 628 HG LEU 628 -3.382 5.144 -8.992 904 1HD1 LEU 628 2HD1 LEU 628 -4.092 4.019 -11.583 905 2HD1 LEU 628 3HD1 LEU 628 -2.392 4.541 -11.515 906 3HD1 LEU 628 1HD1 LEU 628 -3.017 3.389 -10.311 907 1HD2 LEU 628 3HD2 LEU 628 -3.265 7.120 -11.280 908 2HD2 LEU 628 1HD2 LEU 628 -3.013 7.427 -9.544 909 3HD2 LEU 628 2HD2 LEU 628 -1.825 6.469 -10.460 910 H LEU 629 H LEU 629 -8.117 5.869 -9.833 911 HA LEU 629 HA LEU 629 -8.759 8.370 -10.767 912 1HB LEU 629 1HB LEU 629 -10.036 5.829 -10.375 913 2HB LEU 629 2HB LEU 629 -11.145 7.109 -9.925 914 HG LEU 629 HG LEU 629 -11.314 6.346 -12.300 915 1HD1 LEU 629 2HD1 LEU 629 -10.931 9.163 -11.436 916 2HD1 LEU 629 3HD1 LEU 629 -11.009 8.856 -13.187 917 3HD1 LEU 629 1HD1 LEU 629 -12.353 8.352 -12.134 918 1HD2 LEU 629 1HD2 LEU 629 -8.474 6.855 -12.243 919 2HD2 LEU 629 2HD2 LEU 629 -9.461 6.045 -13.482 920 3HD2 LEU 629 3HD2 LEU 629 -9.255 7.812 -13.525 921 H ASP 630 H ASP 630 -9.324 6.917 -7.511 922 HA ASP 630 HA ASP 630 -10.808 9.046 -6.545 923 1HB ASP 630 1HB ASP 630 -9.284 6.737 -5.413 924 2HB ASP 630 2HB ASP 630 -9.539 8.068 -4.302 925 HD2 ASP 630 HD ASP 630 -11.726 6.329 -3.211 926 H GLU 631 H GLU 631 -7.341 8.478 -7.038 927 HA GLU 631 HA GLU 631 -6.484 10.467 -5.221 928 1HB GLU 631 1HB GLU 631 -5.284 8.480 -6.976 929 2HB GLU 631 2HB GLU 631 -4.462 10.014 -7.175 930 1HG GLU 631 1HG GLU 631 -4.947 8.565 -4.529 931 2HG GLU 631 2HG GLU 631 -3.411 8.702 -5.362 932 HE2 GLU 631 HE GLU 631 -3.228 12.061 -5.170 933 H GLY 632 H GLY 632 -6.844 10.253 -8.823 934 1HA GLY 632 2HA GLY 632 -6.863 11.847 -10.414 935 2HA GLY 632 1HA GLY 632 -5.980 12.903 -9.329 936 H LYS 633 H LYS 633 -9.149 11.382 -8.580 937 HA LYS 633 HA LYS 633 -10.790 13.451 -9.401 938 1HB LYS 633 1HB LYS 633 -11.403 11.093 -8.662 939 2HB LYS 633 2HB LYS 633 -11.281 11.663 -7.010 940 1HG LYS 633 1HG LYS 633 -13.606 11.857 -7.682 941 2HG LYS 633 2HG LYS 633 -12.956 13.479 -7.554 942 1HD LYS 633 1HD LYS 633 -12.393 12.792 -10.211 943 2HD LYS 633 2HD LYS 633 -13.952 12.040 -9.937 944 1HE LYS 633 1HE LYS 633 -14.992 14.125 -9.364 945 2HE LYS 633 2HE LYS 633 -13.454 14.923 -9.105 946 H GLN 634 H GLN 634 -8.711 13.095 -6.538 947 HA GLN 634 HA GLN 634 -9.927 15.204 -5.125 948 1HB GLN 634 1HB GLN 634 -7.280 13.737 -4.870 949 2HB GLN 634 2HB GLN 634 -7.671 15.086 -3.823 950 1HG GLN 634 1HG GLN 634 -9.792 12.984 -4.111 951 2HG GLN 634 2HG GLN 634 -8.342 12.502 -3.252 952 1HE2 GLN 634 1HE2 GLN 634 -7.512 14.295 -1.705 953 2HE2 GLN 634 2HE2 GLN 634 -8.690 14.975 -0.633 954 H SER 635 H SER 635 -7.654 14.998 -7.775 955 HA SER 635 HA SER 635 -6.612 17.626 -7.248 956 1HB SER 635 1HB SER 635 -5.798 15.306 -8.782 957 2HB SER 635 2HB SER 635 -5.851 16.696 -9.849 958 HG SER 635 HG SER 635 -3.825 16.156 -8.407 959 H LEU 636 H LEU 636 -9.150 16.019 -9.067 960 HA LEU 636 HA LEU 636 -9.471 17.753 -11.193 961 1HB LEU 636 1HB LEU 636 -10.955 15.660 -9.859 962 2HB LEU 636 2HB LEU 636 -12.029 16.943 -10.380 963 HG LEU 636 HG LEU 636 -11.684 15.025 -11.994 964 1HD1 LEU 636 1HD1 LEU 636 -11.192 17.886 -12.837 965 2HD1 LEU 636 2HD1 LEU 636 -11.470 16.562 -13.993 966 3HD1 LEU 636 3HD1 LEU 636 -12.728 16.987 -12.808 967 1HD2 LEU 636 1HD2 LEU 636 -8.999 15.460 -11.514 968 2HD2 LEU 636 2HD2 LEU 636 -9.689 14.475 -12.827 969 3HD2 LEU 636 3HD2 LEU 636 -9.246 16.173 -13.126 970 H THR 637 H THR 637 -10.930 17.884 -7.873 971 HA THR 637 HA THR 637 -12.241 20.347 -8.356 972 HB THR 637 HB THR 637 -13.169 19.071 -6.607 973 HG1 THR 637 1HG THR 637 -12.742 20.450 -4.830 974 1HG2 THR 637 3HG2 THR 637 -10.277 18.431 -5.958 975 2HG2 THR 637 1HG2 THR 637 -11.489 18.354 -4.657 976 3HG2 THR 637 2HG2 THR 637 -11.663 17.323 -6.098 977 H LYS 638 H LYS 638 -8.924 19.510 -7.738 978 HA LYS 638 HA LYS 638 -8.324 22.128 -6.662 979 1HB LYS 638 1HB LYS 638 -6.665 19.666 -7.242 980 2HB LYS 638 2HB LYS 638 -5.953 21.186 -6.740 981 1HG LYS 638 1HG LYS 638 -7.658 21.117 -4.760 982 2HG LYS 638 2HG LYS 638 -7.906 19.438 -5.194 983 1HD LYS 638 1HD LYS 638 -5.142 20.610 -4.646 984 2HD LYS 638 2HD LYS 638 -6.127 19.881 -3.394 985 1HE LYS 638 1HE LYS 638 -6.254 17.905 -5.291 986 2HE LYS 638 2HE LYS 638 -4.683 18.582 -5.673 987 H LEU 639 H LEU 639 -8.186 20.300 -9.719 988 HA LEU 639 HA LEU 639 -6.711 22.451 -10.986 989 1HB LEU 639 1HB LEU 639 -7.651 19.729 -11.856 990 2HB LEU 639 2HB LEU 639 -7.034 20.900 -13.004 991 HG LEU 639 HG LEU 639 -5.094 19.815 -12.607 992 1HD1 LEU 639 1HD1 LEU 639 -4.824 22.145 -11.736 993 2HD1 LEU 639 2HD1 LEU 639 -5.049 21.499 -10.092 994 3HD1 LEU 639 3HD1 LEU 639 -3.665 20.967 -11.076 995 1HD2 LEU 639 1HD2 LEU 639 -6.428 18.282 -10.959 996 2HD2 LEU 639 2HD2 LEU 639 -4.648 18.316 -10.916 997 3HD2 LEU 639 3HD2 LEU 639 -5.586 19.227 -9.708 998 H ALA 640 H ALA 640 -9.930 21.704 -10.152 999 HA ALA 640 HA ALA 640 -11.453 22.316 -12.302 1000 1HB ALA 640 2HB ALA 640 -11.922 21.867 -9.696 1001 2HB ALA 640 1HB ALA 640 -13.141 22.600 -10.765 1002 3HB ALA 640 3HB ALA 640 -12.151 23.632 -9.705 1003 H ALA 641 H ALA 641 -9.713 24.613 -10.119 1004 HA ALA 641 HA ALA 641 -10.693 26.963 -11.167 1005 1HB ALA 641 1HB ALA 641 -9.013 27.960 -9.927 1006 2HB ALA 641 2HB ALA 641 -9.039 26.349 -9.172 1007 3HB ALA 641 3HB ALA 641 -7.800 26.742 -10.388 1008 H ALA 642 H ALA 642 -8.343 24.640 -12.472 1009 HA ALA 642 HA ALA 642 -7.108 26.301 -14.334 1010 1HB ALA 642 1HB ALA 642 -6.647 23.837 -13.522 1011 2HB ALA 642 3HB ALA 642 -6.212 24.320 -15.179 1012 3HB ALA 642 2HB ALA 642 -7.705 23.397 -14.885 1013 H TRP 643 H TRP 643 -10.347 24.949 -14.165 1014 HA TRP 643 HA TRP 643 -10.793 25.408 -17.002 1015 1HB TRP 643 1HB TRP 643 -12.379 24.133 -14.789 1016 2HB TRP 643 2HB TRP 643 -13.145 24.604 -16.293 1017 HD1 TRP 643 HD TRP 643 -12.687 23.037 -18.420 1018 HE1 TRP 643 1HE TRP 643 -11.509 20.716 -18.855 1019 HE3 TRP 643 3HE TRP 643 -10.341 22.791 -13.916 1020 HZ2 TRP 643 2HZ TRP 643 -9.768 19.075 -17.301 1021 HZ3 TRP 643 3HZ TRP 643 -8.921 20.795 -13.454 1022 HH2 TRP 643 HH TRP 643 -8.616 18.977 -15.059 1023 H GLY 644 H GLY 644 -10.878 27.036 -13.958 1024 1HA GLY 644 2HA GLY 644 -12.890 28.967 -14.921 1025 2HA GLY 644 1HA GLY 644 -11.283 29.503 -14.471 1026 H GLY 645 H GLY 645 -12.591 26.729 -12.743 1027 1HA GLY 645 2HA GLY 645 -13.907 28.192 -10.672 1028 2HA GLY 645 1HA GLY 645 -12.268 27.767 -10.220 1029 H SER 646 H SER 646 -13.965 26.597 -8.599 1030 HA SER 646 HA SER 646 -14.164 23.888 -9.649 1031 1HB SER 646 1HB SER 646 -14.387 23.589 -6.933 1032 2HB SER 646 2HB SER 646 -12.876 23.484 -7.814 1033 HG SER 646 HG SER 646 -13.495 25.218 -5.881 1034 H GLY 647 H GLY 647 -16.271 24.814 -10.641 1035 1HA GLY 647 2HA GLY 647 -18.421 25.490 -8.889 1036 2HA GLY 647 1HA GLY 647 -18.494 23.807 -9.371 1037 H SER 648 H SER 648 -17.054 26.354 -11.432 1038 HA SER 648 HA SER 648 -19.240 27.136 -12.827 1039 1HB SER 648 1HB SER 648 -16.318 27.023 -13.299 1040 2HB SER 648 2HB SER 648 -17.258 27.039 -14.778 1041 HG SER 648 HG SER 648 -16.602 29.166 -13.514 1042 H GLU 649 H GLU 649 -20.292 26.422 -14.782 1043 HA GLU 649 HA GLU 649 -20.785 23.768 -14.957 1044 1HB GLU 649 1HB GLU 649 -22.233 25.435 -15.987 1045 2HB GLU 649 2HB GLU 649 -20.972 25.927 -17.099 1046 1HG GLU 649 1HG GLU 649 -21.640 24.343 -18.573 1047 2HG GLU 649 2HG GLU 649 -21.275 23.090 -17.404 1048 HE2 GLU 649 HE GLU 649 -24.533 23.926 -18.837 1049 H ALA 650 H ALA 650 -18.199 25.680 -16.524 1050 HA ALA 650 HA ALA 650 -17.387 23.921 -18.467 1051 1HB ALA 650 1HB ALA 650 -16.343 26.218 -17.016 1052 2HB ALA 650 3HB ALA 650 -16.033 25.702 -18.691 1053 3HB ALA 650 2HB ALA 650 -15.051 25.043 -17.360 1054 H TYR 651 H TYR 651 -15.729 24.238 -15.248 1055 HA TYR 651 HA TYR 651 -14.336 21.883 -15.401 1056 1HB TYR 651 1HB TYR 651 -13.822 23.414 -13.628 1057 2HB TYR 651 2HB TYR 651 -15.513 23.706 -13.271 1058 HD1 TYR 651 1HD TYR 651 -13.163 20.767 -13.230 1059 HD2 TYR 651 2HD TYR 651 -16.241 22.948 -11.212 1060 HE1 TYR 651 1HE TYR 651 -13.036 19.149 -11.273 1061 HE2 TYR 651 2HE TYR 651 -16.104 21.323 -9.262 1062 HH TYR 651 HH TYR 651 -14.547 19.811 -8.288 1063 H GLN 652 H GLN 652 -17.738 22.452 -14.444 1064 HA GLN 652 HA GLN 652 -18.180 20.053 -13.183 1065 1HB GLN 652 1HB GLN 652 -19.996 21.899 -14.774 1066 2HB GLN 652 2HB GLN 652 -20.616 20.459 -13.991 1067 1HG GLN 652 1HG GLN 652 -19.013 21.733 -12.021 1068 2HG GLN 652 2HG GLN 652 -19.885 23.034 -12.806 1069 1HE2 GLN 652 1HE2 GLN 652 -19.981 20.692 -10.457 1070 2HE2 GLN 652 2HE2 GLN 652 -21.683 20.616 -10.143 1071 H GLY 653 H GLY 653 -18.693 20.947 -16.669 1072 1HA GLY 653 2HA GLY 653 -18.747 19.689 -18.529 1073 2HA GLY 653 1HA GLY 653 -19.601 18.491 -17.577 1074 H VAL 654 H VAL 654 -16.356 19.521 -16.583 1075 HA VAL 654 HA VAL 654 -15.041 17.404 -18.003 1076 HB VAL 654 HB VAL 654 -14.211 19.475 -15.978 1077 1HG1 VAL 654 2HG1 VAL 654 -12.571 17.205 -17.134 1078 2HG1 VAL 654 3HG1 VAL 654 -11.846 18.684 -16.459 1079 3HG1 VAL 654 1HG1 VAL 654 -12.828 17.621 -15.422 1080 1HG2 VAL 654 2HG2 VAL 654 -14.561 19.588 -18.728 1081 2HG2 VAL 654 3HG2 VAL 654 -13.607 20.721 -17.741 1082 3HG2 VAL 654 1HG2 VAL 654 -12.808 19.348 -18.542 1083 H GLN 655 H GLN 655 -15.991 18.134 -14.587 1084 HA GLN 655 HA GLN 655 -14.864 16.001 -13.379 1085 1HB GLN 655 1HB GLN 655 -17.078 17.844 -12.837 1086 2HB GLN 655 2HB GLN 655 -17.385 16.267 -12.137 1087 1HG GLN 655 1HG GLN 655 -14.594 17.124 -11.726 1088 2HG GLN 655 2HG GLN 655 -15.734 18.276 -11.061 1089 1HE2 GLN 655 1HE2 GLN 655 -14.431 17.342 -9.162 1090 2HE2 GLN 655 2HE2 GLN 655 -15.166 16.039 -8.288 1091 H GLN 656 H GLN 656 -17.891 16.132 -15.308 1092 HA GLN 656 HA GLN 656 -18.667 13.514 -14.636 1093 1HB GLN 656 1HB GLN 656 -19.553 15.645 -16.530 1094 2HB GLN 656 2HB GLN 656 -19.973 14.008 -16.992 1095 1HG GLN 656 1HG GLN 656 -21.756 14.239 -15.592 1096 2HG GLN 656 2HG GLN 656 -20.609 14.002 -14.288 1097 1HE2 GLN 656 1HE2 GLN 656 -21.084 16.705 -16.549 1098 2HE2 GLN 656 2HE2 GLN 656 -21.385 17.934 -15.367 1099 H LYS 657 H LYS 657 -16.681 15.003 -17.214 1100 HA LYS 657 HA LYS 657 -16.578 12.704 -18.848 1101 1HB LYS 657 1HB LYS 657 -14.963 15.244 -18.650 1102 2HB LYS 657 2HB LYS 657 -14.499 13.960 -19.748 1103 1HG LYS 657 1HG LYS 657 -17.046 14.047 -20.497 1104 2HG LYS 657 2HG LYS 657 -17.023 15.637 -19.760 1105 1HD LYS 657 1HD LYS 657 -14.809 14.901 -21.685 1106 2HD LYS 657 2HD LYS 657 -16.385 15.308 -22.335 1107 1HE LYS 657 1HE LYS 657 -16.249 17.431 -20.803 1108 2HE LYS 657 2HE LYS 657 -14.543 17.057 -20.660 1109 H TRP 658 H TRP 658 -14.705 13.893 -16.042 1110 HA TRP 658 HA TRP 658 -12.594 12.044 -16.317 1111 1HB TRP 658 1HB TRP 658 -12.185 13.968 -15.040 1112 2HB TRP 658 2HB TRP 658 -13.628 13.753 -14.069 1113 HD1 TRP 658 HD TRP 658 -13.442 12.039 -11.976 1114 HE1 TRP 658 1HE TRP 658 -11.458 10.885 -10.675 1115 HE3 TRP 658 3HE TRP 658 -9.892 12.981 -15.493 1116 HZ2 TRP 658 2HZ TRP 658 -8.688 10.504 -11.249 1117 HZ3 TRP 658 3HZ TRP 658 -7.573 12.184 -15.045 1118 HH2 TRP 658 HH TRP 658 -6.947 10.984 -13.009 1119 H ASP 659 H ASP 659 -15.511 12.157 -14.136 1120 HA ASP 659 HA ASP 659 -15.101 9.613 -13.127 1121 1HB ASP 659 1HB ASP 659 -16.990 11.731 -12.852 1122 2HB ASP 659 2HB ASP 659 -17.935 10.318 -13.279 1123 HD2 ASP 659 HD ASP 659 -17.043 8.288 -11.418 1124 H ALA 660 H ALA 660 -16.672 10.896 -16.060 1125 HA ALA 660 HA ALA 660 -18.345 8.835 -16.751 1126 1HB ALA 660 3HB ALA 660 -18.479 10.734 -18.091 1127 2HB ALA 660 1HB ALA 660 -16.713 10.868 -18.261 1128 3HB ALA 660 2HB ALA 660 -17.600 9.615 -19.161 1129 H THR 661 H THR 661 -15.384 9.177 -18.726 1130 HA THR 661 HA THR 661 -15.171 6.505 -19.324 1131 HB THR 661 HB THR 661 -12.869 7.152 -20.051 1132 HG1 THR 661 1HG THR 661 -12.725 8.473 -17.930 1133 1HG2 THR 661 3HG2 THR 661 -15.221 8.401 -20.931 1134 2HG2 THR 661 1HG2 THR 661 -14.163 9.773 -20.524 1135 3HG2 THR 661 2HG2 THR 661 -13.625 8.556 -21.705 1136 H ALA 662 H ALA 662 -14.294 8.167 -16.352 1137 HA ALA 662 HA ALA 662 -12.366 6.440 -15.385 1138 1HB ALA 662 3HB ALA 662 -12.656 8.359 -14.118 1139 2HB ALA 662 2HB ALA 662 -13.542 7.181 -13.120 1140 3HB ALA 662 1HB ALA 662 -14.432 8.278 -14.203 1141 H THR 663 H THR 663 -15.664 6.405 -13.940 1142 HA THR 663 HA THR 663 -15.586 3.845 -13.026 1143 HB THR 663 HB THR 663 -17.371 5.241 -12.304 1144 HG1 THR 663 1HG THR 663 -18.573 3.676 -14.461 1145 1HG2 THR 663 3HG2 THR 663 -17.381 6.116 -15.099 1146 2HG2 THR 663 1HG2 THR 663 -19.022 5.653 -14.586 1147 3HG2 THR 663 2HG2 THR 663 -18.126 6.900 -13.685 1148 H GLU 664 H GLU 664 -16.000 4.919 -16.364 1149 HA GLU 664 HA GLU 664 -17.171 2.591 -17.317 1150 1HB GLU 664 1HB GLU 664 -17.166 4.633 -18.639 1151 2HB GLU 664 2HB GLU 664 -15.414 4.682 -18.664 1152 1HG GLU 664 1HG GLU 664 -16.019 3.779 -20.788 1153 2HG GLU 664 2HG GLU 664 -15.492 2.393 -19.854 1154 HE2 GLU 664 HE GLU 664 -17.872 3.543 -21.690 1155 H LEU 665 H LEU 665 -13.702 3.645 -17.145 1156 HA LEU 665 HA LEU 665 -12.799 1.119 -18.144 1157 1HB LEU 665 1HB LEU 665 -11.722 3.378 -18.502 1158 2HB LEU 665 2HB LEU 665 -11.190 3.308 -16.834 1159 HG LEU 665 HG LEU 665 -9.425 2.645 -18.399 1160 1HD1 LEU 665 2HD1 LEU 665 -10.143 1.370 -16.048 1161 2HD1 LEU 665 3HD1 LEU 665 -9.826 0.028 -17.174 1162 3HD1 LEU 665 1HD1 LEU 665 -8.573 1.258 -16.879 1163 1HD2 LEU 665 2HD2 LEU 665 -11.056 1.659 -20.086 1164 2HD2 LEU 665 3HD2 LEU 665 -9.533 0.774 -19.826 1165 3HD2 LEU 665 1HD2 LEU 665 -11.042 0.188 -19.085 1166 H ASN 666 H ASN 666 -13.631 2.529 -15.036 1167 HA ASN 666 HA ASN 666 -12.023 0.844 -13.487 1168 1HB ASN 666 1HB ASN 666 -13.732 3.018 -13.026 1169 2HB ASN 666 2HB ASN 666 -14.603 1.695 -12.276 1170 1HD2 ASN 666 1HD2 ASN 666 -13.210 4.022 -11.138 1171 2HD2 ASN 666 2HD2 ASN 666 -12.061 3.414 -9.993 1172 H ASN 667 H ASN 667 -15.552 0.855 -14.400 1173 HA ASN 667 HA ASN 667 -16.228 -1.459 -13.093 1174 1HB ASN 667 1HB ASN 667 -17.330 -0.166 -15.636 1175 2HB ASN 667 2HB ASN 667 -18.096 -1.557 -14.895 1176 1HD2 ASN 667 1HD2 ASN 667 -18.501 1.545 -15.225 1177 2HD2 ASN 667 2HD2 ASN 667 -19.139 2.035 -13.691 1178 H ALA 668 H ALA 668 -15.295 -0.874 -16.568 1179 HA ALA 668 HA ALA 668 -15.478 -3.430 -17.515 1180 1HB ALA 668 3HB ALA 668 -14.644 -0.986 -18.456 1181 2HB ALA 668 1HB ALA 668 -13.119 -1.904 -18.446 1182 3HB ALA 668 2HB ALA 668 -14.520 -2.516 -19.358 1183 H LEU 669 H LEU 669 -12.728 -1.855 -15.769 1184 HA LEU 669 HA LEU 669 -10.989 -4.026 -15.966 1185 1HB LEU 669 1HB LEU 669 -11.139 -1.472 -14.613 1186 2HB LEU 669 2HB LEU 669 -10.434 -2.690 -13.570 1187 HG LEU 669 HG LEU 669 -9.425 -2.397 -16.384 1188 1HD1 LEU 669 1HD1 LEU 669 -9.568 -0.155 -14.927 1189 2HD1 LEU 669 2HD1 LEU 669 -8.050 -0.817 -14.274 1190 3HD1 LEU 669 3HD1 LEU 669 -8.212 -0.518 -16.021 1191 1HD2 LEU 669 1HD2 LEU 669 -8.803 -4.231 -14.601 1192 2HD2 LEU 669 2HD2 LEU 669 -7.560 -3.514 -15.655 1193 3HD2 LEU 669 3HD2 LEU 669 -7.736 -2.950 -13.976 1194 H GLN 670 H GLN 670 -13.629 -3.231 -13.676 1195 HA GLN 670 HA GLN 670 -12.985 -5.193 -11.820 1196 1HB GLN 670 1HB GLN 670 -15.311 -3.446 -12.435 1197 2HB GLN 670 2HB GLN 670 -15.723 -4.925 -11.590 1198 1HG GLN 670 1HG GLN 670 -13.416 -4.016 -10.253 1199 2HG GLN 670 2HG GLN 670 -14.301 -2.543 -10.598 1200 1HE2 GLN 670 1HE2 GLN 670 -13.761 -4.243 -8.141 1201 2HE2 GLN 670 2HE2 GLN 670 -15.302 -4.449 -7.379 1202 H ASN 671 H ASN 671 -15.332 -5.186 -14.592 1203 HA ASN 671 HA ASN 671 -16.077 -7.849 -14.165 1204 1HB ASN 671 1HB ASN 671 -17.233 -5.907 -15.553 1205 2HB ASN 671 2HB ASN 671 -16.214 -6.454 -16.869 1206 1HD2 ASN 671 1HD2 ASN 671 -16.889 -8.049 -18.094 1207 2HD2 ASN 671 2HD2 ASN 671 -18.177 -9.155 -17.750 1208 H LEU 672 H LEU 672 -13.405 -6.201 -15.778 1209 HA LEU 672 HA LEU 672 -12.747 -8.328 -17.555 1210 1HB LEU 672 1HB LEU 672 -12.154 -6.127 -18.175 1211 2HB LEU 672 2HB LEU 672 -11.355 -5.818 -16.646 1212 HG LEU 672 HG LEU 672 -9.884 -6.198 -18.693 1213 1HD1 LEU 672 1HD1 LEU 672 -9.158 -6.263 -16.278 1214 2HD1 LEU 672 2HD1 LEU 672 -9.295 -8.035 -16.364 1215 3HD1 LEU 672 3HD1 LEU 672 -8.142 -7.179 -17.416 1216 1HD2 LEU 672 3HD2 LEU 672 -11.306 -8.257 -19.364 1217 2HD2 LEU 672 1HD2 LEU 672 -9.540 -8.314 -19.582 1218 3HD2 LEU 672 2HD2 LEU 672 -10.293 -9.136 -18.194 1219 H ALA 673 H ALA 673 -11.716 -7.246 -14.280 1220 HA ALA 673 HA ALA 673 -9.773 -9.368 -14.122 1221 1HB ALA 673 1HB ALA 673 -10.196 -6.861 -12.901 1222 2HB ALA 673 2HB ALA 673 -10.435 -8.061 -11.609 1223 3HB ALA 673 3HB ALA 673 -8.911 -8.036 -12.528 1224 H ARG 674 H ARG 674 -13.175 -8.956 -13.649 1225 HA ARG 674 HA ARG 674 -13.474 -10.735 -11.514 1226 1HB ARG 674 1HB ARG 674 -15.301 -9.554 -13.621 1227 2HB ARG 674 2HB ARG 674 -15.905 -10.875 -12.641 1228 1HG ARG 674 1HG ARG 674 -14.532 -8.835 -11.013 1229 2HG ARG 674 2HG ARG 674 -15.865 -8.155 -11.925 1230 1HD ARG 674 1HD ARG 674 -17.355 -10.008 -11.039 1231 2HD ARG 674 2HD ARG 674 -16.019 -10.567 -10.053 1232 HE ARG 674 HE ARG 674 -16.221 -7.866 -9.415 1233 2HH1 ARG 674 1HH ARG 674 -18.797 -7.854 -7.085 1234 1HH2 ARG 674 2HH2 ARG 674 -18.476 -10.599 -9.359 1235 2HH2 ARG 674 1HH2 ARG 674 -19.413 -9.959 -8.051 1236 H THR 675 H THR 675 -13.063 -11.076 -15.015 1237 HA THR 675 HA THR 675 -13.697 -13.942 -14.816 1238 HB THR 675 HB THR 675 -13.413 -12.157 -17.288 1239 HG1 THR 675 1HG THR 675 -15.441 -11.535 -16.663 1240 1HG2 THR 675 3HG2 THR 675 -13.397 -14.855 -17.306 1241 2HG2 THR 675 1HG2 THR 675 -15.146 -14.623 -17.071 1242 3HG2 THR 675 2HG2 THR 675 -14.341 -13.936 -18.503 1243 H ILE 676 H ILE 676 -11.116 -11.737 -14.736 1244 HA ILE 676 HA ILE 676 -9.302 -13.624 -16.024 1245 HB ILE 676 HB ILE 676 -9.139 -10.741 -15.220 1246 1HG1 ILE 676 1HG1 ILE 676 -8.781 -12.289 -17.794 1247 2HG1 ILE 676 2HG1 ILE 676 -10.025 -11.118 -17.405 1248 1HG2 ILE 676 2HG2 ILE 676 -6.974 -12.650 -15.069 1249 2HG2 ILE 676 3HG2 ILE 676 -6.654 -11.426 -16.321 1250 3HG2 ILE 676 1HG2 ILE 676 -7.002 -10.921 -14.650 1251 1HD1 ILE 676 2HD1 ILE 676 -7.972 -9.476 -17.021 1252 2HD1 ILE 676 3HD1 ILE 676 -7.111 -10.650 -18.045 1253 3HD1 ILE 676 1HD1 ILE 676 -8.551 -9.812 -18.671 1254 H SER 677 H SER 677 -9.738 -11.814 -12.908 1255 HA SER 677 HA SER 677 -7.690 -12.829 -11.522 1256 1HB SER 677 1HB SER 677 -9.088 -12.513 -9.483 1257 2HB SER 677 2HB SER 677 -9.229 -11.169 -10.598 1258 HG SER 677 HG SER 677 -11.219 -12.253 -11.428 1259 H GLU 678 H GLU 678 -10.623 -14.503 -12.598 1260 HA GLU 678 HA GLU 678 -10.495 -16.631 -10.808 1261 1HB GLU 678 1HB GLU 678 -11.778 -17.784 -12.842 1262 2HB GLU 678 2HB GLU 678 -12.546 -16.540 -11.875 1263 1HG GLU 678 1HG GLU 678 -12.432 -14.951 -13.561 1264 2HG GLU 678 2HG GLU 678 -10.914 -15.561 -14.189 1265 HE2 GLU 678 HE GLU 678 -11.257 -17.879 -15.043 1266 H ALA 679 H ALA 679 -8.564 -15.753 -13.580 1267 HA ALA 679 HA ALA 679 -7.792 -18.128 -14.651 1268 1HB ALA 679 3HB ALA 679 -5.862 -15.884 -13.977 1269 2HB ALA 679 1HB ALA 679 -5.845 -16.968 -15.388 1270 3HB ALA 679 2HB ALA 679 -7.110 -15.725 -15.236 1271 H GLY 680 H GLY 680 -6.819 -16.656 -11.521 1272 1HA GLY 680 2HA GLY 680 -6.040 -17.712 -9.666 1273 2HA GLY 680 1HA GLY 680 -4.675 -18.026 -10.719 1274 H GLN 681 H GLN 681 -7.786 -19.346 -9.500 1275 HA GLN 681 HA GLN 681 -6.800 -21.978 -10.284 1276 1HB GLN 681 1HB GLN 681 -7.984 -20.999 -7.687 1277 2HB GLN 681 2HB GLN 681 -8.264 -22.662 -8.161 1278 1HG GLN 681 1HG GLN 681 -6.078 -23.275 -7.806 1279 2HG GLN 681 2HG GLN 681 -5.442 -21.790 -8.487 1280 1HE2 GLN 681 1HE2 GLN 681 -5.691 -23.559 -5.759 1281 2HE2 GLN 681 2HE2 GLN 681 -5.521 -22.343 -4.536 1282 H ALA 682 H ALA 682 -9.634 -19.844 -9.675 1283 HA ALA 682 HA ALA 682 -11.727 -21.440 -10.170 1284 1HB ALA 682 1HB ALA 682 -11.141 -18.625 -11.149 1285 2HB ALA 682 2HB ALA 682 -12.741 -19.390 -11.299 1286 3HB ALA 682 3HB ALA 682 -12.033 -19.114 -9.689 1287 H MET 683 H MET 683 -10.121 -19.584 -12.856 1288 HA MET 683 HA MET 683 -11.305 -20.707 -14.934 1289 1HB MET 683 1HB MET 683 -9.518 -18.966 -15.056 1290 2HB MET 683 2HB MET 683 -8.306 -20.145 -14.596 1291 1HG MET 683 1HG MET 683 -9.121 -21.483 -16.714 1292 2HG MET 683 2HG MET 683 -9.863 -19.971 -17.201 1293 1HE MET 683 2HE MET 683 -6.949 -21.968 -16.322 1294 2HE MET 683 3HE MET 683 -6.586 -21.841 -18.059 1295 3HE MET 683 1HE MET 683 -5.497 -21.093 -16.866 1296 H ALA 684 H ALA 684 -9.054 -22.318 -12.741 1297 HA ALA 684 HA ALA 684 -8.758 -24.571 -14.559 1298 1HB ALA 684 2HB ALA 684 -7.180 -25.383 -12.845 1299 2HB ALA 684 3HB ALA 684 -6.793 -23.715 -13.329 1300 3HB ALA 684 1HB ALA 684 -7.624 -24.024 -11.785 1301 H SER 685 H SER 685 -10.227 -23.651 -11.396 1302 HA SER 685 HA SER 685 -11.165 -26.253 -10.894 1303 1HB SER 685 1HB SER 685 -11.903 -23.523 -9.764 1304 2HB SER 685 2HB SER 685 -12.636 -25.006 -9.186 1305 HG SER 685 HG SER 685 -10.602 -25.762 -8.482 1306 H THR 686 H THR 686 -13.286 -23.332 -11.137 1307 HA THR 686 HA THR 686 -14.701 -24.349 -13.408 1308 HB THR 686 HB THR 686 -15.569 -24.982 -10.623 1309 HG1 THR 686 1HG THR 686 -15.102 -26.471 -12.457 1310 1HG2 THR 686 1HG2 THR 686 -17.465 -23.845 -12.738 1311 2HG2 THR 686 2HG2 THR 686 -18.008 -24.929 -11.434 1312 3HG2 THR 686 3HG2 THR 686 -17.319 -23.336 -11.038 1313 H GLU 687 H GLU 687 -16.120 -22.820 -14.319 1314 HA GLU 687 HA GLU 687 -15.388 -20.193 -13.736 1315 1HB GLU 687 1HB GLU 687 -16.099 -21.021 -15.986 1316 2HB GLU 687 2HB GLU 687 -17.735 -21.223 -15.391 1317 1HG GLU 687 1HG GLU 687 -16.640 -18.529 -14.837 1318 2HG GLU 687 2HG GLU 687 -16.694 -18.901 -16.549 1319 HE2 GLU 687 HE GLU 687 -18.355 -17.034 -15.563 1320 H GLY 688 H GLY 688 -16.028 -19.012 -11.989 1321 1HA GLY 688 2HA GLY 688 -18.857 -18.987 -11.281 1322 2HA GLY 688 1HA GLY 688 -17.610 -17.878 -10.748 1323 H ASN 689 H ASN 689 -15.723 -20.213 -10.128 1324 HA ASN 689 HA ASN 689 -17.096 -21.641 -8.088 1325 1HB ASN 689 1HB ASN 689 -15.107 -22.484 -9.527 1326 2HB ASN 689 2HB ASN 689 -14.076 -21.469 -8.538 1327 1HD2 ASN 689 1HD2 ASN 689 -16.836 -23.664 -7.997 1328 2HD2 ASN 689 2HD2 ASN 689 -16.126 -24.598 -6.723 1329 H VAL 690 H VAL 690 -14.186 -19.433 -8.201 1330 HA VAL 690 HA VAL 690 -14.434 -18.915 -5.376 1331 HB VAL 690 HB VAL 690 -12.364 -17.822 -5.582 1332 1HG1 VAL 690 2HG1 VAL 690 -12.710 -20.429 -6.441 1333 2HG1 VAL 690 3HG1 VAL 690 -11.690 -19.718 -7.715 1334 3HG1 VAL 690 1HG1 VAL 690 -11.159 -19.665 -6.017 1335 1HG2 VAL 690 3HG2 VAL 690 -13.120 -17.491 -8.469 1336 2HG2 VAL 690 1HG2 VAL 690 -12.491 -16.295 -7.311 1337 3HG2 VAL 690 2HG2 VAL 690 -11.400 -17.515 -8.012 1338 H THR 691 H THR 691 -14.970 -16.906 -4.421 1339 HA THR 691 HA THR 691 -16.257 -15.015 -6.280 1340 HB THR 691 HB THR 691 -17.065 -15.956 -3.480 1341 HG1 THR 691 1HG THR 691 -18.824 -16.786 -4.776 1342 1HG2 THR 691 2HG2 THR 691 -17.498 -13.401 -4.336 1343 2HG2 THR 691 3HG2 THR 691 -18.828 -14.221 -5.190 1344 3HG2 THR 691 1HG2 THR 691 -18.717 -14.315 -3.416 1345 H GLY 692 H GLY 692 -14.383 -15.465 -3.245 1346 1HA GLY 692 2HA GLY 692 -12.949 -14.090 -2.196 1347 2HA GLY 692 1HA GLY 692 -14.096 -12.806 -2.523 1348 H MET 693 H MET 693 -12.377 -14.759 -5.012 1349 HA MET 693 HA MET 693 -10.458 -12.705 -5.442 1350 1HB MET 693 1HB MET 693 -10.436 -15.377 -5.860 1351 2HB MET 693 2HB MET 693 -11.044 -14.915 -7.438 1352 1HG MET 693 1HG MET 693 -8.925 -14.423 -8.086 1353 2HG MET 693 2HG MET 693 -8.875 -13.137 -6.896 1354 1HE MET 693 3HE MET 693 -6.594 -13.469 -7.206 1355 2HE MET 693 1HE MET 693 -6.018 -13.723 -5.541 1356 3HE MET 693 2HE MET 693 -5.611 -14.900 -6.813 1357 H PHE 694 H PHE 694 -13.506 -13.835 -6.967 1358 HA PHE 694 HA PHE 694 -13.318 -12.416 -9.335 1359 1HB PHE 694 1HB PHE 694 -15.425 -13.576 -7.507 1360 2HB PHE 694 2HB PHE 694 -16.015 -12.418 -8.683 1361 HD1 PHE 694 1HD PHE 694 -13.729 -15.378 -8.602 1362 HD2 PHE 694 2HD PHE 694 -16.777 -13.274 -10.675 1363 HE1 PHE 694 1HE PHE 694 -13.785 -17.179 -10.349 1364 HE2 PHE 694 2HE PHE 694 -16.832 -15.076 -12.422 1365 HZ PHE 694 HZ PHE 694 -15.336 -17.007 -12.238 1366 H ALA 695 H ALA 695 -12.350 -10.333 -8.823 1367 HA ALA 695 HA ALA 695 -14.377 -8.441 -7.884 1368 1HB ALA 695 3HB ALA 695 -11.450 -8.432 -7.047 1369 2HB ALA 695 2HB ALA 695 -12.800 -8.968 -6.019 1370 3HB ALA 695 1HB ALA 695 -12.703 -7.271 -6.548 No H/Q in entry = 1370 Start of MODEL 10 1 H ALA 1 H ALA 1 -10.570 33.689 -1.298 2 HA ALA 1 HA ALA 1 -10.710 32.248 -3.565 3 1HB ALA 1 1HB ALA 1 -13.107 32.889 -3.721 4 2HB ALA 1 2HB ALA 1 -12.630 34.603 -3.785 5 3HB ALA 1 3HB ALA 1 -12.160 33.498 -5.099 6 H GLU 2 H GLU 2 -8.530 32.712 -3.705 7 HA GLU 2 HA GLU 2 -7.951 35.458 -4.441 8 1HB GLU 2 1HB GLU 2 -7.170 34.269 -1.968 9 2HB GLU 2 2HB GLU 2 -5.720 34.343 -2.948 10 1HG GLU 2 1HG GLU 2 -7.397 36.803 -3.056 11 2HG GLU 2 2HG GLU 2 -6.733 36.453 -1.473 12 HE2 GLU 2 HE GLU 2 -5.052 37.635 -1.307 13 H MET 3 H MET 3 -6.203 32.305 -3.909 14 HA MET 3 HA MET 3 -5.358 32.524 -6.695 15 1HB MET 3 1HB MET 3 -3.200 31.493 -5.989 16 2HB MET 3 2HB MET 3 -3.489 32.958 -5.072 17 1HG MET 3 1HG MET 3 -4.745 31.033 -3.494 18 2HG MET 3 2HG MET 3 -3.380 30.142 -4.137 19 1HE MET 3 2HE MET 3 -1.650 29.853 -2.447 20 2HE MET 3 3HE MET 3 -1.424 30.929 -1.048 21 3HE MET 3 1HE MET 3 -2.994 30.134 -1.314 22 H LYS 4 H LYS 4 -7.391 31.222 -7.062 23 HA LYS 4 HA LYS 4 -7.107 28.448 -6.182 24 1HB LYS 4 1HB LYS 4 -9.451 28.208 -6.791 25 2HB LYS 4 2HB LYS 4 -9.234 29.541 -5.675 26 1HG LYS 4 1HG LYS 4 -8.929 30.753 -8.191 27 2HG LYS 4 2HG LYS 4 -10.196 29.574 -8.465 28 1HD LYS 4 1HD LYS 4 -11.693 30.634 -7.053 29 2HD LYS 4 2HD LYS 4 -10.446 31.153 -5.937 30 1HE LYS 4 1HE LYS 4 -10.532 33.219 -6.870 31 2HE LYS 4 2HE LYS 4 -9.890 32.542 -8.353 32 H THR 5 H THR 5 -6.994 30.613 -8.986 33 HA THR 5 HA THR 5 -6.648 28.264 -10.723 34 HB THR 5 HB THR 5 -7.551 29.598 -12.456 35 HG1 THR 5 1HG THR 5 -6.121 31.394 -12.253 36 1HG2 THR 5 3HG2 THR 5 -8.990 29.667 -10.051 37 2HG2 THR 5 1HG2 THR 5 -8.870 31.386 -10.497 38 3HG2 THR 5 2HG2 THR 5 -9.602 30.223 -11.628 39 H ASP 6 H ASP 6 -4.881 30.444 -8.890 40 HA ASP 6 HA ASP 6 -2.995 31.526 -10.364 41 1HB ASP 6 1HB ASP 6 -3.139 30.348 -7.696 42 2HB ASP 6 2HB ASP 6 -1.532 30.116 -8.357 43 HD2 ASP 6 HD ASP 6 -2.590 33.952 -8.323 44 H ALA 7 H ALA 7 -1.050 30.850 -11.481 45 HA ALA 7 HA ALA 7 -1.148 28.273 -12.622 46 1HB ALA 7 3HB ALA 7 -0.277 30.215 -13.820 47 2HB ALA 7 2HB ALA 7 1.009 28.995 -13.655 48 3HB ALA 7 1HB ALA 7 1.002 30.430 -12.601 49 H ALA 8 H ALA 8 0.153 29.554 -9.651 50 HA ALA 8 HA ALA 8 2.192 27.552 -9.383 51 1HB ALA 8 2HB ALA 8 2.835 29.361 -8.155 52 2HB ALA 8 1HB ALA 8 1.841 28.600 -6.889 53 3HB ALA 8 3HB ALA 8 1.162 29.907 -7.889 54 H THR 9 H THR 9 -1.092 28.213 -7.999 55 HA THR 9 HA THR 9 -1.119 25.870 -6.413 56 HB THR 9 HB THR 9 -2.497 28.012 -6.129 57 HG1 THR 9 1HG THR 9 -3.203 26.161 -4.996 58 1HG2 THR 9 2HG2 THR 9 -3.957 26.726 -8.488 59 2HG2 THR 9 3HG2 THR 9 -4.765 27.835 -7.354 60 3HG2 THR 9 1HG2 THR 9 -3.403 28.412 -8.345 61 H LEU 10 H LEU 10 -1.970 26.569 -9.801 62 HA LEU 10 HA LEU 10 -3.389 24.151 -10.181 63 1HB LEU 10 1HB LEU 10 -2.237 26.281 -11.937 64 2HB LEU 10 2HB LEU 10 -2.762 24.770 -12.652 65 HG LEU 10 HG LEU 10 -4.489 26.654 -11.022 66 1HD1 LEU 10 1HD1 LEU 10 -4.419 26.091 -13.999 67 2HD1 LEU 10 2HD1 LEU 10 -5.648 27.071 -13.162 68 3HD1 LEU 10 3HD1 LEU 10 -3.949 27.602 -13.184 69 1HD2 LEU 10 2HD2 LEU 10 -5.000 23.931 -12.178 70 2HD2 LEU 10 3HD2 LEU 10 -5.453 24.601 -10.592 71 3HD2 LEU 10 1HD2 LEU 10 -6.323 25.116 -12.058 72 H ALA 11 H ALA 11 -0.019 25.218 -11.011 73 HA ALA 11 HA ALA 11 0.782 22.752 -12.032 74 1HB ALA 11 3HB ALA 11 2.085 25.247 -11.009 75 2HB ALA 11 1HB ALA 11 3.104 23.800 -11.191 76 3HB ALA 11 2HB ALA 11 2.227 24.453 -12.595 77 H GLN 12 H GLN 12 0.308 23.933 -8.738 78 HA GLN 12 HA GLN 12 1.990 22.065 -7.504 79 1HB GLN 12 1HB GLN 12 0.288 24.226 -6.723 80 2HB GLN 12 2HB GLN 12 -0.230 22.829 -5.801 81 1HG GLN 12 1HG GLN 12 1.647 22.858 -4.513 82 2HG GLN 12 2HG GLN 12 2.697 22.973 -5.911 83 1HE2 GLN 12 1HE2 GLN 12 4.061 24.497 -5.182 84 2HE2 GLN 12 2HE2 GLN 12 3.635 26.141 -4.839 85 H GLU 13 H GLU 13 -1.393 22.024 -8.638 86 HA GLU 13 HA GLU 13 -1.730 19.412 -7.427 87 1HB GLU 13 1HB GLU 13 -3.800 21.079 -8.916 88 2HB GLU 13 2HB GLU 13 -4.107 19.679 -7.909 89 1HG GLU 13 1HG GLU 13 -2.799 22.227 -6.855 90 2HG GLU 13 2HG GLU 13 -4.529 21.952 -6.803 91 HE2 GLU 13 HE GLU 13 -3.488 22.205 -4.462 92 H ALA 14 H ALA 14 -1.419 21.107 -10.546 93 HA ALA 14 HA ALA 14 -2.301 19.039 -12.203 94 1HB ALA 14 3HB ALA 14 -1.748 21.557 -12.657 95 2HB ALA 14 1HB ALA 14 -0.095 20.964 -12.948 96 3HB ALA 14 2HB ALA 14 -1.445 20.360 -13.939 97 H GLY 15 H GLY 15 1.067 19.984 -11.200 98 1HA GLY 15 2HA GLY 15 2.914 18.733 -10.914 99 2HA GLY 15 1HA GLY 15 2.466 17.974 -12.429 100 H ASN 16 H ASN 16 0.404 17.829 -9.509 101 HA ASN 16 HA ASN 16 1.435 15.319 -8.709 102 1HB ASN 16 1HB ASN 16 0.469 16.655 -6.963 103 2HB ASN 16 2HB ASN 16 -0.955 17.030 -7.914 104 1HD2 ASN 16 1HD2 ASN 16 -2.594 16.236 -6.813 105 2HD2 ASN 16 2HD2 ASN 16 -2.777 14.605 -6.258 106 H PHE 17 H PHE 17 -1.143 16.583 -10.808 107 HA PHE 17 HA PHE 17 -2.654 14.176 -10.894 108 1HB PHE 17 1HB PHE 17 -3.555 16.472 -11.367 109 2HB PHE 17 2HB PHE 17 -2.409 16.672 -12.678 110 HD1 PHE 17 1HD PHE 17 -5.399 14.783 -11.604 111 HD2 PHE 17 2HD PHE 17 -2.881 15.849 -14.849 112 HE1 PHE 17 1HE PHE 17 -7.079 13.844 -13.216 113 HE2 PHE 17 2HE PHE 17 -4.561 14.910 -16.461 114 HZ PHE 17 HZ PHE 17 -6.639 13.919 -15.625 115 H GLU 18 H GLU 18 -0.477 15.859 -13.278 116 HA GLU 18 HA GLU 18 -0.544 14.204 -15.316 117 1HB GLU 18 1HB GLU 18 1.750 15.666 -14.018 118 2HB GLU 18 2HB GLU 18 2.105 14.600 -15.363 119 1HG GLU 18 1HG GLU 18 -0.217 16.144 -16.085 120 2HG GLU 18 2HG GLU 18 0.966 17.258 -15.427 121 HE2 GLU 18 HE GLU 18 1.298 15.553 -18.922 122 H ARG 19 H ARG 19 0.908 13.487 -12.139 123 HA ARG 19 HA ARG 19 2.251 11.186 -13.011 124 1HB ARG 19 1HB ARG 19 2.273 12.715 -10.715 125 2HB ARG 19 2HB ARG 19 1.358 11.329 -10.157 126 1HG ARG 19 1HG ARG 19 3.145 9.840 -10.458 127 2HG ARG 19 2HG ARG 19 3.875 10.799 -11.730 128 1HD ARG 19 1HD ARG 19 3.792 12.321 -9.228 129 2HD ARG 19 2HD ARG 19 4.588 10.780 -8.979 130 HE ARG 19 HE ARG 19 5.542 12.993 -10.662 131 2HH1 ARG 19 1HH ARG 19 8.460 11.347 -11.579 132 1HH2 ARG 19 2HH2 ARG 19 5.839 9.535 -9.949 133 2HH2 ARG 19 1HH2 ARG 19 7.424 9.403 -10.634 134 H ILE 20 H ILE 20 -0.889 11.809 -11.302 135 HA ILE 20 HA ILE 20 -1.640 9.185 -10.911 136 HB ILE 20 HB ILE 20 -3.339 11.622 -11.457 137 1HG1 ILE 20 1HG1 ILE 20 -2.712 10.460 -8.750 138 2HG1 ILE 20 2HG1 ILE 20 -1.601 11.578 -9.516 139 1HG2 ILE 20 1HG2 ILE 20 -4.502 9.404 -11.743 140 2HG2 ILE 20 2HG2 ILE 20 -4.163 9.089 -10.025 141 3HG2 ILE 20 3HG2 ILE 20 -5.180 10.473 -10.491 142 1HD1 ILE 20 3HD1 ILE 20 -4.103 12.799 -9.883 143 2HD1 ILE 20 1HD1 ILE 20 -4.192 12.112 -8.244 144 3HD1 ILE 20 2HD1 ILE 20 -2.885 13.245 -8.665 145 H SER 21 H SER 21 -2.269 11.358 -13.743 146 HA SER 21 HA SER 21 -3.735 9.533 -15.174 147 1HB SER 21 1HB SER 21 -3.821 11.678 -16.067 148 2HB SER 21 2HB SER 21 -2.110 11.970 -15.827 149 HG SER 21 HG SER 21 -1.603 10.907 -17.702 150 H GLY 22 H GLY 22 -0.170 10.215 -15.194 151 1HA GLY 22 2HA GLY 22 1.580 8.933 -15.785 152 2HA GLY 22 1HA GLY 22 0.626 8.486 -17.186 153 H ASP 23 H ASP 23 0.583 7.783 -13.610 154 HA ASP 23 HA ASP 23 1.263 5.159 -13.840 155 1HB ASP 23 1HB ASP 23 -0.080 6.884 -11.825 156 2HB ASP 23 2HB ASP 23 -0.469 5.184 -11.661 157 HD2 ASP 23 HD ASP 23 2.564 4.437 -10.232 158 H LEU 24 H LEU 24 -2.021 6.717 -13.659 159 HA LEU 24 HA LEU 24 -3.593 4.490 -13.676 160 1HB LEU 24 1HB LEU 24 -4.195 6.957 -13.481 161 2HB LEU 24 2HB LEU 24 -4.208 6.995 -15.233 162 HG LEU 24 HG LEU 24 -5.882 4.977 -14.983 163 1HD1 LEU 24 2HD1 LEU 24 -5.429 5.049 -12.417 164 2HD1 LEU 24 3HD1 LEU 24 -6.608 6.383 -12.432 165 3HD1 LEU 24 1HD1 LEU 24 -7.080 4.771 -13.020 166 1HD2 LEU 24 1HD2 LEU 24 -6.382 7.921 -14.730 167 2HD2 LEU 24 2HD2 LEU 24 -6.718 6.815 -16.083 168 3HD2 LEU 24 3HD2 LEU 24 -7.748 6.785 -14.633 169 H LYS 25 H LYS 25 -1.831 6.029 -16.391 170 HA LYS 25 HA LYS 25 -3.057 4.368 -18.353 171 1HB LYS 25 1HB LYS 25 -0.485 5.947 -18.596 172 2HB LYS 25 2HB LYS 25 -1.537 5.408 -19.889 173 1HG LYS 25 1HG LYS 25 -3.073 6.943 -17.937 174 2HG LYS 25 2HG LYS 25 -1.678 7.868 -18.457 175 1HD LYS 25 1HD LYS 25 -3.260 6.452 -20.591 176 2HD LYS 25 2HD LYS 25 -4.002 7.852 -19.843 177 1HE LYS 25 1HE LYS 25 -1.209 7.841 -21.083 178 2HE LYS 25 2HE LYS 25 -2.650 8.414 -21.899 179 H THR 26 H THR 26 -0.124 4.256 -16.306 180 HA THR 26 HA THR 26 1.194 2.192 -17.638 181 HB THR 26 HB THR 26 1.167 3.432 -14.888 182 HG1 THR 26 1HG THR 26 2.486 4.269 -16.616 183 1HG2 THR 26 1HG2 THR 26 2.203 0.685 -15.569 184 2HG2 THR 26 2HG2 THR 26 3.294 1.761 -14.664 185 3HG2 THR 26 3HG2 THR 26 1.701 1.340 -13.992 186 H GLN 27 H GLN 27 -1.321 2.083 -15.053 187 HA GLN 27 HA GLN 27 -1.208 -0.710 -14.867 188 1HB GLN 27 1HB GLN 27 -3.367 1.287 -14.064 189 2HB GLN 27 2HB GLN 27 -3.415 -0.413 -13.645 190 1HG GLN 27 1HG GLN 27 -2.343 0.366 -11.749 191 2HG GLN 27 2HG GLN 27 -0.927 0.101 -12.746 192 1HE2 GLN 27 1HE2 GLN 27 0.388 1.650 -12.029 193 2HE2 GLN 27 2HE2 GLN 27 0.089 3.354 -12.113 194 H ILE 28 H ILE 28 -3.455 1.585 -16.555 195 HA ILE 28 HA ILE 28 -5.209 -0.255 -17.579 196 HB ILE 28 HB ILE 28 -4.207 2.389 -18.607 197 1HG1 ILE 28 1HG1 ILE 28 -6.817 1.562 -17.303 198 2HG1 ILE 28 2HG1 ILE 28 -5.487 2.363 -16.490 199 1HG2 ILE 28 2HG2 ILE 28 -6.006 0.422 -19.925 200 2HG2 ILE 28 3HG2 ILE 28 -6.512 2.129 -19.943 201 3HG2 ILE 28 1HG2 ILE 28 -4.936 1.661 -20.626 202 1HD1 ILE 28 1HD1 ILE 28 -5.699 4.188 -18.349 203 2HD1 ILE 28 2HD1 ILE 28 -7.288 3.454 -18.675 204 3HD1 ILE 28 3HD1 ILE 28 -6.938 4.144 -17.072 205 H ASP 29 H ASP 29 -2.102 0.935 -19.025 206 HA ASP 29 HA ASP 29 -2.276 -0.583 -21.307 207 1HB ASP 29 1HB ASP 29 -0.497 1.237 -20.261 208 2HB ASP 29 2HB ASP 29 0.436 -0.237 -20.093 209 HD2 ASP 29 HD ASP 29 0.063 1.436 -23.648 210 H GLN 30 H GLN 30 -0.966 -1.260 -18.012 211 HA GLN 30 HA GLN 30 0.320 -3.621 -18.586 212 1HB GLN 30 1HB GLN 30 -0.887 -2.394 -16.114 213 2HB GLN 30 2HB GLN 30 -0.383 -4.070 -16.035 214 1HG GLN 30 1HG GLN 30 1.899 -3.447 -16.799 215 2HG GLN 30 2HG GLN 30 1.406 -1.773 -16.962 216 1HE2 GLN 30 1HE2 GLN 30 0.802 -0.578 -15.102 217 2HE2 GLN 30 2HE2 GLN 30 1.404 -0.982 -13.529 218 H VAL 31 H VAL 31 -3.098 -3.004 -17.556 219 HA VAL 31 HA VAL 31 -3.829 -5.711 -17.468 220 HB VAL 31 HB VAL 31 -5.339 -3.118 -17.751 221 1HG1 VAL 31 3HG1 VAL 31 -6.388 -5.944 -17.777 222 2HG1 VAL 31 1HG1 VAL 31 -7.355 -4.619 -17.086 223 3HG1 VAL 31 2HG1 VAL 31 -6.851 -4.557 -18.792 224 1HG2 VAL 31 1HG2 VAL 31 -4.130 -4.393 -15.575 225 2HG2 VAL 31 2HG2 VAL 31 -5.315 -3.066 -15.516 226 3HG2 VAL 31 3HG2 VAL 31 -5.865 -4.755 -15.403 227 H GLU 32 H GLU 32 -4.311 -3.162 -20.013 228 HA GLU 32 HA GLU 32 -5.589 -4.665 -21.839 229 1HB GLU 32 1HB GLU 32 -3.743 -2.321 -21.953 230 2HB GLU 32 2HB GLU 32 -3.989 -3.158 -23.472 231 1HG GLU 32 1HG GLU 32 -6.549 -3.036 -22.870 232 2HG GLU 32 2HG GLU 32 -6.066 -1.814 -21.710 233 HE2 GLU 32 HE GLU 32 -7.511 -0.619 -23.597 234 H SER 33 H SER 33 -2.074 -4.610 -21.096 235 HA SER 33 HA SER 33 -1.470 -6.327 -23.277 236 1HB SER 33 1HB SER 33 -0.026 -4.645 -21.509 237 2HB SER 33 2HB SER 33 0.561 -6.262 -21.175 238 HG SER 33 HG SER 33 1.236 -6.508 -23.302 239 H THR 34 H THR 34 -1.537 -6.627 -19.652 240 HA THR 34 HA THR 34 -0.883 -9.309 -19.493 241 HB THR 34 HB THR 34 -2.304 -7.253 -17.815 242 HG1 THR 34 1HG THR 34 -0.164 -9.251 -17.594 243 1HG2 THR 34 3HG2 THR 34 -3.592 -9.491 -17.537 244 2HG2 THR 34 1HG2 THR 34 -2.059 -10.168 -16.938 245 3HG2 THR 34 2HG2 THR 34 -2.841 -8.829 -16.065 246 H ALA 35 H ALA 35 -4.103 -7.770 -20.000 247 HA ALA 35 HA ALA 35 -5.645 -10.035 -19.781 248 1HB ALA 35 1HB ALA 35 -6.231 -8.002 -21.916 249 2HB ALA 35 3HB ALA 35 -6.160 -7.464 -20.221 250 3HB ALA 35 2HB ALA 35 -7.317 -8.727 -20.706 251 H GLY 36 H GLY 36 -3.420 -8.998 -22.348 252 1HA GLY 36 2HA GLY 36 -2.599 -10.132 -24.112 253 2HA GLY 36 1HA GLY 36 -4.279 -10.399 -24.530 254 H SER 37 H SER 37 -2.313 -11.631 -21.736 255 HA SER 37 HA SER 37 -2.050 -14.187 -22.834 256 1HB SER 37 1HB SER 37 -1.914 -13.413 -19.889 257 2HB SER 37 2HB SER 37 -1.176 -14.815 -20.636 258 HG SER 37 HG SER 37 0.448 -13.610 -21.417 259 H LEU 38 H LEU 38 -4.453 -12.593 -20.713 260 HA LEU 38 HA LEU 38 -5.745 -14.917 -19.837 261 1HB LEU 38 1HB LEU 38 -6.381 -12.009 -19.987 262 2HB LEU 38 2HB LEU 38 -7.700 -13.126 -19.700 263 HG LEU 38 HG LEU 38 -7.160 -12.719 -17.544 264 1HD1 LEU 38 2HD1 LEU 38 -6.627 -15.149 -18.081 265 2HD1 LEU 38 3HD1 LEU 38 -4.911 -14.685 -17.985 266 3HD1 LEU 38 1HD1 LEU 38 -5.965 -14.495 -16.564 267 1HD2 LEU 38 2HD2 LEU 38 -4.333 -12.169 -18.469 268 2HD2 LEU 38 3HD2 LEU 38 -5.551 -11.006 -17.892 269 3HD2 LEU 38 1HD2 LEU 38 -4.827 -12.172 -16.759 270 H GLN 39 H GLN 39 -6.804 -12.556 -22.396 271 HA GLN 39 HA GLN 39 -8.836 -14.073 -23.357 272 1HB GLN 39 1HB GLN 39 -8.244 -12.815 -25.601 273 2HB GLN 39 2HB GLN 39 -8.781 -11.902 -24.205 274 1HG GLN 39 1HG GLN 39 -5.922 -12.249 -23.987 275 2HG GLN 39 2HG GLN 39 -6.273 -11.700 -25.614 276 1HE2 GLN 39 1HE2 GLN 39 -8.051 -11.085 -22.610 277 2HE2 GLN 39 2HE2 GLN 39 -7.862 -9.364 -22.581 278 H GLY 40 H GLY 40 -5.400 -14.627 -23.606 279 1HA GLY 40 2HA GLY 40 -4.177 -15.934 -25.060 280 2HA GLY 40 1HA GLY 40 -5.634 -16.369 -25.931 281 H GLN 41 H GLN 41 -6.411 -16.621 -22.666 282 HA GLN 41 HA GLN 41 -5.975 -19.480 -22.803 283 1HB GLN 41 1HB GLN 41 -4.101 -18.454 -21.461 284 2HB GLN 41 2HB GLN 41 -5.288 -17.818 -20.340 285 1HG GLN 41 1HG GLN 41 -5.846 -20.627 -20.727 286 2HG GLN 41 2HG GLN 41 -4.132 -20.457 -20.404 287 1HE2 GLN 41 1HE2 GLN 41 -7.078 -18.760 -19.330 288 2HE2 GLN 41 2HE2 GLN 41 -6.801 -18.897 -17.626 289 H TRP 42 H TRP 42 -8.132 -20.049 -22.986 290 HA TRP 42 HA TRP 42 -9.760 -19.688 -20.668 291 1HB TRP 42 1HB TRP 42 -10.561 -18.286 -23.223 292 2HB TRP 42 2HB TRP 42 -11.633 -18.588 -21.870 293 HD1 TRP 42 HD TRP 42 -9.694 -15.833 -23.157 294 HE1 TRP 42 1HE TRP 42 -9.029 -14.006 -21.373 295 HE3 TRP 42 3HE TRP 42 -10.665 -18.708 -19.077 296 HZ2 TRP 42 2HZ TRP 42 -8.985 -13.969 -18.520 297 HZ3 TRP 42 3HZ TRP 42 -10.285 -17.700 -16.829 298 HH2 TRP 42 HH TRP 42 -9.474 -15.416 -16.514 299 H ARG 43 H ARG 43 -12.124 -20.644 -21.412 300 HA ARG 43 HA ARG 43 -12.242 -22.310 -23.572 301 1HB ARG 43 1HB ARG 43 -10.727 -23.438 -21.296 302 2HB ARG 43 2HB ARG 43 -12.088 -24.446 -21.745 303 1HG ARG 43 1HG ARG 43 -10.492 -23.408 -24.044 304 2HG ARG 43 2HG ARG 43 -9.627 -24.508 -22.989 305 1HD ARG 43 1HD ARG 43 -11.106 -26.306 -23.418 306 2HD ARG 43 2HD ARG 43 -12.421 -25.250 -23.894 307 HE ARG 43 HE ARG 43 -10.449 -24.748 -25.793 308 2HH1 ARG 43 1HH ARG 43 -10.891 -27.378 -28.018 309 1HH2 ARG 43 2HH2 ARG 43 -12.123 -27.661 -24.670 310 2HH2 ARG 43 1HH2 ARG 43 -11.986 -28.477 -26.191 311 H GLY 44 H GLY 44 -12.875 -22.611 -19.991 312 1HA GLY 44 2HA GLY 44 -14.783 -22.964 -18.846 313 2HA GLY 44 1HA GLY 44 -15.528 -23.553 -20.318 314 H ALA 45 H ALA 45 -15.438 -21.363 -22.045 315 HA ALA 45 HA ALA 45 -16.558 -19.530 -22.572 316 1HB ALA 45 1HB ALA 45 -18.092 -19.814 -19.966 317 2HB ALA 45 2HB ALA 45 -18.641 -19.087 -21.495 318 3HB ALA 45 3HB ALA 45 -18.404 -20.847 -21.382 319 H ALA 46 H ALA 46 -14.605 -19.844 -19.823 320 HA ALA 46 HA ALA 46 -14.837 -17.394 -18.561 321 1HB ALA 46 2HB ALA 46 -12.374 -17.841 -18.006 322 2HB ALA 46 3HB ALA 46 -13.529 -19.123 -17.569 323 3HB ALA 46 1HB ALA 46 -12.516 -19.295 -19.022 324 H GLY 47 H GLY 47 -13.739 -18.201 -21.775 325 1HA GLY 47 2HA GLY 47 -12.672 -17.018 -23.379 326 2HA GLY 47 1HA GLY 47 -12.003 -15.963 -22.150 327 H THR 48 H THR 48 -15.242 -16.752 -23.614 328 HA THR 48 HA THR 48 -15.717 -14.264 -24.683 329 HB THR 48 HB THR 48 -18.154 -15.060 -24.527 330 HG1 THR 48 1HG THR 48 -18.300 -16.410 -22.765 331 1HG2 THR 48 1HG2 THR 48 -16.612 -15.900 -26.373 332 2HG2 THR 48 2HG2 THR 48 -16.172 -17.259 -25.312 333 3HG2 THR 48 3HG2 THR 48 -17.847 -17.086 -25.887 334 H ALA 49 H ALA 49 -15.852 -15.285 -21.313 335 HA ALA 49 HA ALA 49 -17.451 -13.059 -20.494 336 1HB ALA 49 1HB ALA 49 -15.780 -15.146 -19.050 337 2HB ALA 49 2HB ALA 49 -16.687 -13.871 -18.202 338 3HB ALA 49 3HB ALA 49 -17.552 -15.069 -19.193 339 H ALA 50 H ALA 50 -13.942 -13.971 -20.285 340 HA ALA 50 HA ALA 50 -13.238 -11.430 -19.204 341 1HB ALA 50 2HB ALA 50 -10.914 -12.567 -20.160 342 2HB ALA 50 1HB ALA 50 -11.950 -13.993 -19.914 343 3HB ALA 50 3HB ALA 50 -11.624 -12.885 -18.559 344 H GLN 51 H GLN 51 -12.571 -13.069 -22.387 345 HA GLN 51 HA GLN 51 -11.351 -11.106 -23.675 346 1HB GLN 51 1HB GLN 51 -11.661 -13.073 -24.909 347 2HB GLN 51 2HB GLN 51 -13.379 -13.148 -24.570 348 1HG GLN 51 1HG GLN 51 -12.453 -10.756 -26.121 349 2HG GLN 51 2HG GLN 51 -12.353 -12.294 -26.954 350 1HE2 GLN 51 1HE2 GLN 51 -14.334 -9.750 -25.938 351 2HE2 GLN 51 2HE2 GLN 51 -15.883 -10.384 -26.384 352 H ALA 52 H ALA 52 -14.899 -11.324 -23.071 353 HA ALA 52 HA ALA 52 -15.544 -9.037 -24.597 354 1HB ALA 52 3HB ALA 52 -17.207 -10.725 -24.116 355 2HB ALA 52 2HB ALA 52 -17.706 -9.219 -23.308 356 3HB ALA 52 1HB ALA 52 -16.967 -10.533 -22.363 357 H ALA 53 H ALA 53 -15.080 -9.619 -21.043 358 HA ALA 53 HA ALA 53 -15.557 -7.035 -20.209 359 1HB ALA 53 3HB ALA 53 -13.448 -8.825 -18.979 360 2HB ALA 53 2HB ALA 53 -15.176 -9.246 -18.898 361 3HB ALA 53 1HB ALA 53 -14.595 -7.729 -18.171 362 H VAL 54 H VAL 54 -12.739 -8.482 -21.825 363 HA VAL 54 HA VAL 54 -10.978 -6.339 -21.200 364 HB VAL 54 HB VAL 54 -10.779 -8.312 -23.474 365 1HG1 VAL 54 3HG1 VAL 54 -9.159 -6.232 -22.938 366 2HG1 VAL 54 1HG1 VAL 54 -8.428 -7.448 -21.864 367 3HG1 VAL 54 2HG1 VAL 54 -8.571 -7.772 -23.608 368 1HG2 VAL 54 2HG2 VAL 54 -11.004 -8.915 -20.696 369 2HG2 VAL 54 3HG2 VAL 54 -10.635 -10.016 -22.045 370 3HG2 VAL 54 1HG2 VAL 54 -9.314 -9.195 -21.179 371 H VAL 55 H VAL 55 -12.891 -7.303 -24.130 372 HA VAL 55 HA VAL 55 -12.138 -5.243 -25.769 373 HB VAL 55 HB VAL 55 -14.662 -6.845 -25.460 374 1HG1 VAL 55 1HG1 VAL 55 -14.375 -4.339 -26.909 375 2HG1 VAL 55 2HG1 VAL 55 -14.757 -5.687 -28.007 376 3HG1 VAL 55 3HG1 VAL 55 -15.824 -5.333 -26.626 377 1HG2 VAL 55 3HG2 VAL 55 -12.232 -7.501 -26.496 378 2HG2 VAL 55 1HG2 VAL 55 -13.772 -8.233 -27.008 379 3HG2 VAL 55 2HG2 VAL 55 -13.063 -6.901 -27.952 380 H ARG 56 H ARG 56 -14.946 -5.330 -23.463 381 HA ARG 56 HA ARG 56 -15.811 -2.799 -23.956 382 1HB ARG 56 1HB ARG 56 -15.918 -4.622 -21.536 383 2HB ARG 56 2HB ARG 56 -16.529 -2.987 -21.383 384 1HG ARG 56 1HG ARG 56 -18.457 -3.598 -22.401 385 2HG ARG 56 2HG ARG 56 -17.567 -4.030 -23.848 386 1HD ARG 56 1HD ARG 56 -17.029 -6.191 -22.168 387 2HD ARG 56 2HD ARG 56 -18.676 -5.784 -21.726 388 HE ARG 56 HE ARG 56 -18.123 -5.950 -24.630 389 2HH1 ARG 56 1HH ARG 56 -20.236 -8.675 -25.046 390 1HH2 ARG 56 2HH2 ARG 56 -19.396 -7.569 -21.747 391 2HH2 ARG 56 1HH2 ARG 56 -20.299 -8.739 -22.651 392 H PHE 57 H PHE 57 -13.504 -3.949 -21.386 393 HA PHE 57 HA PHE 57 -12.998 -1.462 -20.277 394 1HB PHE 57 1HB PHE 57 -12.175 -3.310 -19.050 395 2HB PHE 57 2HB PHE 57 -11.728 -4.190 -20.498 396 HD1 PHE 57 1HD PHE 57 -10.668 -1.512 -18.191 397 HD2 PHE 57 2HD PHE 57 -9.521 -4.070 -21.376 398 HE1 PHE 57 1HE PHE 57 -8.266 -0.877 -17.835 399 HE2 PHE 57 2HE PHE 57 -7.118 -3.436 -21.020 400 HZ PHE 57 HZ PHE 57 -6.520 -1.847 -19.254 401 H GLN 58 H GLN 58 -11.358 -3.224 -22.979 402 HA GLN 58 HA GLN 58 -9.260 -1.503 -23.294 403 1HB GLN 58 1HB GLN 58 -10.791 -3.148 -25.352 404 2HB GLN 58 2HB GLN 58 -9.282 -2.333 -25.710 405 1HG GLN 58 1HG GLN 58 -8.814 -3.743 -23.283 406 2HG GLN 58 2HG GLN 58 -9.722 -4.851 -24.291 407 1HE2 GLN 58 1HE2 GLN 58 -7.446 -2.270 -25.167 408 2HE2 GLN 58 2HE2 GLN 58 -6.287 -3.261 -25.988 409 H GLU 59 H GLU 59 -12.452 -1.473 -25.044 410 HA GLU 59 HA GLU 59 -11.965 0.805 -26.483 411 1HB GLU 59 1HB GLU 59 -14.455 -0.600 -25.523 412 2HB GLU 59 2HB GLU 59 -14.624 0.970 -26.283 413 1HG GLU 59 1HG GLU 59 -12.814 -0.918 -27.718 414 2HG GLU 59 2HG GLU 59 -14.492 -1.420 -27.655 415 HE2 GLU 59 HE GLU 59 -15.999 0.746 -28.364 416 H ALA 60 H ALA 60 -12.814 0.370 -23.077 417 HA ALA 60 HA ALA 60 -13.607 3.114 -22.731 418 1HB ALA 60 1HB ALA 60 -13.078 0.823 -20.797 419 2HB ALA 60 2HB ALA 60 -13.706 2.420 -20.325 420 3HB ALA 60 3HB ALA 60 -14.661 1.370 -21.400 421 H ALA 61 H ALA 61 -10.680 1.123 -22.545 422 HA ALA 61 HA ALA 61 -9.143 2.694 -20.868 423 1HB ALA 61 3HB ALA 61 -8.760 0.368 -22.074 424 2HB ALA 61 1HB ALA 61 -7.963 1.378 -23.305 425 3HB ALA 61 2HB ALA 61 -7.374 1.391 -21.625 426 H ASN 62 H ASN 62 -9.943 3.027 -24.355 427 HA ASN 62 HA ASN 62 -8.100 5.090 -24.790 428 1HB ASN 62 1HB ASN 62 -10.688 4.765 -26.359 429 2HB ASN 62 2HB ASN 62 -9.122 5.279 -26.954 430 1HD2 ASN 62 1HD2 ASN 62 -11.063 2.588 -25.851 431 2HD2 ASN 62 2HD2 ASN 62 -10.106 1.304 -26.513 432 H LYS 63 H LYS 63 -11.679 4.923 -24.170 433 HA LYS 63 HA LYS 63 -12.307 7.573 -24.386 434 1HB LYS 63 1HB LYS 63 -13.651 5.311 -23.748 435 2HB LYS 63 2HB LYS 63 -13.593 6.069 -22.169 436 1HG LYS 63 1HG LYS 63 -15.558 6.987 -23.090 437 2HG LYS 63 2HG LYS 63 -14.379 8.243 -23.409 438 1HD LYS 63 1HD LYS 63 -15.551 7.951 -25.475 439 2HD LYS 63 2HD LYS 63 -14.006 7.158 -25.711 440 1HE LYS 63 1HE LYS 63 -15.079 5.221 -26.195 441 2HE LYS 63 2HE LYS 63 -15.750 5.189 -24.577 442 H GLN 64 H GLN 64 -10.876 5.807 -21.585 443 HA GLN 64 HA GLN 64 -10.949 8.071 -19.924 444 1HB GLN 64 1HB GLN 64 -9.849 5.307 -19.818 445 2HB GLN 64 2HB GLN 64 -8.987 6.474 -18.835 446 1HG GLN 64 1HG GLN 64 -11.960 6.646 -18.654 447 2HG GLN 64 2HG GLN 64 -11.274 5.155 -18.039 448 1HE2 GLN 64 1HE2 GLN 64 -9.659 5.237 -16.405 449 2HE2 GLN 64 2HE2 GLN 64 -9.568 6.562 -15.292 450 H LYS 65 H LYS 65 -8.441 6.544 -22.025 451 HA LYS 65 HA LYS 65 -6.301 8.119 -21.275 452 1HB LYS 65 1HB LYS 65 -6.999 6.301 -23.445 453 2HB LYS 65 2HB LYS 65 -5.972 7.607 -24.002 454 1HG LYS 65 1HG LYS 65 -4.437 5.955 -23.249 455 2HG LYS 65 2HG LYS 65 -4.479 7.120 -21.940 456 1HD LYS 65 1HD LYS 65 -4.866 5.282 -20.627 457 2HD LYS 65 2HD LYS 65 -6.526 5.475 -21.157 458 1HE LYS 65 1HE LYS 65 -5.879 3.150 -21.513 459 2HE LYS 65 2HE LYS 65 -6.068 3.910 -23.081 460 H GLN 66 H GLN 66 -9.131 8.835 -23.293 461 HA GLN 66 HA GLN 66 -7.995 11.128 -24.465 462 1HB GLN 66 1HB GLN 66 -9.872 9.927 -25.509 463 2HB GLN 66 2HB GLN 66 -10.897 10.256 -24.126 464 1HG GLN 66 1HG GLN 66 -11.478 11.890 -25.798 465 2HG GLN 66 2HG GLN 66 -10.569 12.748 -24.570 466 1HE2 GLN 66 1HE2 GLN 66 -9.019 14.016 -25.231 467 2HE2 GLN 66 2HE2 GLN 66 -8.147 13.923 -26.725 468 H GLU 67 H GLU 67 -10.453 10.641 -21.825 469 HA GLU 67 HA GLU 67 -10.619 13.334 -21.196 470 1HB GLU 67 1HB GLU 67 -11.362 10.752 -19.845 471 2HB GLU 67 2HB GLU 67 -11.360 12.204 -18.864 472 1HG GLU 67 1HG GLU 67 -13.577 11.599 -20.055 473 2HG GLU 67 2HG GLU 67 -13.034 13.260 -20.188 474 HE2 GLU 67 HE GLU 67 -12.498 10.253 -22.053 475 H LEU 68 H LEU 68 -8.204 10.893 -20.479 476 HA LEU 68 HA LEU 68 -7.174 12.110 -18.137 477 1HB LEU 68 1HB LEU 68 -6.896 9.704 -19.369 478 2HB LEU 68 2HB LEU 68 -5.387 10.473 -19.819 479 HG LEU 68 HG LEU 68 -4.731 10.751 -17.538 480 1HD1 LEU 68 1HD1 LEU 68 -7.587 10.525 -17.019 481 2HD1 LEU 68 2HD1 LEU 68 -6.617 9.514 -15.920 482 3HD1 LEU 68 3HD1 LEU 68 -6.296 11.261 -16.040 483 1HD2 LEU 68 1HD2 LEU 68 -5.509 8.133 -18.572 484 2HD2 LEU 68 2HD2 LEU 68 -4.004 8.658 -17.780 485 3HD2 LEU 68 3HD2 LEU 68 -5.406 8.173 -16.796 486 H ASP 69 H ASP 69 -5.955 11.991 -21.563 487 HA ASP 69 HA ASP 69 -3.951 13.833 -21.114 488 1HB ASP 69 1HB ASP 69 -4.764 12.250 -23.215 489 2HB ASP 69 2HB ASP 69 -5.250 13.826 -23.808 490 HD2 ASP 69 HD ASP 69 -3.772 14.951 -24.724 491 H GLU 70 H GLU 70 -7.256 14.173 -22.617 492 HA GLU 70 HA GLU 70 -7.243 16.770 -23.243 493 1HB GLU 70 1HB GLU 70 -9.532 16.564 -23.441 494 2HB GLU 70 2HB GLU 70 -9.131 14.867 -23.268 495 1HG GLU 70 1HG GLU 70 -9.592 14.971 -20.834 496 2HG GLU 70 2HG GLU 70 -9.900 16.692 -20.942 497 HE2 GLU 70 HE GLU 70 -13.141 15.623 -21.056 498 H ILE 71 H ILE 71 -7.906 15.360 -19.976 499 HA ILE 71 HA ILE 71 -8.320 17.918 -18.796 500 HB ILE 71 HB ILE 71 -7.980 15.121 -17.745 501 1HG1 ILE 71 1HG1 ILE 71 -10.354 16.993 -17.597 502 2HG1 ILE 71 2HG1 ILE 71 -10.103 15.868 -18.916 503 1HG2 ILE 71 3HG2 ILE 71 -7.397 17.510 -16.315 504 2HG2 ILE 71 1HG2 ILE 71 -8.940 16.868 -15.703 505 3HG2 ILE 71 2HG2 ILE 71 -7.488 15.839 -15.708 506 1HD1 ILE 71 1HD1 ILE 71 -9.875 14.745 -16.143 507 2HD1 ILE 71 2HD1 ILE 71 -11.501 15.207 -16.701 508 3HD1 ILE 71 3HD1 ILE 71 -10.554 14.009 -17.615 509 H SER 72 H SER 72 -5.579 15.614 -19.127 510 HA SER 72 HA SER 72 -3.882 16.906 -17.379 511 1HB SER 72 1HB SER 72 -2.273 15.428 -18.148 512 2HB SER 72 2HB SER 72 -3.714 14.612 -18.721 513 HG SER 72 HG SER 72 -1.861 14.973 -20.296 514 H THR 73 H THR 73 -4.917 17.657 -20.677 515 HA THR 73 HA THR 73 -2.777 19.614 -21.005 516 HB THR 73 HB THR 73 -4.753 18.151 -22.731 517 HG1 THR 73 1HG THR 73 -2.058 19.303 -22.929 518 1HG2 THR 73 2HG2 THR 73 -3.907 21.032 -23.141 519 2HG2 THR 73 3HG2 THR 73 -3.946 19.941 -24.547 520 3HG2 THR 73 1HG2 THR 73 -5.429 20.235 -23.607 521 H ASN 74 H ASN 74 -6.233 19.368 -20.234 522 HA ASN 74 HA ASN 74 -7.081 21.845 -20.838 523 1HB ASN 74 1HB ASN 74 -7.769 19.773 -18.835 524 2HB ASN 74 2HB ASN 74 -8.190 21.383 -18.286 525 1HD2 ASN 74 1HD2 ASN 74 -8.917 18.792 -20.383 526 2HD2 ASN 74 2HD2 ASN 74 -10.288 19.465 -21.201 527 H ILE 75 H ILE 75 -4.839 20.774 -18.292 528 HA ILE 75 HA ILE 75 -5.000 23.166 -16.751 529 HB ILE 75 HB ILE 75 -2.777 21.136 -16.734 530 1HG1 ILE 75 1HG1 ILE 75 -4.888 19.903 -16.700 531 2HG1 ILE 75 2HG1 ILE 75 -4.069 19.808 -15.154 532 1HG2 ILE 75 2HG2 ILE 75 -3.899 23.092 -14.723 533 2HG2 ILE 75 3HG2 ILE 75 -2.847 21.731 -14.264 534 3HG2 ILE 75 1HG2 ILE 75 -2.245 22.987 -15.373 535 1HD1 ILE 75 1HD1 ILE 75 -6.344 21.736 -15.818 536 2HD1 ILE 75 2HD1 ILE 75 -6.498 20.240 -14.865 537 3HD1 ILE 75 3HD1 ILE 75 -5.529 21.596 -14.241 538 H ARG 76 H ARG 76 -2.810 21.846 -19.298 539 HA ARG 76 HA ARG 76 -0.893 23.755 -19.180 540 1HB ARG 76 1HB ARG 76 -1.918 21.847 -21.201 541 2HB ARG 76 2HB ARG 76 -1.169 23.253 -21.930 542 1HG ARG 76 1HG ARG 76 0.852 22.308 -21.533 543 2HG ARG 76 2HG ARG 76 0.577 22.553 -19.819 544 1HD ARG 76 1HD ARG 76 0.284 20.323 -19.462 545 2HD ARG 76 2HD ARG 76 -0.902 20.205 -20.747 546 HE ARG 76 HE ARG 76 1.707 20.463 -21.915 547 2HH1 ARG 76 1HH ARG 76 2.326 17.077 -22.384 548 1HH2 ARG 76 2HH2 ARG 76 -0.263 18.113 -20.139 549 2HH2 ARG 76 1HH2 ARG 76 0.544 16.738 -20.817 550 H GLN 77 H GLN 77 -4.123 23.835 -20.761 551 HA GLN 77 HA GLN 77 -3.617 26.303 -22.048 552 1HB GLN 77 1HB GLN 77 -6.211 24.792 -21.511 553 2HB GLN 77 2HB GLN 77 -6.099 26.221 -22.519 554 1HG GLN 77 1HG GLN 77 -4.052 24.317 -23.327 555 2HG GLN 77 2HG GLN 77 -5.604 23.505 -23.272 556 1HE2 GLN 77 1HE2 GLN 77 -3.607 24.916 -25.298 557 2HE2 GLN 77 2HE2 GLN 77 -4.673 25.668 -26.437 558 H ALA 78 H ALA 78 -4.540 25.304 -18.840 559 HA ALA 78 HA ALA 78 -6.094 27.512 -18.091 560 1HB ALA 78 3HB ALA 78 -4.288 26.142 -16.129 561 2HB ALA 78 1HB ALA 78 -6.013 26.556 -15.994 562 3HB ALA 78 2HB ALA 78 -5.508 25.154 -16.968 563 H GLY 79 H GLY 79 -2.683 27.114 -18.762 564 1HA GLY 79 2HA GLY 79 -2.234 29.879 -17.841 565 2HA GLY 79 1HA GLY 79 -1.379 29.063 -19.135 566 H VAL 80 H VAL 80 -1.434 26.509 -17.280 567 HA VAL 80 HA VAL 80 0.431 27.347 -15.225 568 HB VAL 80 HB VAL 80 -0.502 24.554 -15.870 569 1HG1 VAL 80 3HG1 VAL 80 0.813 25.918 -13.547 570 2HG1 VAL 80 1HG1 VAL 80 -0.288 24.555 -13.231 571 3HG1 VAL 80 2HG1 VAL 80 1.138 24.325 -14.272 572 1HG2 VAL 80 1HG2 VAL 80 -2.393 26.302 -15.607 573 2HG2 VAL 80 2HG2 VAL 80 -2.464 24.822 -14.620 574 3HG2 VAL 80 3HG2 VAL 80 -1.910 26.351 -13.895 575 H GLN 81 H GLN 81 2.300 28.002 -16.344 576 HA GLN 81 HA GLN 81 3.715 25.766 -17.527 577 1HB GLN 81 1HB GLN 81 3.166 28.443 -18.830 578 2HB GLN 81 2HB GLN 81 4.635 27.571 -19.222 579 1HG GLN 81 1HG GLN 81 3.415 25.672 -20.066 580 2HG GLN 81 2HG GLN 81 1.913 26.213 -19.342 581 1HE2 GLN 81 1HE2 GLN 81 0.588 26.610 -20.954 582 2HE2 GLN 81 2HE2 GLN 81 0.891 27.628 -22.323 583 H TYR 82 H TYR 82 3.580 27.741 -15.019 584 HA TYR 82 HA TYR 82 6.390 27.694 -14.578 585 1HB TYR 82 1HB TYR 82 6.728 30.106 -14.615 586 2HB TYR 82 2HB TYR 82 5.844 29.769 -16.090 587 HD1 TYR 82 1HD TYR 82 3.085 29.602 -15.406 588 HD2 TYR 82 2HD TYR 82 6.081 32.121 -13.679 589 HE1 TYR 82 1HE TYR 82 1.294 31.265 -14.705 590 HE2 TYR 82 2HE TYR 82 4.280 33.775 -12.985 591 HH TYR 82 HH TYR 82 1.592 34.119 -14.186 592 H SER 83 H SER 83 6.544 27.148 -12.465 593 HA SER 83 HA SER 83 4.804 28.532 -10.622 594 1HB SER 83 1HB SER 83 3.455 26.648 -10.710 595 2HB SER 83 2HB SER 83 4.769 25.588 -11.180 596 HG SER 83 HG SER 83 3.779 25.550 -8.848 597 H ARG 84 H ARG 84 7.227 25.812 -10.795 598 HA ARG 84 HA ARG 84 8.456 26.839 -8.423 599 1HB ARG 84 1HB ARG 84 8.968 24.403 -10.188 600 2HB ARG 84 2HB ARG 84 10.035 24.812 -8.859 601 1HG ARG 84 1HG ARG 84 8.194 24.634 -7.243 602 2HG ARG 84 2HG ARG 84 7.023 24.430 -8.531 603 1HD ARG 84 1HD ARG 84 8.110 22.288 -9.204 604 2HD ARG 84 2HD ARG 84 9.323 22.498 -7.957 605 HE ARG 84 HE ARG 84 7.720 21.949 -6.296 606 2HH1 ARG 84 1HH ARG 84 4.471 20.780 -6.675 607 1HH2 ARG 84 2HH2 ARG 84 6.170 22.233 -9.470 608 2HH2 ARG 84 1HH2 ARG 84 4.687 21.504 -8.949 609 H ALA 85 H ALA 85 10.067 25.500 -11.379 610 HA ALA 85 HA ALA 85 11.652 27.975 -11.495 611 1HB ALA 85 3HB ALA 85 13.227 26.453 -10.742 612 2HB ALA 85 2HB ALA 85 13.382 26.225 -12.500 613 3HB ALA 85 1HB ALA 85 12.431 25.072 -11.533 614 H ASP 86 H ASP 86 11.474 25.046 -13.603 615 HA ASP 86 HA ASP 86 10.351 26.789 -15.649 616 1HB ASP 86 1HB ASP 86 12.150 24.553 -16.506 617 2HB ASP 86 2HB ASP 86 11.925 26.133 -17.229 618 HD2 ASP 86 HD ASP 86 14.244 24.719 -14.694 619 H GLU 87 H GLU 87 8.794 25.130 -13.960 620 HA GLU 87 HA GLU 87 8.444 22.565 -14.414 621 1HB GLU 87 1HB GLU 87 6.997 24.112 -13.015 622 2HB GLU 87 2HB GLU 87 6.130 24.550 -14.474 623 1HG GLU 87 1HG GLU 87 4.771 22.809 -13.780 624 2HG GLU 87 2HG GLU 87 5.912 21.881 -14.733 625 HE2 GLU 87 HE GLU 87 7.380 20.262 -12.874 626 H GLU 88 H GLU 88 7.466 25.198 -16.674 627 HA GLU 88 HA GLU 88 6.114 23.574 -18.458 628 1HB GLU 88 1HB GLU 88 5.773 25.906 -18.675 629 2HB GLU 88 2HB GLU 88 7.489 26.263 -18.665 630 1HG GLU 88 1HG GLU 88 6.562 24.493 -20.892 631 2HG GLU 88 2HG GLU 88 5.965 26.140 -20.945 632 HE2 GLU 88 HE GLU 88 7.545 25.531 -22.836 633 H GLN 89 H GLN 89 9.551 24.755 -18.475 634 HA GLN 89 HA GLN 89 10.094 22.924 -20.634 635 1HB GLN 89 1HB GLN 89 10.963 25.394 -20.379 636 2HB GLN 89 2HB GLN 89 12.150 24.701 -19.291 637 1HG GLN 89 1HG GLN 89 13.292 24.553 -21.325 638 2HG GLN 89 2HG GLN 89 12.553 22.966 -21.255 639 1HE2 GLN 89 1HE2 GLN 89 13.136 25.525 -23.183 640 2HE2 GLN 89 2HE2 GLN 89 11.856 25.391 -24.343 641 H GLN 90 H GLN 90 9.393 21.996 -17.847 642 HA GLN 90 HA GLN 90 11.484 21.270 -16.336 643 1HB GLN 90 1HB GLN 90 9.222 20.787 -15.642 644 2HB GLN 90 2HB GLN 90 8.946 19.737 -17.018 645 1HG GLN 90 1HG GLN 90 10.767 18.198 -16.139 646 2HG GLN 90 2HG GLN 90 10.884 19.214 -14.716 647 1HE2 GLN 90 1HE2 GLN 90 10.376 16.883 -13.972 648 2HE2 GLN 90 2HE2 GLN 90 8.713 16.537 -13.629 649 H GLN 91 H GLN 91 10.740 20.192 -19.582 650 HA GLN 91 HA GLN 91 11.650 17.739 -19.822 651 1HB GLN 91 1HB GLN 91 11.742 20.153 -21.511 652 2HB GLN 91 2HB GLN 91 13.002 19.006 -21.922 653 1HG GLN 91 1HG GLN 91 10.296 17.821 -21.449 654 2HG GLN 91 2HG GLN 91 10.428 18.851 -22.861 655 1HE2 GLN 91 1HE2 GLN 91 10.209 17.199 -24.311 656 2HE2 GLN 91 2HE2 GLN 91 11.424 16.003 -24.612 657 H ALA 92 H ALA 92 13.986 20.501 -20.240 658 HA ALA 92 HA ALA 92 15.991 18.802 -18.918 659 1HB ALA 92 3HB ALA 92 15.962 20.114 -21.549 660 2HB ALA 92 2HB ALA 92 17.027 18.832 -20.926 661 3HB ALA 92 1HB ALA 92 17.389 20.539 -20.575 662 H LEU 93 H LEU 93 16.089 22.211 -20.094 663 HA LEU 93 HA LEU 93 16.310 23.027 -17.280 664 1HB LEU 93 1HB LEU 93 17.915 23.953 -19.662 665 2HB LEU 93 2HB LEU 93 17.871 24.804 -18.131 666 HG LEU 93 HG LEU 93 18.503 22.159 -17.446 667 1HD1 LEU 93 3HD1 LEU 93 18.934 21.879 -19.942 668 2HD1 LEU 93 1HD1 LEU 93 20.317 22.977 -19.717 669 3HD1 LEU 93 2HD1 LEU 93 20.255 21.431 -18.837 670 1HD2 LEU 93 2HD2 LEU 93 19.353 24.615 -16.778 671 2HD2 LEU 93 3HD2 LEU 93 20.242 23.128 -16.372 672 3HD2 LEU 93 1HD2 LEU 93 20.726 24.097 -17.784 673 H SER 94 H SER 94 16.505 25.314 -19.951 674 HA SER 94 HA SER 94 13.677 25.831 -19.790 675 1HB SER 94 1HB SER 94 14.179 27.331 -18.083 676 2HB SER 94 2HB SER 94 15.806 27.626 -18.664 677 HG SER 94 HG SER 94 13.453 28.988 -19.231 678 H SER 95 H SER 95 16.552 27.802 -20.819 679 HA SER 95 HA SER 95 15.359 27.964 -23.437 680 1HB SER 95 1HB SER 95 16.112 30.062 -22.492 681 2HB SER 95 2HB SER 95 17.687 29.400 -22.103 682 HG SER 95 HG SER 95 17.774 30.696 -24.030 683 H GLN 96 H GLN 96 17.820 26.224 -21.694 684 HA GLN 96 HA GLN 96 19.586 25.804 -23.823 685 1HB GLN 96 1HB GLN 96 19.342 25.036 -21.056 686 2HB GLN 96 2HB GLN 96 19.655 23.587 -21.989 687 1HG GLN 96 1HG GLN 96 21.645 24.622 -23.019 688 2HG GLN 96 2HG GLN 96 21.298 26.150 -22.235 689 1HE2 GLN 96 1HE2 GLN 96 22.984 23.289 -22.068 690 2HE2 GLN 96 2HE2 GLN 96 23.454 23.289 -20.401 691 H MET 97 H MET 97 16.777 23.954 -22.500 692 HA MET 97 HA MET 97 17.059 21.721 -24.062 693 1HB MET 97 1HB MET 97 15.458 22.024 -22.136 694 2HB MET 97 2HB MET 97 14.499 23.123 -23.108 695 1HG MET 97 1HG MET 97 15.074 20.334 -24.152 696 2HG MET 97 2HG MET 97 13.822 20.559 -22.947 697 1HE MET 97 2HE MET 97 13.228 19.253 -25.211 698 2HE MET 97 3HE MET 97 11.900 20.016 -26.119 699 3HE MET 97 1HE MET 97 13.557 20.050 -26.768 700 H GLY 98 H GLY 98 16.439 21.120 -26.153 701 1HA GLY 98 2HA GLY 98 15.039 23.145 -27.770 702 2HA GLY 98 1HA GLY 98 15.130 21.426 -28.098 703 H PHE 99 H PHE 99 16.527 24.524 -28.704 704 HA PHE 99 HA PHE 99 18.418 23.316 -30.501 705 1HB PHE 99 1HB PHE 99 16.833 25.640 -30.355 706 2HB PHE 99 2HB PHE 99 18.424 26.266 -29.973 707 HD1 PHE 99 1HD PHE 99 16.203 25.463 -32.575 708 HD2 PHE 99 2HD PHE 99 20.339 25.541 -31.627 709 HE1 PHE 99 1HE PHE 99 16.762 25.534 -35.021 710 HE2 PHE 99 2HE PHE 99 20.898 25.612 -34.073 711 HZ PHE 99 HZ PHE 99 19.103 25.607 -35.740 712 H MET 601 H MET 601 5.853 -21.026 -20.993 713 HA MET 601 HA MET 601 8.148 -20.373 -22.675 714 1HB MET 601 1HB MET 601 7.622 -22.399 -20.548 715 2HB MET 601 2HB MET 601 8.367 -23.081 -21.980 716 1HG MET 601 1HG MET 601 10.063 -21.094 -21.815 717 2HG MET 601 2HG MET 601 9.439 -20.861 -20.195 718 1HE MET 601 3HE MET 601 11.973 -21.690 -21.906 719 2HE MET 601 1HE MET 601 12.897 -22.255 -20.494 720 3HE MET 601 2HE MET 601 12.481 -23.393 -21.798 721 H THR 602 H THR 602 5.629 -22.956 -22.168 722 HA THR 602 HA THR 602 5.836 -24.283 -24.516 723 HB THR 602 HB THR 602 3.454 -23.500 -22.780 724 HG1 THR 602 1HG THR 602 5.366 -25.020 -22.253 725 1HG2 THR 602 2HG2 THR 602 2.858 -24.156 -25.277 726 2HG2 THR 602 3HG2 THR 602 3.425 -25.774 -24.797 727 3HG2 THR 602 1HG2 THR 602 2.052 -25.024 -23.948 728 H GLU 603 H GLU 603 4.557 -21.005 -24.031 729 HA GLU 603 HA GLU 603 4.703 -20.637 -26.853 730 1HB GLU 603 1HB GLU 603 2.331 -19.746 -27.006 731 2HB GLU 603 2HB GLU 603 2.453 -21.484 -26.827 732 1HG GLU 603 1HG GLU 603 2.325 -20.001 -24.248 733 2HG GLU 603 2HG GLU 603 0.890 -19.838 -25.241 734 HE2 GLU 603 HE GLU 603 2.262 -21.605 -23.026 735 H GLN 604 H GLN 604 5.571 -18.630 -27.178 736 HA GLN 604 HA GLN 604 6.080 -16.974 -25.020 737 1HB GLN 604 1HB GLN 604 6.879 -15.357 -26.752 738 2HB GLN 604 2HB GLN 604 7.502 -16.975 -27.002 739 1HG GLN 604 1HG GLN 604 5.745 -17.410 -28.711 740 2HG GLN 604 2HG GLN 604 5.065 -15.818 -28.437 741 1HE2 GLN 604 1HE2 GLN 604 5.750 -16.441 -30.925 742 2HE2 GLN 604 2HE2 GLN 604 7.176 -15.609 -31.451 743 H GLN 605 H GLN 605 3.493 -16.979 -27.509 744 HA GLN 605 HA GLN 605 2.457 -14.550 -27.324 745 1HB GLN 605 1HB GLN 605 0.969 -17.209 -27.306 746 2HB GLN 605 2HB GLN 605 0.175 -15.672 -27.586 747 1HG GLN 605 1HG GLN 605 2.519 -15.807 -29.283 748 2HG GLN 605 2HG GLN 605 1.613 -17.295 -29.476 749 1HE2 GLN 605 1HE2 GLN 605 -0.567 -17.230 -30.124 750 2HE2 GLN 605 2HE2 GLN 605 -1.229 -15.887 -30.994 751 H TRP 606 H TRP 606 1.748 -17.241 -24.985 752 HA TRP 606 HA TRP 606 1.387 -15.242 -22.912 753 1HB TRP 606 1HB TRP 606 -0.770 -15.993 -22.231 754 2HB TRP 606 2HB TRP 606 -0.849 -15.488 -23.907 755 HD1 TRP 606 HD TRP 606 -1.514 -17.371 -25.708 756 HE1 TRP 606 1HE TRP 606 -2.412 -19.851 -25.610 757 HE3 TRP 606 3HE TRP 606 -0.493 -18.103 -20.781 758 HZ2 TRP 606 2HZ TRP 606 -2.590 -21.796 -23.530 759 HZ3 TRP 606 3HZ TRP 606 -1.060 -20.321 -19.794 760 HH2 TRP 606 HH TRP 606 -2.073 -22.133 -21.085 761 H ASN 607 H ASN 607 3.089 -16.012 -21.678 762 HA ASN 607 HA ASN 607 3.693 -18.750 -21.577 763 1HB ASN 607 1HB ASN 607 4.541 -16.419 -19.779 764 2HB ASN 607 2HB ASN 607 5.256 -18.017 -19.700 765 1HD2 ASN 607 1HD2 ASN 607 7.278 -17.345 -20.273 766 2HD2 ASN 607 2HD2 ASN 607 7.715 -16.822 -21.865 767 H PHE 608 H PHE 608 3.263 -20.262 -19.845 768 HA PHE 608 HA PHE 608 0.857 -20.000 -18.522 769 1HB PHE 608 1HB PHE 608 1.628 -22.058 -17.398 770 2HB PHE 608 2HB PHE 608 2.249 -22.091 -19.036 771 HD1 PHE 608 1HD PHE 608 3.239 -21.056 -15.594 772 HD2 PHE 608 2HD PHE 608 4.509 -22.477 -19.386 773 HE1 PHE 608 1HE PHE 608 5.569 -21.344 -14.706 774 HE2 PHE 608 2HE PHE 608 6.839 -22.766 -18.498 775 HZ PHE 608 HZ PHE 608 7.341 -22.196 -16.169 776 H ALA 609 H ALA 609 4.037 -18.744 -17.710 777 HA ALA 609 HA ALA 609 3.294 -18.368 -14.925 778 1HB ALA 609 3HB ALA 609 5.798 -18.060 -16.583 779 2HB ALA 609 2HB ALA 609 5.529 -19.033 -15.117 780 3HB ALA 609 1HB ALA 609 5.672 -17.263 -14.997 781 H GLY 610 H GLY 610 2.725 -16.875 -17.900 782 1HA GLY 610 2HA GLY 610 2.665 -14.606 -18.490 783 2HA GLY 610 1HA GLY 610 2.863 -14.150 -16.810 784 H ILE 611 H ILE 611 0.580 -16.458 -18.450 785 HA ILE 611 HA ILE 611 -1.641 -14.750 -18.172 786 HB ILE 611 HB ILE 611 -1.311 -16.622 -19.817 787 1HG1 ILE 611 1HG1 ILE 611 -3.510 -15.400 -19.150 788 2HG1 ILE 611 2HG1 ILE 611 -3.581 -16.836 -20.152 789 1HG2 ILE 611 3HG2 ILE 611 -1.809 -18.250 -17.334 790 2HG2 ILE 611 1HG2 ILE 611 -2.266 -18.856 -18.944 791 3HG2 ILE 611 2HG2 ILE 611 -0.568 -18.456 -18.593 792 1HD1 ILE 611 2HD1 ILE 611 -3.840 -18.162 -17.919 793 2HD1 ILE 611 3HD1 ILE 611 -4.203 -16.578 -17.192 794 3HD1 ILE 611 1HD1 ILE 611 -5.236 -17.217 -18.493 795 H GLU 612 H GLU 612 -0.038 -17.101 -16.056 796 HA GLU 612 HA GLU 612 -2.212 -17.435 -14.325 797 1HB GLU 612 1HB GLU 612 -0.384 -19.049 -14.379 798 2HB GLU 612 2HB GLU 612 0.785 -17.821 -13.938 799 1HG GLU 612 1HG GLU 612 0.415 -18.750 -11.842 800 2HG GLU 612 2HG GLU 612 -0.817 -17.504 -11.817 801 HE2 GLU 612 HE GLU 612 -2.371 -20.435 -10.719 802 H ALA 613 H ALA 613 0.809 -15.420 -14.092 803 HA ALA 613 HA ALA 613 -0.167 -14.080 -11.762 804 1HB ALA 613 1HB ALA 613 2.273 -14.609 -12.467 805 2HB ALA 613 3HB ALA 613 1.935 -13.006 -11.772 806 3HB ALA 613 2HB ALA 613 2.123 -13.191 -13.532 807 H ALA 614 H ALA 614 -0.666 -13.828 -15.177 808 HA ALA 614 HA ALA 614 -0.871 -11.123 -15.589 809 1HB ALA 614 1HB ALA 614 -2.189 -13.582 -16.713 810 2HB ALA 614 2HB ALA 614 -2.800 -11.982 -17.200 811 3HB ALA 614 3HB ALA 614 -1.100 -12.415 -17.501 812 H ALA 615 H ALA 615 -3.403 -13.423 -14.370 813 HA ALA 615 HA ALA 615 -5.426 -11.570 -14.074 814 1HB ALA 615 2HB ALA 615 -6.453 -13.468 -13.456 815 2HB ALA 615 3HB ALA 615 -4.877 -14.293 -13.404 816 3HB ALA 615 1HB ALA 615 -5.515 -13.499 -11.944 817 H SER 616 H SER 616 -2.920 -12.643 -11.674 818 HA SER 616 HA SER 616 -3.757 -11.083 -9.607 819 1HB SER 616 1HB SER 616 -1.600 -12.772 -10.139 820 2HB SER 616 2HB SER 616 -0.815 -11.230 -9.862 821 HG SER 616 HG SER 616 -2.555 -11.306 -7.915 822 H ALA 617 H ALA 617 -2.020 -10.215 -12.576 823 HA ALA 617 HA ALA 617 -1.103 -7.691 -11.618 824 1HB ALA 617 3HB ALA 617 -0.508 -9.355 -13.732 825 2HB ALA 617 2HB ALA 617 0.013 -7.659 -13.593 826 3HB ALA 617 1HB ALA 617 -1.443 -8.069 -14.530 827 H ILE 618 H ILE 618 -3.983 -8.956 -13.341 828 HA ILE 618 HA ILE 618 -5.020 -6.466 -14.087 829 HB ILE 618 HB ILE 618 -6.365 -9.116 -13.552 830 1HG1 ILE 618 1HG1 ILE 618 -4.672 -9.273 -15.281 831 2HG1 ILE 618 2HG1 ILE 618 -6.271 -9.386 -15.989 832 1HG2 ILE 618 3HG2 ILE 618 -7.942 -7.207 -13.425 833 2HG2 ILE 618 1HG2 ILE 618 -7.451 -6.727 -15.067 834 3HG2 ILE 618 2HG2 ILE 618 -8.258 -8.291 -14.801 835 1HD1 ILE 618 2HD1 ILE 618 -5.763 -6.632 -16.029 836 2HD1 ILE 618 3HD1 ILE 618 -4.184 -7.357 -16.412 837 3HD1 ILE 618 1HD1 ILE 618 -5.607 -7.742 -17.411 838 H GLN 619 H GLN 619 -5.490 -8.525 -11.151 839 HA GLN 619 HA GLN 619 -7.405 -6.965 -9.971 840 1HB GLN 619 1HB GLN 619 -5.597 -9.118 -9.198 841 2HB GLN 619 2HB GLN 619 -5.765 -7.974 -7.881 842 1HG GLN 619 1HG GLN 619 -8.133 -9.177 -9.389 843 2HG GLN 619 2HG GLN 619 -7.500 -9.834 -7.893 844 1HE2 GLN 619 1HE2 GLN 619 -10.046 -8.402 -8.826 845 2HE2 GLN 619 2HE2 GLN 619 -10.353 -7.208 -7.610 846 H GLY 620 H GLY 620 -3.856 -6.977 -9.141 847 1HA GLY 620 2HA GLY 620 -2.484 -5.319 -8.490 848 2HA GLY 620 1HA GLY 620 -3.834 -4.744 -7.532 849 H ASN 621 H ASN 621 -3.881 -4.991 -11.111 850 HA ASN 621 HA ASN 621 -3.184 -2.283 -11.479 851 1HB ASN 621 1HB ASN 621 -4.226 -4.533 -13.219 852 2HB ASN 621 2HB ASN 621 -4.319 -2.900 -13.849 853 1HD2 ASN 621 1HD2 ASN 621 -2.129 -1.664 -12.959 854 2HD2 ASN 621 2HD2 ASN 621 -0.674 -2.401 -13.542 855 H VAL 622 H VAL 622 -6.165 -4.216 -11.080 856 HA VAL 622 HA VAL 622 -7.977 -2.298 -12.056 857 HB VAL 622 HB VAL 622 -8.182 -4.679 -10.222 858 1HG1 VAL 622 1HG1 VAL 622 -10.350 -2.742 -11.057 859 2HG1 VAL 622 2HG1 VAL 622 -10.704 -4.427 -10.606 860 3HG1 VAL 622 3HG1 VAL 622 -9.948 -3.330 -9.426 861 1HG2 VAL 622 3HG2 VAL 622 -7.935 -4.487 -12.963 862 2HG2 VAL 622 1HG2 VAL 622 -8.609 -5.875 -12.076 863 3HG2 VAL 622 2HG2 VAL 622 -9.695 -4.630 -12.740 864 H THR 623 H THR 623 -6.969 -3.187 -8.677 865 HA THR 623 HA THR 623 -8.429 -1.159 -7.431 866 HB THR 623 HB THR 623 -6.975 -1.732 -5.506 867 HG1 THR 623 1HG THR 623 -4.979 -1.727 -6.800 868 1HG2 THR 623 3HG2 THR 623 -8.607 -3.547 -6.549 869 2HG2 THR 623 1HG2 THR 623 -7.100 -4.314 -7.103 870 3HG2 THR 623 2HG2 THR 623 -7.385 -4.066 -5.364 871 H SER 624 H SER 624 -5.149 -1.165 -8.884 872 HA SER 624 HA SER 624 -4.225 1.159 -7.856 873 1HB SER 624 1HB SER 624 -3.883 -0.121 -10.588 874 2HB SER 624 2HB SER 624 -3.050 1.366 -10.184 875 HG SER 624 HG SER 624 -2.896 -0.899 -8.419 876 H ILE 625 H ILE 625 -6.340 0.671 -10.761 877 HA ILE 625 HA ILE 625 -6.501 3.446 -11.328 878 HB ILE 625 HB ILE 625 -7.687 0.926 -12.336 879 1HG1 ILE 625 1HG1 ILE 625 -7.131 2.768 -14.392 880 2HG1 ILE 625 2HG1 ILE 625 -5.862 3.003 -13.207 881 1HG2 ILE 625 3HG2 ILE 625 -9.049 3.607 -12.587 882 2HG2 ILE 625 1HG2 ILE 625 -9.242 2.324 -13.805 883 3HG2 ILE 625 2HG2 ILE 625 -9.744 2.036 -12.122 884 1HD1 ILE 625 3HD1 ILE 625 -6.690 0.243 -14.202 885 2HD1 ILE 625 1HD1 ILE 625 -5.394 1.204 -14.954 886 3HD1 ILE 625 2HD1 ILE 625 -5.238 0.666 -13.265 887 H HIS 626 H HIS 626 -8.217 1.177 -9.216 888 HA HIS 626 HA HIS 626 -10.561 2.634 -8.900 889 1HB HIS 626 1HB HIS 626 -10.049 0.254 -8.185 890 2HB HIS 626 2HB HIS 626 -9.210 0.924 -6.799 891 HD1 HIS 626 1HD HIS 626 -11.079 -0.404 -5.378 892 HD2 HIS 626 2HD HIS 626 -12.449 2.856 -7.635 893 HE1 HIS 626 1HE HIS 626 -13.389 0.177 -4.465 894 H SER 627 H SER 627 -7.397 2.763 -7.156 895 HA SER 627 HA SER 627 -8.366 4.863 -5.488 896 1HB SER 627 1HB SER 627 -5.742 3.397 -5.815 897 2HB SER 627 2HB SER 627 -5.774 4.897 -4.910 898 HG SER 627 HG SER 627 -7.633 3.853 -3.679 899 H LEU 628 H LEU 628 -6.003 4.471 -8.210 900 HA LEU 628 HA LEU 628 -4.951 6.946 -8.363 901 1HB LEU 628 1HB LEU 628 -5.625 4.822 -10.308 902 2HB LEU 628 2HB LEU 628 -5.317 6.408 -10.988 903 HG LEU 628 HG LEU 628 -3.341 5.373 -9.007 904 1HD1 LEU 628 3HD1 LEU 628 -3.822 4.149 -11.711 905 2HD1 LEU 628 1HD1 LEU 628 -2.182 4.225 -11.023 906 3HD1 LEU 628 2HD1 LEU 628 -3.473 3.362 -10.153 907 1HD2 LEU 628 1HD2 LEU 628 -3.235 7.030 -11.532 908 2HD2 LEU 628 2HD2 LEU 628 -2.893 7.530 -9.858 909 3HD2 LEU 628 3HD2 LEU 628 -1.778 6.429 -10.704 910 H LEU 629 H LEU 629 -8.110 5.915 -9.829 911 HA LEU 629 HA LEU 629 -8.808 8.340 -10.901 912 1HB LEU 629 1HB LEU 629 -10.074 5.832 -10.236 913 2HB LEU 629 2HB LEU 629 -11.166 7.167 -9.925 914 HG LEU 629 HG LEU 629 -11.373 6.158 -12.195 915 1HD1 LEU 629 3HD1 LEU 629 -10.931 9.038 -11.643 916 2HD1 LEU 629 1HD1 LEU 629 -10.985 8.555 -13.356 917 3HD1 LEU 629 2HD1 LEU 629 -12.358 8.189 -12.284 918 1HD2 LEU 629 3HD2 LEU 629 -8.567 6.369 -12.205 919 2HD2 LEU 629 1HD2 LEU 629 -9.628 5.798 -13.515 920 3HD2 LEU 629 2HD2 LEU 629 -9.154 7.512 -13.437 921 H ASP 630 H ASP 630 -9.214 7.123 -7.530 922 HA ASP 630 HA ASP 630 -10.679 9.323 -6.671 923 1HB ASP 630 1HB ASP 630 -9.154 7.071 -5.433 924 2HB ASP 630 2HB ASP 630 -9.354 8.476 -4.404 925 HD2 ASP 630 HD ASP 630 -11.932 9.159 -4.505 926 H GLU 631 H GLU 631 -7.246 8.704 -7.264 927 HA GLU 631 HA GLU 631 -6.298 10.771 -5.584 928 1HB GLU 631 1HB GLU 631 -5.183 8.721 -7.357 929 2HB GLU 631 2HB GLU 631 -4.333 10.243 -7.541 930 1HG GLU 631 1HG GLU 631 -3.793 10.345 -5.188 931 2HG GLU 631 2HG GLU 631 -4.930 9.071 -4.794 932 HE2 GLU 631 HE GLU 631 -3.162 6.887 -4.581 933 H GLY 632 H GLY 632 -6.971 10.398 -9.114 934 1HA GLY 632 2HA GLY 632 -6.986 11.910 -10.794 935 2HA GLY 632 1HA GLY 632 -6.068 13.020 -9.796 936 H LYS 633 H LYS 633 -9.221 11.502 -8.932 937 HA LYS 633 HA LYS 633 -10.904 13.510 -9.759 938 1HB LYS 633 1HB LYS 633 -11.394 11.167 -8.788 939 2HB LYS 633 2HB LYS 633 -11.326 11.939 -7.216 940 1HG LYS 633 1HG LYS 633 -13.644 11.951 -7.948 941 2HG LYS 633 2HG LYS 633 -13.060 13.603 -7.994 942 1HD LYS 633 1HD LYS 633 -12.409 12.684 -10.544 943 2HD LYS 633 2HD LYS 633 -13.911 11.841 -10.225 944 1HE LYS 633 1HE LYS 633 -14.957 14.063 -9.572 945 2HE LYS 633 2HE LYS 633 -13.470 14.860 -10.046 946 H GLN 634 H GLN 634 -8.786 13.303 -6.886 947 HA GLN 634 HA GLN 634 -9.937 15.486 -5.576 948 1HB GLN 634 1HB GLN 634 -7.264 14.066 -5.374 949 2HB GLN 634 2HB GLN 634 -7.592 15.489 -4.405 950 1HG GLN 634 1HG GLN 634 -9.906 13.994 -4.020 951 2HG GLN 634 2HG GLN 634 -8.689 12.740 -4.154 952 1HE2 GLN 634 1HE2 GLN 634 -10.334 14.219 -1.955 953 2HE2 GLN 634 2HE2 GLN 634 -9.194 14.463 -0.674 954 H SER 635 H SER 635 -7.511 15.139 -8.151 955 HA SER 635 HA SER 635 -6.623 17.832 -7.870 956 1HB SER 635 1HB SER 635 -5.744 15.455 -9.216 957 2HB SER 635 2HB SER 635 -5.952 16.689 -10.442 958 HG SER 635 HG SER 635 -3.798 16.648 -9.412 959 H LEU 636 H LEU 636 -9.254 16.142 -9.392 960 HA LEU 636 HA LEU 636 -9.635 17.775 -11.637 961 1HB LEU 636 1HB LEU 636 -10.971 15.618 -10.265 962 2HB LEU 636 2HB LEU 636 -12.133 16.838 -10.748 963 HG LEU 636 HG LEU 636 -11.771 14.971 -12.388 964 1HD1 LEU 636 1HD1 LEU 636 -11.686 17.869 -12.975 965 2HD1 LEU 636 2HD1 LEU 636 -11.268 16.790 -14.327 966 3HD1 LEU 636 3HD1 LEU 636 -12.835 16.615 -13.500 967 1HD2 LEU 636 2HD2 LEU 636 -9.306 14.809 -12.047 968 2HD2 LEU 636 3HD2 LEU 636 -9.802 14.898 -13.754 969 3HD2 LEU 636 1HD2 LEU 636 -9.125 16.334 -12.948 970 H THR 637 H THR 637 -11.067 17.880 -8.303 971 HA THR 637 HA THR 637 -12.447 20.315 -8.838 972 HB THR 637 HB THR 637 -13.400 18.890 -7.179 973 HG1 THR 637 1HG THR 637 -13.492 20.629 -5.815 974 1HG2 THR 637 1HG2 THR 637 -10.529 18.610 -6.236 975 2HG2 THR 637 2HG2 THR 637 -11.853 18.412 -5.063 976 3HG2 THR 637 3HG2 THR 637 -11.752 17.340 -6.481 977 H LYS 638 H LYS 638 -9.206 19.456 -7.692 978 HA LYS 638 HA LYS 638 -8.704 22.103 -6.706 979 1HB LYS 638 1HB LYS 638 -6.964 19.659 -7.116 980 2HB LYS 638 2HB LYS 638 -6.344 21.185 -6.518 981 1HG LYS 638 1HG LYS 638 -8.191 21.080 -4.713 982 2HG LYS 638 2HG LYS 638 -8.479 19.431 -5.230 983 1HD LYS 638 1HD LYS 638 -5.860 20.556 -4.136 984 2HD LYS 638 2HD LYS 638 -6.930 19.432 -3.322 985 1HE LYS 638 1HE LYS 638 -6.516 17.996 -5.580 986 2HE LYS 638 2HE LYS 638 -5.039 18.938 -5.614 987 H LEU 639 H LEU 639 -8.621 20.419 -9.771 988 HA LEU 639 HA LEU 639 -6.951 22.544 -10.898 989 1HB LEU 639 1HB LEU 639 -7.746 19.837 -11.977 990 2HB LEU 639 2HB LEU 639 -6.822 21.030 -12.868 991 HG LEU 639 HG LEU 639 -5.833 20.071 -10.196 992 1HD1 LEU 639 3HD1 LEU 639 -6.461 18.109 -11.725 993 2HD1 LEU 639 1HD1 LEU 639 -5.109 18.645 -12.751 994 3HD1 LEU 639 2HD1 LEU 639 -4.808 18.157 -11.066 995 1HD2 LEU 639 1HD2 LEU 639 -4.844 22.033 -11.527 996 2HD2 LEU 639 2HD2 LEU 639 -3.730 20.783 -10.923 997 3HD2 LEU 639 3HD2 LEU 639 -4.216 20.791 -12.635 998 H ALA 640 H ALA 640 -10.188 21.670 -10.338 999 HA ALA 640 HA ALA 640 -11.536 22.164 -12.636 1000 1HB ALA 640 3HB ALA 640 -13.382 22.838 -11.205 1001 2HB ALA 640 1HB ALA 640 -12.476 21.537 -10.395 1002 3HB ALA 640 2HB ALA 640 -12.262 23.227 -9.877 1003 H ALA 641 H ALA 641 -9.982 24.537 -10.418 1004 HA ALA 641 HA ALA 641 -11.013 26.847 -11.536 1005 1HB ALA 641 1HB ALA 641 -9.640 27.805 -10.018 1006 2HB ALA 641 2HB ALA 641 -9.214 26.145 -9.537 1007 3HB ALA 641 3HB ALA 641 -8.197 27.022 -10.706 1008 H ALA 642 H ALA 642 -8.514 24.593 -12.677 1009 HA ALA 642 HA ALA 642 -7.222 26.262 -14.483 1010 1HB ALA 642 2HB ALA 642 -6.829 23.767 -13.631 1011 2HB ALA 642 1HB ALA 642 -6.206 24.313 -15.206 1012 3HB ALA 642 3HB ALA 642 -7.712 23.368 -15.124 1013 H TRP 643 H TRP 643 -10.454 24.915 -14.467 1014 HA TRP 643 HA TRP 643 -10.750 25.311 -17.333 1015 1HB TRP 643 1HB TRP 643 -12.443 24.076 -15.180 1016 2HB TRP 643 2HB TRP 643 -13.142 24.528 -16.722 1017 HD1 TRP 643 HD TRP 643 -12.702 22.867 -18.754 1018 HE1 TRP 643 1HE TRP 643 -11.472 20.562 -19.123 1019 HE3 TRP 643 3HE TRP 643 -10.301 22.830 -14.271 1020 HZ2 TRP 643 2HZ TRP 643 -9.674 19.016 -17.535 1021 HZ3 TRP 643 3HZ TRP 643 -8.828 20.886 -13.759 1022 HH2 TRP 643 HH TRP 643 -8.496 19.023 -15.305 1023 H GLY 644 H GLY 644 -11.028 26.980 -14.311 1024 1HA GLY 644 2HA GLY 644 -12.970 28.900 -15.422 1025 2HA GLY 644 1HA GLY 644 -11.389 29.445 -14.900 1026 H GLY 645 H GLY 645 -12.775 26.703 -13.186 1027 1HA GLY 645 2HA GLY 645 -14.192 28.212 -11.211 1028 2HA GLY 645 1HA GLY 645 -12.582 27.777 -10.671 1029 H SER 646 H SER 646 -14.491 26.681 -9.165 1030 HA SER 646 HA SER 646 -14.624 23.946 -10.167 1031 1HB SER 646 1HB SER 646 -14.855 23.427 -7.618 1032 2HB SER 646 2HB SER 646 -13.274 23.846 -8.246 1033 HG SER 646 HG SER 646 -14.946 25.266 -6.482 1034 H GLY 647 H GLY 647 -16.656 24.911 -11.288 1035 1HA GLY 647 2HA GLY 647 -18.887 25.686 -9.721 1036 2HA GLY 647 1HA GLY 647 -18.963 23.970 -10.067 1037 H SER 648 H SER 648 -17.403 26.376 -12.223 1038 HA SER 648 HA SER 648 -19.501 27.031 -13.800 1039 1HB SER 648 1HB SER 648 -16.555 26.904 -14.092 1040 2HB SER 648 2HB SER 648 -17.409 26.809 -15.620 1041 HG SER 648 HG SER 648 -17.209 28.954 -13.789 1042 H GLU 649 H GLU 649 -20.505 26.140 -15.681 1043 HA GLU 649 HA GLU 649 -20.913 23.470 -15.707 1044 1HB GLU 649 1HB GLU 649 -22.370 25.052 -16.871 1045 2HB GLU 649 2HB GLU 649 -21.098 25.466 -18.002 1046 1HG GLU 649 1HG GLU 649 -22.378 23.909 -19.227 1047 2HG GLU 649 2HG GLU 649 -21.072 22.918 -18.607 1048 HE2 GLU 649 HE GLU 649 -23.825 22.363 -19.266 1049 H ALA 650 H ALA 650 -18.330 25.354 -17.303 1050 HA ALA 650 HA ALA 650 -17.424 23.509 -19.125 1051 1HB ALA 650 1HB ALA 650 -16.489 25.918 -17.797 1052 2HB ALA 650 3HB ALA 650 -16.095 25.299 -19.419 1053 3HB ALA 650 2HB ALA 650 -15.152 24.762 -18.008 1054 H TYR 651 H TYR 651 -15.870 24.055 -15.885 1055 HA TYR 651 HA TYR 651 -14.414 21.730 -15.866 1056 1HB TYR 651 1HB TYR 651 -13.988 23.387 -14.181 1057 2HB TYR 651 2HB TYR 651 -15.694 23.636 -13.870 1058 HD1 TYR 651 1HD TYR 651 -13.260 20.776 -13.635 1059 HD2 TYR 651 2HD TYR 651 -16.417 22.984 -11.773 1060 HE1 TYR 651 1HE TYR 651 -13.112 19.276 -11.588 1061 HE2 TYR 651 2HE TYR 651 -16.258 21.476 -9.733 1062 HH TYR 651 HH TYR 651 -15.468 19.521 -9.000 1063 H GLN 652 H GLN 652 -17.850 22.272 -15.020 1064 HA GLN 652 HA GLN 652 -18.276 19.950 -13.626 1065 1HB GLN 652 1HB GLN 652 -20.068 21.664 -15.376 1066 2HB GLN 652 2HB GLN 652 -20.695 20.238 -14.574 1067 1HG GLN 652 1HG GLN 652 -19.220 21.612 -12.574 1068 2HG GLN 652 2HG GLN 652 -20.075 22.868 -13.446 1069 1HE2 GLN 652 1HE2 GLN 652 -20.750 22.534 -10.920 1070 2HE2 GLN 652 2HE2 GLN 652 -22.288 21.762 -10.726 1071 H GLY 653 H GLY 653 -18.728 20.591 -17.178 1072 1HA GLY 653 2HA GLY 653 -18.703 19.209 -18.948 1073 2HA GLY 653 1HA GLY 653 -19.522 18.042 -17.929 1074 H VAL 654 H VAL 654 -16.344 19.274 -16.953 1075 HA VAL 654 HA VAL 654 -14.919 17.118 -18.205 1076 HB VAL 654 HB VAL 654 -14.195 19.358 -16.321 1077 1HG1 VAL 654 2HG1 VAL 654 -12.816 17.371 -15.784 1078 2HG1 VAL 654 3HG1 VAL 654 -12.304 17.286 -17.487 1079 3HG1 VAL 654 1HG1 VAL 654 -11.859 18.694 -16.493 1080 1HG2 VAL 654 2HG2 VAL 654 -14.551 19.290 -19.072 1081 2HG2 VAL 654 3HG2 VAL 654 -13.647 20.521 -18.157 1082 3HG2 VAL 654 1HG2 VAL 654 -12.788 19.138 -18.878 1083 H GLN 655 H GLN 655 -16.165 17.988 -14.945 1084 HA GLN 655 HA GLN 655 -14.894 15.991 -13.552 1085 1HB GLN 655 1HB GLN 655 -17.083 17.872 -13.125 1086 2HB GLN 655 2HB GLN 655 -17.447 16.338 -12.360 1087 1HG GLN 655 1HG GLN 655 -14.642 17.209 -11.952 1088 2HG GLN 655 2HG GLN 655 -15.815 18.331 -11.292 1089 1HE2 GLN 655 1HE2 GLN 655 -14.261 17.196 -9.526 1090 2HE2 GLN 655 2HE2 GLN 655 -15.048 15.956 -8.608 1091 H GLN 656 H GLN 656 -18.147 16.001 -15.160 1092 HA GLN 656 HA GLN 656 -18.733 13.375 -14.428 1093 1HB GLN 656 1HB GLN 656 -20.585 13.561 -16.007 1094 2HB GLN 656 2HB GLN 656 -20.422 15.073 -15.137 1095 1HG GLN 656 1HG GLN 656 -18.929 15.853 -17.132 1096 2HG GLN 656 2HG GLN 656 -19.560 14.462 -17.990 1097 1HE2 GLN 656 1HE2 GLN 656 -20.558 17.284 -16.085 1098 2HE2 GLN 656 2HE2 GLN 656 -22.025 17.627 -16.940 1099 H LYS 657 H LYS 657 -17.256 14.850 -17.376 1100 HA LYS 657 HA LYS 657 -17.153 12.509 -18.885 1101 1HB LYS 657 1HB LYS 657 -15.690 15.135 -18.920 1102 2HB LYS 657 2HB LYS 657 -15.157 13.834 -19.965 1103 1HG LYS 657 1HG LYS 657 -17.589 13.627 -20.772 1104 2HG LYS 657 2HG LYS 657 -17.932 15.100 -19.888 1105 1HD LYS 657 1HD LYS 657 -15.658 14.989 -21.904 1106 2HD LYS 657 2HD LYS 657 -17.305 15.287 -22.424 1107 1HE LYS 657 1HE LYS 657 -17.368 17.182 -20.656 1108 2HE LYS 657 2HE LYS 657 -15.634 16.974 -20.513 1109 H TRP 658 H TRP 658 -15.272 13.643 -16.129 1110 HA TRP 658 HA TRP 658 -13.021 11.978 -16.614 1111 1HB TRP 658 1HB TRP 658 -12.671 13.889 -15.294 1112 2HB TRP 658 2HB TRP 658 -14.034 13.539 -14.250 1113 HD1 TRP 658 HD TRP 658 -13.564 11.935 -12.159 1114 HE1 TRP 658 1HE TRP 658 -11.446 10.814 -11.054 1115 HE3 TRP 658 3HE TRP 658 -10.405 12.851 -16.036 1116 HZ2 TRP 658 2HZ TRP 658 -8.748 10.444 -11.906 1117 HZ3 TRP 658 3HZ TRP 658 -8.045 12.078 -15.819 1118 HH2 TRP 658 HH TRP 658 -7.202 10.912 -13.843 1119 H ASP 659 H ASP 659 -15.888 11.835 -14.376 1120 HA ASP 659 HA ASP 659 -15.270 9.318 -13.406 1121 1HB ASP 659 1HB ASP 659 -17.227 11.275 -12.967 1122 2HB ASP 659 2HB ASP 659 -18.161 9.930 -13.592 1123 HD2 ASP 659 HD ASP 659 -18.007 10.633 -10.374 1124 H ALA 660 H ALA 660 -17.227 10.522 -16.183 1125 HA ALA 660 HA ALA 660 -18.668 8.382 -16.930 1126 1HB ALA 660 1HB ALA 660 -19.008 9.798 -18.638 1127 2HB ALA 660 2HB ALA 660 -17.588 10.749 -18.141 1128 3HB ALA 660 3HB ALA 660 -17.399 9.400 -19.287 1129 H THR 661 H THR 661 -15.638 8.892 -18.798 1130 HA THR 661 HA THR 661 -15.330 6.232 -19.466 1131 HB THR 661 HB THR 661 -13.128 6.968 -20.242 1132 HG1 THR 661 1HG THR 661 -12.560 9.232 -19.314 1133 1HG2 THR 661 2HG2 THR 661 -15.369 8.288 -21.041 1134 2HG2 THR 661 3HG2 THR 661 -14.516 9.640 -20.258 1135 3HG2 THR 661 1HG2 THR 661 -13.747 8.761 -21.601 1136 H ALA 662 H ALA 662 -14.284 7.977 -16.534 1137 HA ALA 662 HA ALA 662 -12.451 6.173 -15.568 1138 1HB ALA 662 3HB ALA 662 -12.614 8.142 -14.353 1139 2HB ALA 662 2HB ALA 662 -13.503 7.027 -13.287 1140 3HB ALA 662 1HB ALA 662 -14.394 8.129 -14.364 1141 H THR 663 H THR 663 -15.703 6.333 -14.028 1142 HA THR 663 HA THR 663 -15.724 3.811 -13.027 1143 HB THR 663 HB THR 663 -17.407 5.439 -12.406 1144 HG1 THR 663 1HG THR 663 -18.018 3.091 -12.673 1145 1HG2 THR 663 3HG2 THR 663 -17.625 5.810 -15.308 1146 2HG2 THR 663 1HG2 THR 663 -19.218 5.463 -14.593 1147 3HG2 THR 663 2HG2 THR 663 -18.257 6.840 -14.002 1148 H GLU 664 H GLU 664 -16.265 4.786 -16.397 1149 HA GLU 664 HA GLU 664 -17.507 2.477 -17.243 1150 1HB GLU 664 1HB GLU 664 -17.392 4.483 -18.633 1151 2HB GLU 664 2HB GLU 664 -15.644 4.392 -18.709 1152 1HG GLU 664 1HG GLU 664 -17.036 3.462 -20.727 1153 2HG GLU 664 2HG GLU 664 -15.658 2.538 -20.163 1154 HE2 GLU 664 HE GLU 664 -19.237 1.343 -18.820 1155 H LEU 665 H LEU 665 -13.992 3.340 -17.070 1156 HA LEU 665 HA LEU 665 -13.236 0.728 -17.996 1157 1HB LEU 665 1HB LEU 665 -12.021 2.839 -18.531 1158 2HB LEU 665 2HB LEU 665 -11.543 2.951 -16.849 1159 HG LEU 665 HG LEU 665 -10.665 0.447 -17.406 1160 1HD1 LEU 665 3HD1 LEU 665 -11.028 1.800 -20.000 1161 2HD1 LEU 665 1HD1 LEU 665 -9.416 1.092 -19.738 1162 3HD1 LEU 665 2HD1 LEU 665 -10.869 0.071 -19.610 1163 1HD2 LEU 665 2HD2 LEU 665 -9.482 3.125 -17.244 1164 2HD2 LEU 665 3HD2 LEU 665 -8.989 1.597 -16.476 1165 3HD2 LEU 665 1HD2 LEU 665 -8.490 1.954 -18.147 1166 H ASN 666 H ASN 666 -13.768 2.416 -14.922 1167 HA ASN 666 HA ASN 666 -12.283 0.748 -13.309 1168 1HB ASN 666 1HB ASN 666 -13.915 2.962 -12.939 1169 2HB ASN 666 2HB ASN 666 -14.890 1.707 -12.201 1170 1HD2 ASN 666 1HD2 ASN 666 -12.560 3.951 -11.668 1171 2HD2 ASN 666 2HD2 ASN 666 -11.804 3.328 -10.240 1172 H ASN 667 H ASN 667 -15.665 0.595 -14.569 1173 HA ASN 667 HA ASN 667 -16.355 -1.662 -13.039 1174 1HB ASN 667 1HB ASN 667 -18.427 -1.596 -14.240 1175 2HB ASN 667 2HB ASN 667 -17.923 0.081 -14.173 1176 1HD2 ASN 667 1HD2 ASN 667 -18.102 1.149 -15.976 1177 2HD2 ASN 667 2HD2 ASN 667 -17.978 0.530 -17.589 1178 H ALA 668 H ALA 668 -15.022 -1.006 -16.310 1179 HA ALA 668 HA ALA 668 -15.371 -3.615 -17.328 1180 1HB ALA 668 3HB ALA 668 -14.858 -1.272 -18.459 1181 2HB ALA 668 1HB ALA 668 -13.167 -1.781 -18.238 1182 3HB ALA 668 2HB ALA 668 -14.279 -2.784 -19.199 1183 H LEU 669 H LEU 669 -12.692 -1.904 -15.615 1184 HA LEU 669 HA LEU 669 -10.846 -3.998 -15.858 1185 1HB LEU 669 1HB LEU 669 -11.074 -1.431 -14.523 1186 2HB LEU 669 2HB LEU 669 -10.254 -2.606 -13.515 1187 HG LEU 669 HG LEU 669 -9.410 -2.249 -16.379 1188 1HD1 LEU 669 1HD1 LEU 669 -9.489 0.015 -15.479 1189 2HD1 LEU 669 2HD1 LEU 669 -8.527 -0.495 -14.071 1190 3HD1 LEU 669 3HD1 LEU 669 -7.807 -0.523 -15.698 1191 1HD2 LEU 669 1HD2 LEU 669 -8.598 -4.116 -14.805 1192 2HD2 LEU 669 2HD2 LEU 669 -7.381 -3.186 -15.710 1193 3HD2 LEU 669 3HD2 LEU 669 -7.671 -2.834 -13.990 1194 H GLN 670 H GLN 670 -13.376 -3.210 -13.423 1195 HA GLN 670 HA GLN 670 -12.595 -5.212 -11.643 1196 1HB GLN 670 1HB GLN 670 -14.909 -3.378 -11.999 1197 2HB GLN 670 2HB GLN 670 -15.284 -4.859 -11.139 1198 1HG GLN 670 1HG GLN 670 -12.747 -3.801 -10.178 1199 2HG GLN 670 2HG GLN 670 -13.961 -2.538 -10.122 1200 1HE2 GLN 670 1HE2 GLN 670 -12.673 -3.893 -7.938 1201 2HE2 GLN 670 2HE2 GLN 670 -13.895 -4.665 -6.984 1202 H ASN 671 H ASN 671 -15.244 -5.069 -14.130 1203 HA ASN 671 HA ASN 671 -16.147 -7.630 -13.700 1204 1HB ASN 671 1HB ASN 671 -17.098 -5.651 -15.173 1205 2HB ASN 671 2HB ASN 671 -16.113 -6.329 -16.455 1206 1HD2 ASN 671 1HD2 ASN 671 -17.818 -6.937 -17.713 1207 2HD2 ASN 671 2HD2 ASN 671 -18.891 -8.243 -17.337 1208 H LEU 672 H LEU 672 -13.362 -6.309 -15.464 1209 HA LEU 672 HA LEU 672 -12.903 -8.625 -17.059 1210 1HB LEU 672 1HB LEU 672 -12.137 -6.599 -17.930 1211 2HB LEU 672 2HB LEU 672 -11.381 -6.117 -16.424 1212 HG LEU 672 HG LEU 672 -10.179 -8.567 -17.375 1213 1HD1 LEU 672 2HD1 LEU 672 -11.097 -7.341 -19.545 1214 2HD1 LEU 672 3HD1 LEU 672 -9.623 -6.371 -19.316 1215 3HD1 LEU 672 1HD1 LEU 672 -9.505 -8.136 -19.508 1216 1HD2 LEU 672 3HD2 LEU 672 -9.416 -6.461 -15.875 1217 2HD2 LEU 672 1HD2 LEU 672 -8.278 -7.579 -16.665 1218 3HD2 LEU 672 2HD2 LEU 672 -8.667 -6.018 -17.428 1219 H ALA 673 H ALA 673 -11.588 -7.298 -13.965 1220 HA ALA 673 HA ALA 673 -9.772 -9.457 -13.632 1221 1HB ALA 673 3HB ALA 673 -10.231 -6.924 -12.509 1222 2HB ALA 673 1HB ALA 673 -10.550 -8.071 -11.185 1223 3HB ALA 673 2HB ALA 673 -8.980 -8.095 -12.025 1224 H ARG 674 H ARG 674 -13.196 -9.018 -13.192 1225 HA ARG 674 HA ARG 674 -13.496 -10.813 -11.065 1226 1HB ARG 674 1HB ARG 674 -15.326 -9.561 -13.126 1227 2HB ARG 674 2HB ARG 674 -15.943 -10.900 -12.178 1228 1HG ARG 674 1HG ARG 674 -14.695 -9.280 -10.254 1229 2HG ARG 674 2HG ARG 674 -15.402 -8.115 -11.357 1230 1HD ARG 674 1HD ARG 674 -17.600 -9.440 -11.182 1231 2HD ARG 674 2HD ARG 674 -16.855 -10.370 -9.897 1232 HE ARG 674 HE ARG 674 -17.742 -7.571 -9.749 1233 2HH1 ARG 674 1HH ARG 674 -16.836 -7.215 -6.415 1234 1HH2 ARG 674 2HH2 ARG 674 -15.718 -10.070 -8.261 1235 2HH2 ARG 674 1HH2 ARG 674 -15.674 -9.289 -6.716 1236 H THR 675 H THR 675 -13.223 -11.101 -14.599 1237 HA THR 675 HA THR 675 -13.819 -13.976 -14.398 1238 HB THR 675 HB THR 675 -13.857 -11.994 -16.733 1239 HG1 THR 675 1HG THR 675 -15.601 -12.161 -14.985 1240 1HG2 THR 675 2HG2 THR 675 -13.199 -14.463 -17.294 1241 2HG2 THR 675 3HG2 THR 675 -14.839 -14.882 -16.741 1242 3HG2 THR 675 1HG2 THR 675 -14.620 -13.792 -18.131 1243 H ILE 676 H ILE 676 -11.267 -11.726 -14.478 1244 HA ILE 676 HA ILE 676 -9.513 -13.577 -15.892 1245 HB ILE 676 HB ILE 676 -9.353 -10.699 -15.076 1246 1HG1 ILE 676 1HG1 ILE 676 -9.144 -12.247 -17.661 1247 2HG1 ILE 676 2HG1 ILE 676 -10.321 -11.029 -17.211 1248 1HG2 ILE 676 2HG2 ILE 676 -7.131 -12.586 -15.118 1249 2HG2 ILE 676 3HG2 ILE 676 -6.913 -11.250 -16.273 1250 3HG2 ILE 676 1HG2 ILE 676 -7.198 -10.899 -14.552 1251 1HD1 ILE 676 3HD1 ILE 676 -8.084 -9.531 -16.923 1252 2HD1 ILE 676 1HD1 ILE 676 -7.490 -10.690 -18.137 1253 3HD1 ILE 676 2HD1 ILE 676 -8.926 -9.696 -18.483 1254 H SER 677 H SER 677 -9.672 -11.749 -12.754 1255 HA SER 677 HA SER 677 -7.557 -12.797 -11.523 1256 1HB SER 677 1HB SER 677 -9.082 -11.118 -10.530 1257 2HB SER 677 2HB SER 677 -10.319 -12.339 -10.311 1258 HG SER 677 HG SER 677 -9.313 -12.239 -8.333 1259 H GLU 678 H GLU 678 -10.583 -14.443 -12.366 1260 HA GLU 678 HA GLU 678 -10.328 -16.575 -10.594 1261 1HB GLU 678 1HB GLU 678 -11.810 -17.720 -12.463 1262 2HB GLU 678 2HB GLU 678 -12.463 -16.408 -11.502 1263 1HG GLU 678 1HG GLU 678 -12.558 -14.974 -13.288 1264 2HG GLU 678 2HG GLU 678 -10.987 -15.465 -13.892 1265 HE2 GLU 678 HE GLU 678 -14.389 -16.076 -14.407 1266 H ALA 679 H ALA 679 -8.825 -15.798 -13.706 1267 HA ALA 679 HA ALA 679 -8.112 -18.209 -14.701 1268 1HB ALA 679 2HB ALA 679 -6.202 -15.860 -14.453 1269 2HB ALA 679 3HB ALA 679 -6.303 -17.059 -15.765 1270 3HB ALA 679 1HB ALA 679 -7.600 -15.858 -15.554 1271 H GLY 680 H GLY 680 -7.075 -16.709 -11.676 1272 1HA GLY 680 2HA GLY 680 -6.028 -17.686 -9.915 1273 2HA GLY 680 1HA GLY 680 -4.695 -17.757 -11.050 1274 H GLN 681 H GLN 681 -7.481 -19.568 -9.697 1275 HA GLN 681 HA GLN 681 -6.179 -21.996 -10.663 1276 1HB GLN 681 1HB GLN 681 -7.458 -21.402 -7.969 1277 2HB GLN 681 2HB GLN 681 -7.196 -23.045 -8.520 1278 1HG GLN 681 1HG GLN 681 -4.717 -22.001 -9.021 1279 2HG GLN 681 2HG GLN 681 -5.195 -20.978 -7.681 1280 1HE2 GLN 681 1HE2 GLN 681 -3.119 -22.463 -7.196 1281 2HE2 GLN 681 2HE2 GLN 681 -3.456 -23.830 -6.187 1282 H ALA 682 H ALA 682 -8.961 -20.000 -10.673 1283 HA ALA 682 HA ALA 682 -11.069 -21.759 -10.660 1284 1HB ALA 682 1HB ALA 682 -10.962 -19.501 -12.649 1285 2HB ALA 682 3HB ALA 682 -10.861 -19.131 -10.910 1286 3HB ALA 682 2HB ALA 682 -12.279 -19.990 -11.557 1287 H MET 683 H MET 683 -9.316 -20.543 -13.612 1288 HA MET 683 HA MET 683 -10.498 -22.104 -15.435 1289 1HB MET 683 1HB MET 683 -8.023 -20.606 -15.153 1290 2HB MET 683 2HB MET 683 -7.655 -22.093 -16.005 1291 1HG MET 683 1HG MET 683 -9.775 -20.035 -16.787 1292 2HG MET 683 2HG MET 683 -8.271 -20.349 -17.629 1293 1HE MET 683 2HE MET 683 -7.822 -22.138 -19.223 1294 2HE MET 683 3HE MET 683 -7.829 -23.353 -17.922 1295 3HE MET 683 1HE MET 683 -8.748 -23.645 -19.418 1296 H ALA 684 H ALA 684 -8.371 -23.146 -12.851 1297 HA ALA 684 HA ALA 684 -7.825 -25.688 -14.147 1298 1HB ALA 684 3HB ALA 684 -6.168 -25.942 -12.556 1299 2HB ALA 684 1HB ALA 684 -6.266 -24.165 -12.608 1300 3HB ALA 684 2HB ALA 684 -7.082 -25.065 -11.306 1301 H SER 685 H SER 685 -9.722 -24.246 -11.450 1302 HA SER 685 HA SER 685 -10.538 -26.522 -10.228 1303 1HB SER 685 1HB SER 685 -11.911 -23.859 -10.704 1304 2HB SER 685 2HB SER 685 -12.718 -25.122 -9.797 1305 HG SER 685 HG SER 685 -11.639 -23.991 -8.232 1306 H THR 686 H THR 686 -12.895 -24.716 -12.296 1307 HA THR 686 HA THR 686 -13.291 -26.778 -14.166 1308 HB THR 686 HB THR 686 -14.502 -27.187 -11.559 1309 HG1 THR 686 1HG THR 686 -14.984 -29.170 -12.739 1310 1HG2 THR 686 3HG2 THR 686 -16.404 -25.823 -12.701 1311 2HG2 THR 686 1HG2 THR 686 -16.493 -27.159 -13.874 1312 3HG2 THR 686 2HG2 THR 686 -16.822 -27.463 -12.151 1313 H GLU 687 H GLU 687 -15.393 -26.390 -15.441 1314 HA GLU 687 HA GLU 687 -15.474 -23.563 -15.859 1315 1HB GLU 687 1HB GLU 687 -17.017 -24.273 -17.793 1316 2HB GLU 687 2HB GLU 687 -15.361 -24.841 -17.859 1317 1HG GLU 687 1HG GLU 687 -15.943 -27.054 -17.343 1318 2HG GLU 687 2HG GLU 687 -17.384 -26.587 -16.462 1319 HE2 GLU 687 HE GLU 687 -18.483 -28.288 -18.821 1320 H GLY 688 H GLY 688 -16.842 -22.278 -14.704 1321 1HA GLY 688 2HA GLY 688 -19.618 -23.112 -14.398 1322 2HA GLY 688 1HA GLY 688 -18.939 -21.522 -14.111 1323 H ASN 689 H ASN 689 -16.686 -23.398 -12.648 1324 HA ASN 689 HA ASN 689 -17.935 -24.445 -10.437 1325 1HB ASN 689 1HB ASN 689 -15.537 -24.849 -11.123 1326 2HB ASN 689 2HB ASN 689 -15.133 -23.217 -10.628 1327 1HD2 ASN 689 1HD2 ASN 689 -16.857 -26.076 -9.378 1328 2HD2 ASN 689 2HD2 ASN 689 -16.207 -26.040 -7.773 1329 H VAL 690 H VAL 690 -16.045 -21.334 -10.765 1330 HA VAL 690 HA VAL 690 -17.112 -20.360 -8.283 1331 HB VAL 690 HB VAL 690 -15.715 -18.426 -8.736 1332 1HG1 VAL 690 3HG1 VAL 690 -14.838 -20.854 -8.047 1333 2HG1 VAL 690 1HG1 VAL 690 -13.929 -20.672 -9.566 1334 3HG1 VAL 690 2HG1 VAL 690 -13.737 -19.473 -8.264 1335 1HG2 VAL 690 1HG2 VAL 690 -15.977 -19.291 -11.473 1336 2HG2 VAL 690 2HG2 VAL 690 -15.318 -17.768 -10.829 1337 3HG2 VAL 690 3HG2 VAL 690 -14.254 -19.180 -11.040 1338 H THR 691 H THR 691 -18.859 -19.042 -7.996 1339 HA THR 691 HA THR 691 -19.921 -17.646 -10.332 1340 HB THR 691 HB THR 691 -21.176 -19.713 -10.402 1341 HG1 THR 691 1HG THR 691 -23.132 -18.634 -10.159 1342 1HG2 THR 691 2HG2 THR 691 -20.531 -20.336 -7.930 1343 2HG2 THR 691 3HG2 THR 691 -21.943 -19.351 -7.477 1344 3HG2 THR 691 1HG2 THR 691 -22.154 -20.789 -8.505 1345 H GLY 692 H GLY 692 -20.208 -18.301 -6.786 1346 1HA GLY 692 2HA GLY 692 -20.867 -16.927 -5.111 1347 2HA GLY 692 1HA GLY 692 -21.466 -15.775 -6.287 1348 H MET 693 H MET 693 -18.318 -17.133 -5.074 1349 HA MET 693 HA MET 693 -17.301 -14.806 -4.173 1350 1HB MET 693 1HB MET 693 -15.045 -15.936 -4.537 1351 2HB MET 693 2HB MET 693 -16.227 -16.981 -3.773 1352 1HG MET 693 1HG MET 693 -16.799 -17.775 -6.210 1353 2HG MET 693 2HG MET 693 -15.284 -17.021 -6.665 1354 1HE MET 693 1HE MET 693 -13.267 -17.429 -6.088 1355 2HE MET 693 2HE MET 693 -12.728 -18.264 -4.611 1356 3HE MET 693 3HE MET 693 -12.748 -19.130 -6.166 1357 H PHE 694 H PHE 694 -17.176 -16.115 -7.529 1358 HA PHE 694 HA PHE 694 -15.907 -13.605 -8.354 1359 1HB PHE 694 1HB PHE 694 -15.987 -16.494 -9.285 1360 2HB PHE 694 2HB PHE 694 -15.790 -15.272 -10.525 1361 HD1 PHE 694 1HD PHE 694 -14.062 -13.303 -9.186 1362 HD2 PHE 694 2HD PHE 694 -13.925 -17.544 -9.118 1363 HE1 PHE 694 1HE PHE 694 -11.599 -13.216 -8.710 1364 HE2 PHE 694 2HE PHE 694 -11.462 -17.457 -8.642 1365 HZ PHE 694 HZ PHE 694 -10.329 -15.294 -8.444 1366 H ALA 695 H ALA 695 -17.764 -12.269 -8.503 1367 HA ALA 695 HA ALA 695 -19.364 -12.805 -10.850 1368 1HB ALA 695 2HB ALA 695 -20.337 -13.198 -8.105 1369 2HB ALA 695 1HB ALA 695 -21.072 -13.674 -9.655 1370 3HB ALA 695 3HB ALA 695 -21.314 -12.028 -9.024 No H/Q in entry = 1370 Start of MODEL 11 1 H ALA 1 H ALA 1 -9.054 36.221 -1.927 2 HA ALA 1 HA ALA 1 -6.682 34.764 -2.226 3 1HB ALA 1 1HB ALA 1 -7.529 32.994 -0.931 4 2HB ALA 1 3HB ALA 1 -7.929 32.505 -2.595 5 3HB ALA 1 2HB ALA 1 -9.185 33.208 -1.548 6 H GLU 2 H GLU 2 -6.314 35.591 -4.234 7 HA GLU 2 HA GLU 2 -8.579 35.583 -6.060 8 1HB GLU 2 1HB GLU 2 -5.948 37.123 -6.175 9 2HB GLU 2 2HB GLU 2 -7.204 37.213 -7.394 10 1HG GLU 2 1HG GLU 2 -8.687 38.372 -5.993 11 2HG GLU 2 2HG GLU 2 -7.996 37.707 -4.526 12 HE2 GLU 2 HE GLU 2 -7.323 41.016 -6.129 13 H MET 3 H MET 3 -5.086 34.709 -5.736 14 HA MET 3 HA MET 3 -4.995 33.521 -8.292 15 1HB MET 3 1HB MET 3 -3.180 33.068 -5.859 16 2HB MET 3 2HB MET 3 -2.752 32.756 -7.530 17 1HG MET 3 1HG MET 3 -3.430 35.507 -6.378 18 2HG MET 3 2HG MET 3 -1.810 34.926 -6.709 19 1HE MET 3 2HE MET 3 -3.337 37.500 -7.688 20 2HE MET 3 3HE MET 3 -3.791 37.523 -9.409 21 3HE MET 3 1HE MET 3 -4.873 36.770 -8.213 22 H LYS 4 H LYS 4 -7.051 32.200 -7.983 23 HA LYS 4 HA LYS 4 -6.569 29.804 -6.378 24 1HB LYS 4 1HB LYS 4 -8.945 29.432 -6.495 25 2HB LYS 4 2HB LYS 4 -8.649 31.076 -5.969 26 1HG LYS 4 1HG LYS 4 -8.755 31.432 -8.702 27 2HG LYS 4 2HG LYS 4 -9.863 30.087 -8.510 28 1HD LYS 4 1HD LYS 4 -10.175 32.333 -6.548 29 2HD LYS 4 2HD LYS 4 -10.603 32.700 -8.207 30 1HE LYS 4 1HE LYS 4 -12.526 31.493 -8.069 31 2HE LYS 4 2HE LYS 4 -11.679 30.089 -7.451 32 H THR 5 H THR 5 -6.485 31.061 -9.608 33 HA THR 5 HA THR 5 -6.469 28.303 -10.651 34 HB THR 5 HB THR 5 -7.307 29.287 -12.755 35 HG1 THR 5 1HG THR 5 -7.370 31.772 -11.216 36 1HG2 THR 5 2HG2 THR 5 -8.741 29.898 -10.183 37 2HG2 THR 5 3HG2 THR 5 -9.309 30.761 -11.633 38 3HG2 THR 5 1HG2 THR 5 -9.307 28.981 -11.600 39 H ASP 6 H ASP 6 -4.547 30.926 -9.759 40 HA ASP 6 HA ASP 6 -2.827 31.414 -11.700 41 1HB ASP 6 1HB ASP 6 -2.681 31.189 -8.774 42 2HB ASP 6 2HB ASP 6 -1.134 30.816 -9.508 43 HD2 ASP 6 HD ASP 6 -0.390 32.655 -8.542 44 H ALA 7 H ALA 7 -0.899 30.381 -12.599 45 HA ALA 7 HA ALA 7 -1.082 27.610 -12.920 46 1HB ALA 7 3HB ALA 7 0.974 29.735 -13.553 47 2HB ALA 7 2HB ALA 7 -0.062 28.807 -14.664 48 3HB ALA 7 1HB ALA 7 1.318 28.016 -13.866 49 H ALA 8 H ALA 8 0.251 29.595 -10.385 50 HA ALA 8 HA ALA 8 2.306 27.898 -9.518 51 1HB ALA 8 2HB ALA 8 2.490 29.947 -8.521 52 2HB ALA 8 1HB ALA 8 1.510 29.170 -7.255 53 3HB ALA 8 3HB ALA 8 0.729 30.202 -8.476 54 H THR 9 H THR 9 -1.204 28.145 -8.671 55 HA THR 9 HA THR 9 -1.027 25.952 -6.832 56 HB THR 9 HB THR 9 -2.665 28.089 -7.038 57 HG1 THR 9 1HG THR 9 -3.215 26.863 -5.281 58 1HG2 THR 9 3HG2 THR 9 -4.135 25.793 -8.440 59 2HG2 THR 9 1HG2 THR 9 -4.911 27.264 -7.805 60 3HG2 THR 9 2HG2 THR 9 -3.761 27.378 -9.159 61 H LEU 10 H LEU 10 -2.271 26.422 -10.191 62 HA LEU 10 HA LEU 10 -3.283 23.869 -10.507 63 1HB LEU 10 1HB LEU 10 -2.146 25.878 -12.441 64 2HB LEU 10 2HB LEU 10 -2.806 24.344 -12.971 65 HG LEU 10 HG LEU 10 -4.239 26.657 -11.672 66 1HD1 LEU 10 1HD1 LEU 10 -3.880 26.517 -14.176 67 2HD1 LEU 10 2HD1 LEU 10 -4.963 25.104 -14.161 68 3HD1 LEU 10 3HD1 LEU 10 -5.565 26.693 -13.629 69 1HD2 LEU 10 3HD2 LEU 10 -5.008 23.766 -11.664 70 2HD2 LEU 10 1HD2 LEU 10 -5.259 25.024 -10.431 71 3HD2 LEU 10 2HD2 LEU 10 -6.274 24.996 -11.893 72 H ALA 11 H ALA 11 0.027 25.156 -11.249 73 HA ALA 11 HA ALA 11 1.055 22.735 -12.167 74 1HB ALA 11 2HB ALA 11 2.568 24.940 -10.721 75 2HB ALA 11 3HB ALA 11 3.189 23.818 -11.955 76 3HB ALA 11 1HB ALA 11 2.013 25.076 -12.407 77 H GLN 12 H GLN 12 0.377 23.970 -8.920 78 HA GLN 12 HA GLN 12 2.078 22.102 -7.640 79 1HB GLN 12 1HB GLN 12 0.709 24.432 -6.897 80 2HB GLN 12 2HB GLN 12 -0.129 23.174 -6.010 81 1HG GLN 12 1HG GLN 12 1.625 22.868 -4.591 82 2HG GLN 12 2HG GLN 12 2.773 22.761 -5.910 83 1HE2 GLN 12 1HE2 GLN 12 4.327 24.166 -5.706 84 2HE2 GLN 12 2HE2 GLN 12 4.201 25.812 -5.182 85 H GLU 13 H GLU 13 -1.327 22.233 -8.691 86 HA GLU 13 HA GLU 13 -1.888 19.786 -7.278 87 1HB GLU 13 1HB GLU 13 -3.717 21.366 -9.135 88 2HB GLU 13 2HB GLU 13 -4.199 20.134 -7.986 89 1HG GLU 13 1HG GLU 13 -3.995 21.544 -6.162 90 2HG GLU 13 2HG GLU 13 -2.624 22.402 -6.837 91 HE2 GLU 13 HE GLU 13 -4.588 23.765 -5.752 92 H ALA 14 H ALA 14 -2.035 21.035 -10.694 93 HA ALA 14 HA ALA 14 -2.584 18.636 -11.921 94 1HB ALA 14 2HB ALA 14 -2.752 20.574 -13.234 95 2HB ALA 14 1HB ALA 14 -1.282 19.795 -13.869 96 3HB ALA 14 3HB ALA 14 -1.147 21.166 -12.741 97 H GLY 15 H GLY 15 0.494 19.957 -10.664 98 1HA GLY 15 2HA GLY 15 2.488 18.983 -10.309 99 2HA GLY 15 1HA GLY 15 2.310 18.282 -11.905 100 H ASN 16 H ASN 16 0.338 17.749 -8.908 101 HA ASN 16 HA ASN 16 1.530 15.232 -8.453 102 1HB ASN 16 1HB ASN 16 -0.024 15.063 -6.601 103 2HB ASN 16 2HB ASN 16 0.431 16.753 -6.697 104 1HD2 ASN 16 1HD2 ASN 16 -1.172 18.086 -6.431 105 2HD2 ASN 16 2HD2 ASN 16 -2.817 17.877 -6.932 106 H PHE 17 H PHE 17 -1.291 16.541 -10.192 107 HA PHE 17 HA PHE 17 -2.759 14.153 -10.379 108 1HB PHE 17 1HB PHE 17 -3.662 16.446 -10.788 109 2HB PHE 17 2HB PHE 17 -2.512 16.700 -12.085 110 HD1 PHE 17 1HD PHE 17 -2.999 16.013 -14.292 111 HD2 PHE 17 2HD PHE 17 -5.486 14.728 -11.102 112 HE1 PHE 17 1HE PHE 17 -4.674 15.145 -15.947 113 HE2 PHE 17 2HE PHE 17 -7.161 13.860 -12.758 114 HZ PHE 17 HZ PHE 17 -6.735 14.078 -15.160 115 H GLU 18 H GLU 18 -0.513 15.820 -12.702 116 HA GLU 18 HA GLU 18 -0.676 14.237 -14.808 117 1HB GLU 18 1HB GLU 18 1.608 15.668 -13.501 118 2HB GLU 18 2HB GLU 18 2.028 14.534 -14.768 119 1HG GLU 18 1HG GLU 18 1.276 15.936 -16.390 120 2HG GLU 18 2HG GLU 18 -0.270 16.139 -15.590 121 HE2 GLU 18 HE GLU 18 2.533 18.728 -15.737 122 H ARG 19 H ARG 19 0.641 13.342 -11.641 123 HA ARG 19 HA ARG 19 1.951 11.035 -12.594 124 1HB ARG 19 1HB ARG 19 2.083 12.483 -10.275 125 2HB ARG 19 2HB ARG 19 1.046 11.179 -9.731 126 1HG ARG 19 1HG ARG 19 2.695 9.536 -10.055 127 2HG ARG 19 2HG ARG 19 3.523 10.455 -11.296 128 1HD ARG 19 1HD ARG 19 4.965 11.253 -9.737 129 2HD ARG 19 2HD ARG 19 3.635 12.044 -8.914 130 HE ARG 19 HE ARG 19 3.510 10.245 -7.375 131 2HH1 ARG 19 1HH ARG 19 5.618 7.511 -6.996 132 1HH2 ARG 19 2HH2 ARG 19 5.790 9.484 -9.977 133 2HH2 ARG 19 1HH2 ARG 19 6.457 8.110 -9.160 134 H ILE 20 H ILE 20 -1.240 11.807 -11.107 135 HA ILE 20 HA ILE 20 -2.047 9.120 -10.802 136 HB ILE 20 HB ILE 20 -3.732 11.615 -11.036 137 1HG1 ILE 20 1HG1 ILE 20 -2.780 10.394 -8.450 138 2HG1 ILE 20 2HG1 ILE 20 -1.798 11.569 -9.301 139 1HG2 ILE 20 2HG2 ILE 20 -4.539 8.975 -10.971 140 2HG2 ILE 20 3HG2 ILE 20 -4.636 9.473 -9.264 141 3HG2 ILE 20 1HG2 ILE 20 -5.519 10.388 -10.510 142 1HD1 ILE 20 2HD1 ILE 20 -4.176 12.882 -9.387 143 2HD1 ILE 20 3HD1 ILE 20 -4.415 11.938 -7.897 144 3HD1 ILE 20 1HD1 ILE 20 -3.031 13.049 -8.034 145 H SER 21 H SER 21 -2.516 11.613 -13.373 146 HA SER 21 HA SER 21 -4.210 10.076 -14.922 147 1HB SER 21 1HB SER 21 -4.139 12.339 -15.518 148 2HB SER 21 2HB SER 21 -2.392 12.427 -15.412 149 HG SER 21 HG SER 21 -2.874 12.461 -17.605 150 H GLY 22 H GLY 22 -0.618 10.616 -15.176 151 1HA GLY 22 2HA GLY 22 1.017 9.363 -16.072 152 2HA GLY 22 1HA GLY 22 -0.134 8.898 -17.309 153 H ASP 23 H ASP 23 -0.120 8.272 -13.732 154 HA ASP 23 HA ASP 23 0.738 5.658 -13.941 155 1HB ASP 23 1HB ASP 23 0.601 7.087 -11.844 156 2HB ASP 23 2HB ASP 23 -1.135 6.850 -11.843 157 HD2 ASP 23 HD ASP 23 0.171 5.650 -9.505 158 H LEU 24 H LEU 24 -2.493 7.226 -14.094 159 HA LEU 24 HA LEU 24 -4.065 4.944 -13.835 160 1HB LEU 24 1HB LEU 24 -4.373 7.730 -14.612 161 2HB LEU 24 2HB LEU 24 -5.428 6.676 -15.533 162 HG LEU 24 HG LEU 24 -5.291 6.826 -12.508 163 1HD1 LEU 24 3HD1 LEU 24 -6.257 8.840 -13.521 164 2HD1 LEU 24 1HD1 LEU 24 -7.421 7.834 -14.415 165 3HD1 LEU 24 2HD1 LEU 24 -7.478 7.894 -12.637 166 1HD2 LEU 24 2HD2 LEU 24 -6.269 4.758 -14.207 167 2HD2 LEU 24 3HD2 LEU 24 -6.359 4.887 -12.434 168 3HD2 LEU 24 1HD2 LEU 24 -7.664 5.557 -13.443 169 H LYS 25 H LYS 25 -2.827 6.618 -16.810 170 HA LYS 25 HA LYS 25 -3.880 4.730 -18.580 171 1HB LYS 25 1HB LYS 25 -3.298 6.875 -19.404 172 2HB LYS 25 2HB LYS 25 -1.664 6.773 -18.781 173 1HG LYS 25 1HG LYS 25 -1.073 5.033 -20.386 174 2HG LYS 25 2HG LYS 25 -2.742 4.847 -20.887 175 1HD LYS 25 1HD LYS 25 -1.676 6.185 -22.583 176 2HD LYS 25 2HD LYS 25 -2.699 7.276 -21.670 177 1HE LYS 25 1HE LYS 25 -0.843 8.575 -21.422 178 2HE LYS 25 2HE LYS 25 -0.312 7.396 -20.239 179 H THR 26 H THR 26 -0.827 4.897 -16.716 180 HA THR 26 HA THR 26 0.561 2.882 -18.032 181 HB THR 26 HB THR 26 0.526 4.037 -15.217 182 HG1 THR 26 1HG THR 26 1.426 5.118 -17.189 183 1HG2 THR 26 2HG2 THR 26 1.413 1.452 -15.605 184 2HG2 THR 26 3HG2 THR 26 2.859 2.378 -16.077 185 3HG2 THR 26 1HG2 THR 26 2.159 2.586 -14.454 186 H GLN 27 H GLN 27 -1.559 2.591 -15.100 187 HA GLN 27 HA GLN 27 -1.331 -0.127 -14.899 188 1HB GLN 27 1HB GLN 27 -3.723 1.634 -14.202 189 2HB GLN 27 2HB GLN 27 -3.478 0.003 -13.611 190 1HG GLN 27 1HG GLN 27 -1.943 2.517 -12.935 191 2HG GLN 27 2HG GLN 27 -2.603 1.306 -11.853 192 1HE2 GLN 27 1HE2 GLN 27 -0.033 2.118 -14.073 193 2HE2 GLN 27 2HE2 GLN 27 1.113 0.916 -13.580 194 H ILE 28 H ILE 28 -3.738 1.858 -16.738 195 HA ILE 28 HA ILE 28 -5.353 -0.185 -17.613 196 HB ILE 28 HB ILE 28 -4.731 2.570 -18.393 197 1HG1 ILE 28 1HG1 ILE 28 -7.394 1.161 -18.498 198 2HG1 ILE 28 2HG1 ILE 28 -6.665 1.597 -16.965 199 1HG2 ILE 28 2HG2 ILE 28 -5.761 0.606 -20.451 200 2HG2 ILE 28 3HG2 ILE 28 -6.000 2.367 -20.556 201 3HG2 ILE 28 1HG2 ILE 28 -4.354 1.690 -20.570 202 1HD1 ILE 28 3HD1 ILE 28 -6.360 3.978 -18.073 203 2HD1 ILE 28 1HD1 ILE 28 -7.622 3.407 -19.191 204 3HD1 ILE 28 2HD1 ILE 28 -7.955 3.500 -17.445 205 H ASP 29 H ASP 29 -2.242 1.035 -18.978 206 HA ASP 29 HA ASP 29 -2.298 -0.545 -21.237 207 1HB ASP 29 1HB ASP 29 -0.506 1.258 -19.951 208 2HB ASP 29 2HB ASP 29 0.406 -0.222 -20.167 209 HD2 ASP 29 HD ASP 29 -1.677 1.823 -22.277 210 H GLN 30 H GLN 30 -1.018 -1.054 -17.891 211 HA GLN 30 HA GLN 30 0.330 -3.393 -18.326 212 1HB GLN 30 1HB GLN 30 -1.219 -2.538 -15.841 213 2HB GLN 30 2HB GLN 30 0.006 -3.791 -15.878 214 1HG GLN 30 1HG GLN 30 0.324 -0.813 -16.062 215 2HG GLN 30 2HG GLN 30 1.324 -1.988 -15.230 216 1HE2 GLN 30 1HE2 GLN 30 1.390 0.175 -17.584 217 2HE2 GLN 30 2HE2 GLN 30 2.519 -0.516 -18.702 218 H VAL 31 H VAL 31 -3.134 -2.886 -17.370 219 HA VAL 31 HA VAL 31 -3.773 -5.605 -17.248 220 HB VAL 31 HB VAL 31 -5.332 -3.059 -17.610 221 1HG1 VAL 31 3HG1 VAL 31 -6.386 -5.897 -17.632 222 2HG1 VAL 31 1HG1 VAL 31 -7.389 -4.504 -17.160 223 3HG1 VAL 31 2HG1 VAL 31 -6.697 -4.588 -18.798 224 1HG2 VAL 31 3HG2 VAL 31 -4.217 -4.303 -15.393 225 2HG2 VAL 31 1HG2 VAL 31 -5.492 -3.062 -15.374 226 3HG2 VAL 31 2HG2 VAL 31 -5.928 -4.787 -15.325 227 H GLU 32 H GLU 32 -4.340 -3.157 -19.877 228 HA GLU 32 HA GLU 32 -5.464 -4.798 -21.688 229 1HB GLU 32 1HB GLU 32 -3.770 -2.336 -21.842 230 2HB GLU 32 2HB GLU 32 -3.972 -3.223 -23.339 231 1HG GLU 32 1HG GLU 32 -6.527 -3.235 -22.756 232 2HG GLU 32 2HG GLU 32 -6.130 -1.988 -21.589 233 HE2 GLU 32 HE GLU 32 -6.707 0.269 -23.667 234 H SER 33 H SER 33 -1.971 -4.435 -20.905 235 HA SER 33 HA SER 33 -1.174 -6.133 -23.020 236 1HB SER 33 1HB SER 33 0.079 -4.457 -21.018 237 2HB SER 33 2HB SER 33 0.837 -6.036 -20.979 238 HG SER 33 HG SER 33 1.670 -5.747 -22.962 239 H THR 34 H THR 34 -1.305 -6.455 -19.396 240 HA THR 34 HA THR 34 -0.520 -9.101 -19.242 241 HB THR 34 HB THR 34 -2.029 -7.110 -17.577 242 HG1 THR 34 1HG THR 34 -0.012 -7.328 -16.694 243 1HG2 THR 34 2HG2 THR 34 -3.299 -9.377 -17.369 244 2HG2 THR 34 3HG2 THR 34 -1.781 -10.024 -16.702 245 3HG2 THR 34 1HG2 THR 34 -2.626 -8.699 -15.867 246 H ALA 35 H ALA 35 -3.777 -7.716 -19.882 247 HA ALA 35 HA ALA 35 -5.212 -10.069 -19.675 248 1HB ALA 35 2HB ALA 35 -6.935 -8.861 -20.690 249 2HB ALA 35 3HB ALA 35 -5.907 -7.561 -20.041 250 3HB ALA 35 1HB ALA 35 -5.824 -7.983 -21.768 251 H GLY 36 H GLY 36 -2.747 -9.139 -21.934 252 1HA GLY 36 2HA GLY 36 -1.826 -10.260 -23.656 253 2HA GLY 36 1HA GLY 36 -3.455 -10.312 -24.301 254 H SER 37 H SER 37 -1.612 -11.945 -21.614 255 HA SER 37 HA SER 37 -1.692 -14.430 -22.793 256 1HB SER 37 1HB SER 37 -1.701 -14.101 -19.785 257 2HB SER 37 2HB SER 37 -0.797 -15.244 -20.760 258 HG SER 37 HG SER 37 -0.244 -12.512 -20.184 259 H LEU 38 H LEU 38 -4.028 -12.685 -20.734 260 HA LEU 38 HA LEU 38 -5.600 -14.877 -20.004 261 1HB LEU 38 1HB LEU 38 -6.015 -11.917 -20.192 262 2HB LEU 38 2HB LEU 38 -7.382 -12.966 -19.872 263 HG LEU 38 HG LEU 38 -6.802 -12.510 -17.731 264 1HD1 LEU 38 3HD1 LEU 38 -6.417 -14.991 -18.224 265 2HD1 LEU 38 1HD1 LEU 38 -4.680 -14.623 -18.098 266 3HD1 LEU 38 2HD1 LEU 38 -5.752 -14.340 -16.706 267 1HD2 LEU 38 2HD2 LEU 38 -4.212 -11.777 -18.920 268 2HD2 LEU 38 3HD2 LEU 38 -5.145 -11.006 -17.614 269 3HD2 LEU 38 1HD2 LEU 38 -4.113 -12.413 -17.260 270 H GLN 39 H GLN 39 -6.486 -12.334 -22.443 271 HA GLN 39 HA GLN 39 -8.472 -13.786 -23.595 272 1HB GLN 39 1HB GLN 39 -7.963 -12.302 -25.658 273 2HB GLN 39 2HB GLN 39 -8.357 -11.493 -24.155 274 1HG GLN 39 1HG GLN 39 -5.534 -11.923 -24.095 275 2HG GLN 39 2HG GLN 39 -5.898 -11.359 -25.714 276 1HE2 GLN 39 1HE2 GLN 39 -7.506 -10.682 -22.620 277 2HE2 GLN 39 2HE2 GLN 39 -7.270 -8.966 -22.615 278 H GLY 40 H GLY 40 -5.023 -14.262 -23.787 279 1HA GLY 40 2HA GLY 40 -3.730 -15.407 -25.312 280 2HA GLY 40 1HA GLY 40 -5.146 -15.762 -26.281 281 H GLN 41 H GLN 41 -6.096 -16.369 -23.127 282 HA GLN 41 HA GLN 41 -5.726 -19.188 -23.555 283 1HB GLN 41 1HB GLN 41 -4.226 -19.580 -21.907 284 2HB GLN 41 2HB GLN 41 -3.915 -17.855 -21.905 285 1HG GLN 41 1HG GLN 41 -4.432 -18.552 -19.622 286 2HG GLN 41 2HG GLN 41 -5.740 -17.542 -20.205 287 1HE2 GLN 41 1HE2 GLN 41 -7.371 -18.319 -19.013 288 2HE2 GLN 41 2HE2 GLN 41 -7.997 -19.932 -19.093 289 H TRP 42 H TRP 42 -7.770 -19.987 -23.372 290 HA TRP 42 HA TRP 42 -9.281 -19.541 -21.016 291 1HB TRP 42 1HB TRP 42 -10.202 -18.159 -23.539 292 2HB TRP 42 2HB TRP 42 -11.252 -18.514 -22.182 293 HD1 TRP 42 HD TRP 42 -9.373 -15.694 -23.440 294 HE1 TRP 42 1HE TRP 42 -8.751 -13.876 -21.632 295 HE3 TRP 42 3HE TRP 42 -10.291 -18.641 -19.400 296 HZ2 TRP 42 2HZ TRP 42 -8.713 -13.875 -18.778 297 HZ3 TRP 42 3HZ TRP 42 -9.937 -17.654 -17.138 298 HH2 TRP 42 HH TRP 42 -9.176 -15.358 -16.791 299 H ARG 43 H ARG 43 -11.616 -20.607 -21.483 300 HA ARG 43 HA ARG 43 -11.814 -22.328 -23.643 301 1HB ARG 43 1HB ARG 43 -10.241 -23.331 -21.361 302 2HB ARG 43 2HB ARG 43 -11.635 -24.348 -21.667 303 1HG ARG 43 1HG ARG 43 -9.998 -23.477 -24.044 304 2HG ARG 43 2HG ARG 43 -9.305 -24.687 -22.983 305 1HD ARG 43 1HD ARG 43 -11.648 -25.888 -23.211 306 2HD ARG 43 2HD ARG 43 -11.864 -24.855 -24.610 307 HE ARG 43 HE ARG 43 -9.292 -26.284 -24.556 308 2HH1 ARG 43 1HH ARG 43 -10.140 -28.370 -27.200 309 1HH2 ARG 43 2HH2 ARG 43 -12.666 -26.376 -25.634 310 2HH2 ARG 43 1HH2 ARG 43 -12.365 -27.538 -26.883 311 H GLY 44 H GLY 44 -12.396 -22.529 -20.045 312 1HA GLY 44 2HA GLY 44 -14.289 -22.773 -18.855 313 2HA GLY 44 1HA GLY 44 -15.049 -23.455 -20.280 314 H ALA 45 H ALA 45 -15.076 -21.425 -22.144 315 HA ALA 45 HA ALA 45 -16.174 -19.608 -22.763 316 1HB ALA 45 1HB ALA 45 -17.691 -20.611 -20.408 317 2HB ALA 45 2HB ALA 45 -18.030 -18.931 -20.887 318 3HB ALA 45 3HB ALA 45 -18.247 -20.252 -22.060 319 H ALA 46 H ALA 46 -14.203 -19.745 -20.019 320 HA ALA 46 HA ALA 46 -14.470 -17.243 -18.876 321 1HB ALA 46 1HB ALA 46 -11.989 -17.616 -18.331 322 2HB ALA 46 2HB ALA 46 -13.119 -18.889 -17.811 323 3HB ALA 46 3HB ALA 46 -12.122 -19.125 -19.266 324 H GLY 47 H GLY 47 -13.371 -18.189 -22.055 325 1HA GLY 47 2HA GLY 47 -12.371 -17.060 -23.735 326 2HA GLY 47 1HA GLY 47 -11.674 -15.957 -22.565 327 H THR 48 H THR 48 -14.921 -16.799 -23.975 328 HA THR 48 HA THR 48 -15.412 -14.323 -25.078 329 HB THR 48 HB THR 48 -17.812 -15.144 -25.020 330 HG1 THR 48 1HG THR 48 -16.668 -17.470 -23.720 331 1HG2 THR 48 2HG2 THR 48 -16.157 -16.129 -26.703 332 2HG2 THR 48 3HG2 THR 48 -15.844 -17.433 -25.532 333 3HG2 THR 48 1HG2 THR 48 -17.467 -17.240 -26.237 334 H ALA 49 H ALA 49 -15.598 -15.340 -21.703 335 HA ALA 49 HA ALA 49 -17.227 -13.135 -20.909 336 1HB ALA 49 3HB ALA 49 -15.574 -15.244 -19.494 337 2HB ALA 49 1HB ALA 49 -16.365 -13.923 -18.601 338 3HB ALA 49 2HB ALA 49 -17.345 -15.067 -19.549 339 H ALA 50 H ALA 50 -13.704 -13.979 -20.627 340 HA ALA 50 HA ALA 50 -13.064 -11.410 -19.578 341 1HB ALA 50 3HB ALA 50 -10.998 -12.334 -19.247 342 2HB ALA 50 1HB ALA 50 -11.887 -13.852 -19.517 343 3HB ALA 50 2HB ALA 50 -10.969 -13.110 -20.849 344 H GLN 51 H GLN 51 -12.364 -13.077 -22.738 345 HA GLN 51 HA GLN 51 -11.137 -11.137 -24.046 346 1HB GLN 51 1HB GLN 51 -11.504 -13.164 -25.208 347 2HB GLN 51 2HB GLN 51 -13.239 -13.112 -24.961 348 1HG GLN 51 1HG GLN 51 -12.082 -10.813 -26.491 349 2HG GLN 51 2HG GLN 51 -12.012 -12.368 -27.296 350 1HE2 GLN 51 1HE2 GLN 51 -13.904 -9.700 -26.480 351 2HE2 GLN 51 2HE2 GLN 51 -15.458 -10.261 -27.001 352 H ALA 52 H ALA 52 -14.745 -11.408 -23.733 353 HA ALA 52 HA ALA 52 -15.302 -9.065 -25.160 354 1HB ALA 52 2HB ALA 52 -16.982 -10.770 -24.790 355 2HB ALA 52 1HB ALA 52 -17.525 -9.274 -23.993 356 3HB ALA 52 3HB ALA 52 -16.835 -10.598 -23.024 357 H ALA 53 H ALA 53 -14.881 -9.732 -21.623 358 HA ALA 53 HA ALA 53 -15.431 -7.140 -20.768 359 1HB ALA 53 3HB ALA 53 -13.507 -9.126 -19.504 360 2HB ALA 53 2HB ALA 53 -15.278 -9.270 -19.398 361 3HB ALA 53 1HB ALA 53 -14.455 -7.860 -18.688 362 H VAL 54 H VAL 54 -12.603 -8.593 -22.320 363 HA VAL 54 HA VAL 54 -10.801 -6.535 -21.521 364 HB VAL 54 HB VAL 54 -10.659 -8.583 -23.742 365 1HG1 VAL 54 3HG1 VAL 54 -9.106 -6.496 -23.782 366 2HG1 VAL 54 1HG1 VAL 54 -8.289 -7.282 -22.410 367 3HG1 VAL 54 2HG1 VAL 54 -8.387 -8.112 -23.981 368 1HG2 VAL 54 3HG2 VAL 54 -10.813 -9.106 -21.060 369 2HG2 VAL 54 1HG2 VAL 54 -9.996 -10.142 -22.255 370 3HG2 VAL 54 2HG2 VAL 54 -9.053 -8.974 -21.297 371 H VAL 55 H VAL 55 -12.953 -7.193 -24.319 372 HA VAL 55 HA VAL 55 -11.954 -5.102 -25.917 373 HB VAL 55 HB VAL 55 -14.440 -6.781 -25.844 374 1HG1 VAL 55 1HG1 VAL 55 -14.173 -4.156 -27.109 375 2HG1 VAL 55 2HG1 VAL 55 -14.559 -5.445 -28.274 376 3HG1 VAL 55 3HG1 VAL 55 -15.615 -5.170 -26.868 377 1HG2 VAL 55 1HG2 VAL 55 -11.914 -7.150 -26.911 378 2HG2 VAL 55 2HG2 VAL 55 -13.386 -8.034 -27.378 379 3HG2 VAL 55 3HG2 VAL 55 -12.868 -6.612 -28.314 380 H ARG 56 H ARG 56 -14.853 -5.357 -23.742 381 HA ARG 56 HA ARG 56 -15.748 -2.818 -24.138 382 1HB ARG 56 1HB ARG 56 -16.986 -4.589 -22.891 383 2HB ARG 56 2HB ARG 56 -15.833 -4.490 -21.575 384 1HG ARG 56 1HG ARG 56 -16.856 -2.662 -20.683 385 2HG ARG 56 2HG ARG 56 -16.899 -1.836 -22.228 386 1HD ARG 56 1HD ARG 56 -18.818 -4.128 -21.796 387 2HD ARG 56 2HD ARG 56 -19.157 -2.608 -20.992 388 HE ARG 56 HE ARG 56 -18.515 -2.330 -23.848 389 2HH1 ARG 56 1HH ARG 56 -21.766 -1.485 -24.733 390 1HH2 ARG 56 2HH2 ARG 56 -21.101 -2.798 -21.471 391 2HH2 ARG 56 1HH2 ARG 56 -22.344 -2.210 -22.524 392 H PHE 57 H PHE 57 -13.440 -4.078 -21.632 393 HA PHE 57 HA PHE 57 -13.047 -1.633 -20.348 394 1HB PHE 57 1HB PHE 57 -12.243 -3.518 -19.168 395 2HB PHE 57 2HB PHE 57 -11.750 -4.340 -20.635 396 HD1 PHE 57 1HD PHE 57 -10.778 -1.670 -18.262 397 HD2 PHE 57 2HD PHE 57 -9.510 -4.260 -21.376 398 HE1 PHE 57 1HE PHE 57 -8.389 -1.044 -17.810 399 HE2 PHE 57 2HE PHE 57 -7.121 -3.634 -20.924 400 HZ PHE 57 HZ PHE 57 -6.590 -2.034 -19.147 401 H GLN 58 H GLN 58 -11.317 -3.239 -23.085 402 HA GLN 58 HA GLN 58 -9.224 -1.468 -23.228 403 1HB GLN 58 1HB GLN 58 -10.609 -3.236 -25.261 404 2HB GLN 58 2HB GLN 58 -9.297 -2.188 -25.762 405 1HG GLN 58 1HG GLN 58 -8.636 -3.652 -23.293 406 2HG GLN 58 2HG GLN 58 -9.047 -4.743 -24.601 407 1HE2 GLN 58 1HE2 GLN 58 -6.752 -5.305 -24.268 408 2HE2 GLN 58 2HE2 GLN 58 -5.540 -4.447 -25.160 409 H GLU 59 H GLU 59 -12.295 -1.479 -25.188 410 HA GLU 59 HA GLU 59 -11.804 0.876 -26.490 411 1HB GLU 59 1HB GLU 59 -14.403 -0.479 -25.677 412 2HB GLU 59 2HB GLU 59 -14.381 0.961 -26.675 413 1HG GLU 59 1HG GLU 59 -12.519 -1.196 -27.560 414 2HG GLU 59 2HG GLU 59 -14.218 -1.615 -27.650 415 HE2 GLU 59 HE GLU 59 -13.995 -1.465 -29.978 416 H ALA 60 H ALA 60 -12.964 0.259 -23.188 417 HA ALA 60 HA ALA 60 -13.873 2.943 -22.781 418 1HB ALA 60 2HB ALA 60 -13.518 0.450 -21.124 419 2HB ALA 60 1HB ALA 60 -14.994 1.388 -21.455 420 3HB ALA 60 3HB ALA 60 -13.778 2.014 -20.316 421 H ALA 61 H ALA 61 -10.846 1.127 -22.525 422 HA ALA 61 HA ALA 61 -9.500 2.703 -20.691 423 1HB ALA 61 3HB ALA 61 -8.897 0.462 -21.922 424 2HB ALA 61 1HB ALA 61 -8.153 1.538 -23.129 425 3HB ALA 61 2HB ALA 61 -7.594 1.574 -21.439 426 H ASN 62 H ASN 62 -9.555 2.960 -24.320 427 HA ASN 62 HA ASN 62 -8.004 5.157 -24.543 428 1HB ASN 62 1HB ASN 62 -10.526 4.909 -26.222 429 2HB ASN 62 2HB ASN 62 -8.924 5.400 -26.736 430 1HD2 ASN 62 1HD2 ASN 62 -10.879 2.694 -25.610 431 2HD2 ASN 62 2HD2 ASN 62 -9.959 1.419 -26.336 432 H LYS 63 H LYS 63 -11.624 4.968 -24.169 433 HA LYS 63 HA LYS 63 -12.201 7.642 -24.235 434 1HB LYS 63 1HB LYS 63 -13.499 5.411 -22.645 435 2HB LYS 63 2HB LYS 63 -14.195 7.006 -22.847 436 1HG LYS 63 1HG LYS 63 -13.315 5.800 -25.406 437 2HG LYS 63 2HG LYS 63 -14.538 4.848 -24.588 438 1HD LYS 63 1HD LYS 63 -14.741 7.803 -25.330 439 2HD LYS 63 2HD LYS 63 -15.621 6.482 -26.073 440 1HE LYS 63 1HE LYS 63 -16.435 6.028 -23.562 441 2HE LYS 63 2HE LYS 63 -15.998 7.710 -23.335 442 H GLN 64 H GLN 64 -10.846 5.662 -21.575 443 HA GLN 64 HA GLN 64 -11.122 7.751 -19.689 444 1HB GLN 64 1HB GLN 64 -10.386 4.976 -19.689 445 2HB GLN 64 2HB GLN 64 -9.075 5.857 -18.930 446 1HG GLN 64 1HG GLN 64 -11.836 6.673 -18.104 447 2HG GLN 64 2HG GLN 64 -11.335 5.070 -17.604 448 1HE2 GLN 64 1HE2 GLN 64 -9.692 4.787 -16.152 449 2HE2 GLN 64 2HE2 GLN 64 -8.997 6.066 -15.213 450 H LYS 65 H LYS 65 -8.593 6.603 -21.945 451 HA LYS 65 HA LYS 65 -6.530 8.196 -20.827 452 1HB LYS 65 1HB LYS 65 -6.903 6.407 -23.157 453 2HB LYS 65 2HB LYS 65 -5.724 7.683 -23.382 454 1HG LYS 65 1HG LYS 65 -4.280 6.284 -22.300 455 2HG LYS 65 2HG LYS 65 -5.077 6.827 -20.837 456 1HD LYS 65 1HD LYS 65 -5.334 4.532 -20.576 457 2HD LYS 65 2HD LYS 65 -6.820 4.889 -21.434 458 1HE LYS 65 1HE LYS 65 -5.206 4.509 -23.583 459 2HE LYS 65 2HE LYS 65 -4.332 3.521 -22.429 460 H GLN 66 H GLN 66 -9.119 8.680 -23.223 461 HA GLN 66 HA GLN 66 -8.012 11.003 -24.324 462 1HB GLN 66 1HB GLN 66 -10.196 9.349 -24.856 463 2HB GLN 66 2HB GLN 66 -10.961 10.842 -24.350 464 1HG GLN 66 1HG GLN 66 -10.573 10.856 -26.792 465 2HG GLN 66 2HG GLN 66 -9.637 12.119 -26.017 466 1HE2 GLN 66 1HE2 GLN 66 -7.653 12.312 -26.687 467 2HE2 GLN 66 2HE2 GLN 66 -6.620 11.067 -27.306 468 H GLU 67 H GLU 67 -10.625 10.459 -21.855 469 HA GLU 67 HA GLU 67 -10.898 13.202 -21.341 470 1HB GLU 67 1HB GLU 67 -11.962 10.649 -20.251 471 2HB GLU 67 2HB GLU 67 -11.899 11.958 -19.088 472 1HG GLU 67 1HG GLU 67 -14.048 11.728 -20.548 473 2HG GLU 67 2HG GLU 67 -13.367 13.329 -20.340 474 HE2 GLU 67 HE GLU 67 -14.351 13.824 -22.296 475 H LEU 68 H LEU 68 -8.754 10.649 -20.157 476 HA LEU 68 HA LEU 68 -7.986 12.048 -17.792 477 1HB LEU 68 1HB LEU 68 -7.910 9.641 -17.901 478 2HB LEU 68 2HB LEU 68 -6.811 9.689 -19.265 479 HG LEU 68 HG LEU 68 -5.301 11.053 -17.533 480 1HD1 LEU 68 3HD1 LEU 68 -7.453 10.115 -15.897 481 2HD1 LEU 68 1HD1 LEU 68 -5.955 9.283 -15.416 482 3HD1 LEU 68 2HD1 LEU 68 -6.018 11.062 -15.437 483 1HD2 LEU 68 1HD2 LEU 68 -5.317 8.489 -18.627 484 2HD2 LEU 68 2HD2 LEU 68 -3.963 9.298 -17.802 485 3HD2 LEU 68 3HD2 LEU 68 -5.056 8.233 -16.885 486 H ASP 69 H ASP 69 -6.816 11.767 -21.171 487 HA ASP 69 HA ASP 69 -4.440 13.186 -20.617 488 1HB ASP 69 1HB ASP 69 -4.791 11.579 -22.544 489 2HB ASP 69 2HB ASP 69 -5.877 12.743 -23.276 490 HD2 ASP 69 HD ASP 69 -2.415 12.069 -23.083 491 H GLU 70 H GLU 70 -7.623 13.901 -22.227 492 HA GLU 70 HA GLU 70 -7.130 16.466 -22.975 493 1HB GLU 70 1HB GLU 70 -9.437 16.641 -23.333 494 2HB GLU 70 2HB GLU 70 -9.205 14.904 -23.340 495 1HG GLU 70 1HG GLU 70 -9.851 14.811 -20.921 496 2HG GLU 70 2HG GLU 70 -10.090 16.547 -20.919 497 HE2 GLU 70 HE GLU 70 -12.709 15.699 -23.534 498 H ILE 71 H ILE 71 -8.337 15.222 -19.800 499 HA ILE 71 HA ILE 71 -8.699 17.760 -18.655 500 HB ILE 71 HB ILE 71 -8.480 14.953 -17.654 501 1HG1 ILE 71 1HG1 ILE 71 -10.669 17.000 -17.251 502 2HG1 ILE 71 2HG1 ILE 71 -10.571 15.999 -18.687 503 1HG2 ILE 71 3HG2 ILE 71 -8.104 17.434 -16.040 504 2HG2 ILE 71 1HG2 ILE 71 -9.113 16.133 -15.363 505 3HG2 ILE 71 2HG2 ILE 71 -7.425 15.803 -15.821 506 1HD1 ILE 71 1HD1 ILE 71 -10.508 14.791 -15.894 507 2HD1 ILE 71 2HD1 ILE 71 -12.032 15.110 -16.757 508 3HD1 ILE 71 3HD1 ILE 71 -10.845 13.972 -17.438 509 H SER 72 H SER 72 -5.955 15.398 -18.579 510 HA SER 72 HA SER 72 -4.367 16.892 -16.896 511 1HB SER 72 1HB SER 72 -2.685 15.352 -17.401 512 2HB SER 72 2HB SER 72 -4.120 14.448 -17.840 513 HG SER 72 HG SER 72 -3.635 15.625 -20.075 514 H THR 73 H THR 73 -5.210 17.294 -20.288 515 HA THR 73 HA THR 73 -2.977 19.118 -20.744 516 HB THR 73 HB THR 73 -5.112 17.769 -22.450 517 HG1 THR 73 1HG THR 73 -2.191 18.022 -22.296 518 1HG2 THR 73 2HG2 THR 73 -3.888 20.356 -22.958 519 2HG2 THR 73 3HG2 THR 73 -3.176 19.153 -24.060 520 3HG2 THR 73 1HG2 THR 73 -4.938 19.404 -24.035 521 H ASN 74 H ASN 74 -6.411 19.099 -19.950 522 HA ASN 74 HA ASN 74 -7.201 21.490 -20.904 523 1HB ASN 74 1HB ASN 74 -7.980 19.683 -18.735 524 2HB ASN 74 2HB ASN 74 -8.220 21.344 -18.231 525 1HD2 ASN 74 1HD2 ASN 74 -9.347 18.753 -20.107 526 2HD2 ASN 74 2HD2 ASN 74 -10.670 19.528 -20.912 527 H ILE 75 H ILE 75 -5.692 20.793 -17.654 528 HA ILE 75 HA ILE 75 -5.506 23.451 -16.845 529 HB ILE 75 HB ILE 75 -3.640 21.233 -16.028 530 1HG1 ILE 75 1HG1 ILE 75 -5.820 21.275 -14.256 531 2HG1 ILE 75 2HG1 ILE 75 -6.538 21.290 -15.855 532 1HG2 ILE 75 1HG2 ILE 75 -3.861 23.884 -15.220 533 2HG2 ILE 75 2HG2 ILE 75 -4.724 22.970 -13.960 534 3HG2 ILE 75 3HG2 ILE 75 -3.035 22.567 -14.353 535 1HD1 ILE 75 2HD1 ILE 75 -4.951 19.365 -16.468 536 2HD1 ILE 75 3HD1 ILE 75 -4.553 19.269 -14.736 537 3HD1 ILE 75 1HD1 ILE 75 -6.221 18.975 -15.283 538 H ARG 76 H ARG 76 -3.175 21.305 -18.589 539 HA ARG 76 HA ARG 76 -1.037 22.935 -18.597 540 1HB ARG 76 1HB ARG 76 -1.952 20.648 -20.078 541 2HB ARG 76 2HB ARG 76 -1.338 21.790 -21.257 542 1HG ARG 76 1HG ARG 76 0.831 21.528 -20.570 543 2HG ARG 76 2HG ARG 76 0.401 21.560 -18.872 544 1HD ARG 76 1HD ARG 76 0.705 19.311 -18.799 545 2HD ARG 76 2HD ARG 76 -0.681 19.121 -19.855 546 HE ARG 76 HE ARG 76 1.367 19.759 -21.611 547 2HH1 ARG 76 1HH ARG 76 3.015 16.727 -22.001 548 1HH2 ARG 76 2HH2 ARG 76 0.969 17.275 -19.116 549 2HH2 ARG 76 1HH2 ARG 76 1.995 16.131 -19.916 550 H GLN 77 H GLN 77 -3.963 23.059 -20.695 551 HA GLN 77 HA GLN 77 -2.881 25.175 -22.263 552 1HB GLN 77 1HB GLN 77 -5.737 24.113 -22.123 553 2HB GLN 77 2HB GLN 77 -5.093 25.157 -23.374 554 1HG GLN 77 1HG GLN 77 -3.333 22.871 -23.097 555 2HG GLN 77 2HG GLN 77 -4.980 22.287 -23.230 556 1HE2 GLN 77 1HE2 GLN 77 -6.306 23.090 -24.989 557 2HE2 GLN 77 2HE2 GLN 77 -5.584 23.476 -26.515 558 H ALA 78 H ALA 78 -4.381 24.894 -19.183 559 HA ALA 78 HA ALA 78 -5.935 27.224 -19.143 560 1HB ALA 78 1HB ALA 78 -4.441 26.005 -16.798 561 2HB ALA 78 2HB ALA 78 -5.995 26.875 -16.785 562 3HB ALA 78 3HB ALA 78 -5.889 25.252 -17.507 563 H GLY 79 H GLY 79 -2.471 26.646 -19.122 564 1HA GLY 79 2HA GLY 79 -2.048 29.527 -18.598 565 2HA GLY 79 1HA GLY 79 -1.134 28.572 -19.749 566 H VAL 80 H VAL 80 -1.392 26.230 -17.624 567 HA VAL 80 HA VAL 80 0.626 27.260 -15.764 568 HB VAL 80 HB VAL 80 -1.169 26.443 -14.541 569 1HG1 VAL 80 2HG1 VAL 80 -1.469 24.540 -16.792 570 2HG1 VAL 80 3HG1 VAL 80 -1.881 23.898 -15.183 571 3HG1 VAL 80 1HG1 VAL 80 -2.703 25.352 -15.798 572 1HG2 VAL 80 1HG2 VAL 80 1.266 24.967 -14.550 573 2HG2 VAL 80 2HG2 VAL 80 0.131 25.223 -13.203 574 3HG2 VAL 80 3HG2 VAL 80 -0.061 23.813 -14.273 575 H GLN 81 H GLN 81 2.484 27.113 -17.072 576 HA GLN 81 HA GLN 81 3.265 24.363 -17.563 577 1HB GLN 81 1HB GLN 81 2.401 25.681 -19.682 578 2HB GLN 81 2HB GLN 81 3.950 26.496 -19.600 579 1HG GLN 81 1HG GLN 81 5.139 24.615 -20.219 580 2HG GLN 81 2HG GLN 81 4.081 23.524 -19.346 581 1HE2 GLN 81 1HE2 GLN 81 3.148 22.144 -20.631 582 2HE2 GLN 81 2HE2 GLN 81 2.495 22.442 -22.208 583 H TYR 82 H TYR 82 3.787 26.946 -15.749 584 HA TYR 82 HA TYR 82 6.629 26.432 -15.566 585 1HB TYR 82 1HB TYR 82 7.176 28.809 -15.886 586 2HB TYR 82 2HB TYR 82 6.168 28.355 -17.246 587 HD1 TYR 82 1HD TYR 82 6.711 30.857 -14.918 588 HD2 TYR 82 2HD TYR 82 3.500 28.636 -16.668 589 HE1 TYR 82 1HE TYR 82 5.094 32.736 -14.354 590 HE2 TYR 82 2HE TYR 82 1.894 30.523 -16.098 591 HH TYR 82 HH TYR 82 2.983 33.312 -14.221 592 H SER 83 H SER 83 6.954 26.033 -13.440 593 HA SER 83 HA SER 83 5.402 27.667 -11.588 594 1HB SER 83 1HB SER 83 5.620 25.633 -10.013 595 2HB SER 83 2HB SER 83 4.486 25.494 -11.341 596 HG SER 83 HG SER 83 6.989 24.196 -10.949 597 H ARG 84 H ARG 84 8.438 25.849 -12.275 598 HA ARG 84 HA ARG 84 9.705 26.847 -9.952 599 1HB ARG 84 1HB ARG 84 10.661 25.337 -12.420 600 2HB ARG 84 2HB ARG 84 11.801 25.897 -11.212 601 1HG ARG 84 1HG ARG 84 10.890 24.503 -9.512 602 2HG ARG 84 2HG ARG 84 9.369 24.298 -10.358 603 1HD ARG 84 1HD ARG 84 10.146 22.461 -11.451 604 2HD ARG 84 2HD ARG 84 11.543 23.336 -12.043 605 HE ARG 84 HE ARG 84 11.692 22.525 -9.209 606 2HH1 ARG 84 1HH ARG 84 14.258 20.257 -9.789 607 1HH2 ARG 84 2HH2 ARG 84 12.513 21.707 -12.557 608 2HH2 ARG 84 1HH2 ARG 84 13.777 20.611 -12.110 609 H ALA 85 H ALA 85 10.653 27.167 -13.457 610 HA ALA 85 HA ALA 85 11.334 29.970 -12.876 611 1HB ALA 85 3HB ALA 85 13.119 29.602 -14.673 612 2HB ALA 85 2HB ALA 85 12.791 27.861 -14.505 613 3HB ALA 85 1HB ALA 85 13.397 28.791 -13.113 614 H ASP 86 H ASP 86 11.339 28.070 -15.941 615 HA ASP 86 HA ASP 86 9.006 29.592 -16.753 616 1HB ASP 86 1HB ASP 86 11.750 29.745 -17.851 617 2HB ASP 86 2HB ASP 86 10.554 29.389 -19.082 618 HD2 ASP 86 HD ASP 86 9.604 32.739 -17.178 619 H GLU 87 H GLU 87 11.365 27.563 -18.615 620 HA GLU 87 HA GLU 87 9.178 25.747 -19.181 621 1HB GLU 87 1HB GLU 87 10.492 25.020 -21.099 622 2HB GLU 87 2HB GLU 87 10.438 26.772 -21.086 623 1HG GLU 87 1HG GLU 87 12.688 26.799 -19.937 624 2HG GLU 87 2HG GLU 87 12.743 25.051 -20.055 625 HE2 GLU 87 HE GLU 87 13.270 27.819 -22.538 626 H GLU 88 H GLU 88 11.196 25.999 -16.720 627 HA GLU 88 HA GLU 88 12.905 23.963 -16.588 628 1HB GLU 88 1HB GLU 88 11.794 25.705 -14.775 629 2HB GLU 88 2HB GLU 88 11.147 24.185 -14.191 630 1HG GLU 88 1HG GLU 88 13.183 24.234 -13.051 631 2HG GLU 88 2HG GLU 88 13.646 23.326 -14.477 632 HE2 GLU 88 HE GLU 88 14.677 25.452 -12.622 633 H GLN 89 H GLN 89 9.363 23.760 -16.674 634 HA GLN 89 HA GLN 89 9.062 21.222 -15.655 635 1HB GLN 89 1HB GLN 89 7.389 23.165 -16.653 636 2HB GLN 89 2HB GLN 89 7.281 21.964 -17.925 637 1HG GLN 89 1HG GLN 89 6.963 21.222 -14.987 638 2HG GLN 89 2HG GLN 89 5.604 21.759 -15.956 639 1HE2 GLN 89 1HE2 GLN 89 6.939 19.129 -14.753 640 2HE2 GLN 89 2HE2 GLN 89 6.598 17.936 -15.961 641 H GLN 90 H GLN 90 9.135 22.199 -19.167 642 HA GLN 90 HA GLN 90 9.482 19.509 -19.953 643 1HB GLN 90 1HB GLN 90 8.325 21.282 -21.321 644 2HB GLN 90 2HB GLN 90 9.874 22.061 -21.578 645 1HG GLN 90 1HG GLN 90 10.595 20.458 -23.075 646 2HG GLN 90 2HG GLN 90 9.824 19.144 -22.209 647 1HE2 GLN 90 1HE2 GLN 90 9.807 20.845 -24.986 648 2HE2 GLN 90 2HE2 GLN 90 8.173 20.632 -25.520 649 H GLN 91 H GLN 91 11.577 21.784 -18.571 650 HA GLN 91 HA GLN 91 13.868 20.891 -20.083 651 1HB GLN 91 1HB GLN 91 13.352 23.338 -19.220 652 2HB GLN 91 2HB GLN 91 14.000 22.753 -17.701 653 1HG GLN 91 1HG GLN 91 16.155 22.630 -18.505 654 2HG GLN 91 2HG GLN 91 15.649 22.052 -20.080 655 1HE2 GLN 91 1HE2 GLN 91 16.810 23.411 -21.317 656 2HE2 GLN 91 2HE2 GLN 91 16.579 25.125 -21.405 657 H ALA 92 H ALA 92 12.078 19.367 -17.931 658 HA ALA 92 HA ALA 92 14.151 18.712 -16.004 659 1HB ALA 92 1HB ALA 92 12.203 17.207 -15.163 660 2HB ALA 92 2HB ALA 92 12.036 18.972 -15.000 661 3HB ALA 92 3HB ALA 92 11.200 18.117 -16.318 662 H LEU 93 H LEU 93 14.696 18.113 -18.795 663 HA LEU 93 HA LEU 93 14.481 15.185 -18.745 664 1HB LEU 93 1HB LEU 93 13.527 16.775 -20.650 665 2HB LEU 93 2HB LEU 93 15.182 16.687 -21.220 666 HG LEU 93 HG LEU 93 13.560 15.033 -22.225 667 1HD1 LEU 93 2HD1 LEU 93 16.198 14.855 -21.892 668 2HD1 LEU 93 3HD1 LEU 93 15.718 13.430 -20.940 669 3HD1 LEU 93 1HD1 LEU 93 15.239 13.560 -22.650 670 1HD2 LEU 93 2HD2 LEU 93 12.486 14.564 -19.938 671 2HD2 LEU 93 3HD2 LEU 93 12.753 13.189 -21.037 672 3HD2 LEU 93 1HD2 LEU 93 13.859 13.463 -19.669 673 H SER 94 H SER 94 16.306 15.745 -17.019 674 HA SER 94 HA SER 94 18.807 15.857 -18.518 675 1HB SER 94 1HB SER 94 18.487 17.756 -16.942 676 2HB SER 94 2HB SER 94 18.269 16.631 -15.616 677 HG SER 94 HG SER 94 20.439 17.369 -15.626 678 H SER 95 H SER 95 17.006 14.363 -15.765 679 HA SER 95 HA SER 95 18.747 12.686 -14.725 680 1HB SER 95 1HB SER 95 16.098 12.909 -14.519 681 2HB SER 95 2HB SER 95 16.098 11.509 -15.573 682 HG SER 95 HG SER 95 16.314 11.427 -12.975 683 H GLN 96 H GLN 96 16.665 11.669 -17.542 684 HA GLN 96 HA GLN 96 18.186 9.410 -18.061 685 1HB GLN 96 1HB GLN 96 15.801 10.571 -19.017 686 2HB GLN 96 2HB GLN 96 16.831 10.484 -20.432 687 1HG GLN 96 1HG GLN 96 16.120 8.170 -18.569 688 2HG GLN 96 2HG GLN 96 15.541 8.397 -20.207 689 1HE2 GLN 96 1HE2 GLN 96 17.064 6.217 -18.975 690 2HE2 GLN 96 2HE2 GLN 96 18.508 6.010 -19.909 691 H MET 97 H MET 97 18.116 12.668 -19.666 692 HA MET 97 HA MET 97 20.334 11.941 -21.303 693 1HB MET 97 1HB MET 97 18.614 13.464 -22.182 694 2HB MET 97 2HB MET 97 18.785 14.538 -20.807 695 1HG MET 97 1HG MET 97 21.197 14.961 -21.522 696 2HG MET 97 2HG MET 97 20.884 14.017 -22.966 697 1HE MET 97 2HE MET 97 21.803 16.894 -22.237 698 2HE MET 97 3HE MET 97 21.627 17.053 -24.001 699 3HE MET 97 1HE MET 97 20.799 18.197 -22.917 700 H GLY 98 H GLY 98 22.072 11.477 -19.853 701 1HA GLY 98 2HA GLY 98 22.849 13.008 -17.677 702 2HA GLY 98 1HA GLY 98 23.620 13.725 -19.078 703 H PHE 99 H PHE 99 24.492 11.911 -16.641 704 HA PHE 99 HA PHE 99 26.677 10.768 -17.819 705 1HB PHE 99 1HB PHE 99 26.209 11.183 -15.354 706 2HB PHE 99 2HB PHE 99 25.029 9.887 -15.371 707 HD1 PHE 99 1HD PHE 99 28.621 10.664 -15.571 708 HD2 PHE 99 2HD PHE 99 25.709 7.593 -15.258 709 HE1 PHE 99 1HE PHE 99 30.420 9.018 -14.978 710 HE2 PHE 99 2HE PHE 99 27.509 5.947 -14.664 711 HZ PHE 99 HZ PHE 99 29.843 6.679 -14.532 712 H MET 601 H MET 601 6.331 -24.533 -20.665 713 HA MET 601 HA MET 601 6.499 -22.096 -21.779 714 1HB MET 601 1HB MET 601 9.099 -23.622 -21.926 715 2HB MET 601 2HB MET 601 8.598 -22.810 -23.396 716 1HG MET 601 1HG MET 601 8.331 -20.666 -22.058 717 2HG MET 601 2HG MET 601 8.973 -21.502 -20.658 718 1HE MET 601 3HE MET 601 11.151 -20.614 -20.057 719 2HE MET 601 1HE MET 601 11.432 -22.337 -20.404 720 3HE MET 601 2HE MET 601 12.603 -21.116 -20.956 721 H THR 602 H THR 602 4.676 -24.135 -21.872 722 HA THR 602 HA THR 602 4.996 -25.836 -24.122 723 HB THR 602 HB THR 602 3.463 -25.977 -21.961 724 HG1 THR 602 1HG THR 602 2.585 -26.469 -24.720 725 1HG2 THR 602 2HG2 THR 602 1.678 -24.523 -23.984 726 2HG2 THR 602 3HG2 THR 602 1.106 -25.333 -22.506 727 3HG2 THR 602 1HG2 THR 602 2.147 -23.895 -22.386 728 H GLU 603 H GLU 603 3.814 -22.521 -23.657 729 HA GLU 603 HA GLU 603 3.788 -22.266 -26.511 730 1HB GLU 603 1HB GLU 603 1.292 -22.170 -24.838 731 2HB GLU 603 2HB GLU 603 1.438 -20.996 -26.131 732 1HG GLU 603 1HG GLU 603 1.970 -22.920 -27.719 733 2HG GLU 603 2HG GLU 603 1.619 -24.032 -26.411 734 HE2 GLU 603 HE GLU 603 -0.574 -21.593 -28.344 735 H GLN 604 H GLN 604 5.108 -20.523 -26.788 736 HA GLN 604 HA GLN 604 5.713 -18.755 -24.776 737 1HB GLN 604 1HB GLN 604 7.037 -19.220 -26.891 738 2HB GLN 604 2HB GLN 604 5.898 -18.221 -27.772 739 1HG GLN 604 1HG GLN 604 6.522 -16.240 -26.563 740 2HG GLN 604 2HG GLN 604 7.333 -17.158 -25.310 741 1HE2 GLN 604 1HE2 GLN 604 8.936 -15.427 -26.000 742 2HE2 GLN 604 2HE2 GLN 604 10.113 -15.871 -27.191 743 H GLN 605 H GLN 605 3.203 -18.644 -27.336 744 HA GLN 605 HA GLN 605 2.466 -16.117 -27.416 745 1HB GLN 605 1HB GLN 605 0.599 -18.503 -27.066 746 2HB GLN 605 2HB GLN 605 0.086 -16.930 -27.643 747 1HG GLN 605 1HG GLN 605 2.333 -17.550 -29.240 748 2HG GLN 605 2HG GLN 605 1.484 -19.076 -29.087 749 1HE2 GLN 605 1HE2 GLN 605 -0.120 -19.466 -30.409 750 2HE2 GLN 605 2HE2 GLN 605 -1.018 -18.310 -31.336 751 H TRP 606 H TRP 606 1.509 -18.410 -24.769 752 HA TRP 606 HA TRP 606 1.370 -16.150 -22.959 753 1HB TRP 606 1HB TRP 606 -0.850 -16.623 -22.179 754 2HB TRP 606 2HB TRP 606 -0.885 -16.238 -23.889 755 HD1 TRP 606 HD TRP 606 -1.710 -18.194 -25.558 756 HE1 TRP 606 1HE TRP 606 -2.891 -20.536 -25.273 757 HE3 TRP 606 3HE TRP 606 -0.869 -18.598 -20.559 758 HZ2 TRP 606 2HZ TRP 606 -3.331 -22.257 -23.039 759 HZ3 TRP 606 3HZ TRP 606 -1.708 -20.641 -19.403 760 HH2 TRP 606 HH TRP 606 -2.901 -22.433 -20.561 761 H ASN 607 H ASN 607 2.984 -16.938 -21.624 762 HA ASN 607 HA ASN 607 3.332 -19.682 -21.207 763 1HB ASN 607 1HB ASN 607 4.356 -17.229 -19.686 764 2HB ASN 607 2HB ASN 607 4.896 -18.860 -19.339 765 1HD2 ASN 607 1HD2 ASN 607 6.837 -17.291 -19.946 766 2HD2 ASN 607 2HD2 ASN 607 7.433 -17.477 -21.561 767 H PHE 608 H PHE 608 3.109 -20.794 -19.032 768 HA PHE 608 HA PHE 608 0.581 -20.288 -17.898 769 1HB PHE 608 1HB PHE 608 2.176 -22.436 -18.136 770 2HB PHE 608 2HB PHE 608 2.863 -21.874 -16.626 771 HD1 PHE 608 1HD PHE 608 1.744 -22.227 -14.566 772 HD2 PHE 608 2HD PHE 608 -0.255 -23.058 -18.216 773 HE1 PHE 608 1HE PHE 608 -0.083 -23.392 -13.300 774 HE2 PHE 608 2HE PHE 608 -2.082 -24.223 -16.949 775 HZ PHE 608 HZ PHE 608 -1.975 -24.376 -14.507 776 H ALA 609 H ALA 609 3.977 -19.821 -16.716 777 HA ALA 609 HA ALA 609 3.173 -18.808 -14.206 778 1HB ALA 609 3HB ALA 609 5.607 -18.008 -14.201 779 2HB ALA 609 2HB ALA 609 5.743 -18.730 -15.822 780 3HB ALA 609 1HB ALA 609 5.353 -19.756 -14.421 781 H GLY 610 H GLY 610 2.844 -17.565 -17.346 782 1HA GLY 610 2HA GLY 610 2.961 -15.379 -18.153 783 2HA GLY 610 1HA GLY 610 3.201 -14.773 -16.527 784 H ILE 611 H ILE 611 0.721 -16.787 -18.280 785 HA ILE 611 HA ILE 611 -1.308 -14.898 -18.006 786 HB ILE 611 HB ILE 611 -1.149 -16.820 -19.616 787 1HG1 ILE 611 1HG1 ILE 611 -3.206 -15.359 -19.068 788 2HG1 ILE 611 2HG1 ILE 611 -3.437 -16.834 -19.984 789 1HG2 ILE 611 3HG2 ILE 611 -1.814 -18.338 -17.113 790 2HG2 ILE 611 1HG2 ILE 611 -2.403 -18.911 -18.692 791 3HG2 ILE 611 2HG2 ILE 611 -0.656 -18.725 -18.408 792 1HD1 ILE 611 3HD1 ILE 611 -3.797 -17.933 -17.589 793 2HD1 ILE 611 1HD1 ILE 611 -4.145 -16.255 -17.106 794 3HD1 ILE 611 2HD1 ILE 611 -5.121 -17.038 -18.372 795 H GLU 612 H GLU 612 -0.087 -17.455 -15.847 796 HA GLU 612 HA GLU 612 -2.299 -17.516 -14.166 797 1HB GLU 612 1HB GLU 612 -0.673 -19.299 -14.085 798 2HB GLU 612 2HB GLU 612 0.637 -18.188 -13.739 799 1HG GLU 612 1HG GLU 612 -0.637 -17.570 -11.575 800 2HG GLU 612 2HG GLU 612 -1.679 -18.940 -11.905 801 HE2 GLU 612 HE GLU 612 0.074 -20.351 -9.790 802 H ALA 613 H ALA 613 0.789 -15.624 -14.056 803 HA ALA 613 HA ALA 613 -0.070 -14.223 -11.697 804 1HB ALA 613 1HB ALA 613 2.099 -13.418 -11.642 805 2HB ALA 613 3HB ALA 613 2.234 -13.347 -13.415 806 3HB ALA 613 2HB ALA 613 2.347 -14.913 -12.575 807 H ALA 614 H ALA 614 -0.554 -14.005 -15.121 808 HA ALA 614 HA ALA 614 -0.618 -11.294 -15.565 809 1HB ALA 614 2HB ALA 614 -2.502 -13.420 -16.662 810 2HB ALA 614 3HB ALA 614 -2.120 -11.852 -17.413 811 3HB ALA 614 1HB ALA 614 -0.859 -13.100 -17.267 812 H ALA 615 H ALA 615 -3.284 -13.459 -14.382 813 HA ALA 615 HA ALA 615 -5.217 -11.516 -14.123 814 1HB ALA 615 2HB ALA 615 -6.366 -13.313 -13.412 815 2HB ALA 615 3HB ALA 615 -4.853 -14.246 -13.494 816 3HB ALA 615 1HB ALA 615 -5.334 -13.463 -11.970 817 H SER 616 H SER 616 -2.781 -12.661 -11.685 818 HA SER 616 HA SER 616 -3.568 -11.068 -9.633 819 1HB SER 616 1HB SER 616 -1.436 -12.795 -10.176 820 2HB SER 616 2HB SER 616 -0.633 -11.267 -9.878 821 HG SER 616 HG SER 616 -1.698 -11.120 -7.828 822 H ALA 617 H ALA 617 -1.831 -10.243 -12.611 823 HA ALA 617 HA ALA 617 -0.862 -7.733 -11.661 824 1HB ALA 617 1HB ALA 617 -0.313 -9.424 -13.779 825 2HB ALA 617 3HB ALA 617 0.273 -7.751 -13.620 826 3HB ALA 617 2HB ALA 617 -1.193 -8.094 -14.570 827 H ILE 618 H ILE 618 -3.811 -8.981 -13.226 828 HA ILE 618 HA ILE 618 -4.786 -6.449 -14.019 829 HB ILE 618 HB ILE 618 -6.186 -9.081 -13.537 830 1HG1 ILE 618 1HG1 ILE 618 -4.419 -9.216 -15.230 831 2HG1 ILE 618 2HG1 ILE 618 -6.011 -9.399 -15.939 832 1HG2 ILE 618 3HG2 ILE 618 -7.461 -6.714 -13.647 833 2HG2 ILE 618 1HG2 ILE 618 -7.329 -7.064 -15.387 834 3HG2 ILE 618 2HG2 ILE 618 -8.131 -8.226 -14.304 835 1HD1 ILE 618 2HD1 ILE 618 -5.475 -6.600 -15.969 836 2HD1 ILE 618 3HD1 ILE 618 -3.984 -7.404 -16.516 837 3HD1 ILE 618 1HD1 ILE 618 -5.521 -7.709 -17.361 838 H GLN 619 H GLN 619 -5.349 -8.578 -11.145 839 HA GLN 619 HA GLN 619 -7.250 -7.059 -9.937 840 1HB GLN 619 1HB GLN 619 -5.360 -9.153 -9.167 841 2HB GLN 619 2HB GLN 619 -5.605 -8.029 -7.845 842 1HG GLN 619 1HG GLN 619 -7.869 -9.362 -9.405 843 2HG GLN 619 2HG GLN 619 -7.255 -9.945 -7.870 844 1HE2 GLN 619 1HE2 GLN 619 -9.698 -8.345 -9.193 845 2HE2 GLN 619 2HE2 GLN 619 -10.160 -7.253 -7.930 846 H GLY 620 H GLY 620 -3.699 -6.977 -9.117 847 1HA GLY 620 2HA GLY 620 -2.371 -5.282 -8.466 848 2HA GLY 620 1HA GLY 620 -3.729 -4.762 -7.488 849 H ASN 621 H ASN 621 -3.774 -4.965 -11.074 850 HA ASN 621 HA ASN 621 -3.182 -2.231 -11.409 851 1HB ASN 621 1HB ASN 621 -4.045 -4.533 -13.144 852 2HB ASN 621 2HB ASN 621 -4.396 -2.932 -13.766 853 1HD2 ASN 621 1HD2 ASN 621 -2.358 -1.401 -12.943 854 2HD2 ASN 621 2HD2 ASN 621 -0.843 -1.924 -13.602 855 H VAL 622 H VAL 622 -6.086 -4.263 -10.987 856 HA VAL 622 HA VAL 622 -7.970 -2.396 -11.941 857 HB VAL 622 HB VAL 622 -8.074 -4.821 -10.159 858 1HG1 VAL 622 2HG1 VAL 622 -10.288 -2.889 -10.842 859 2HG1 VAL 622 3HG1 VAL 622 -10.628 -4.612 -10.548 860 3HG1 VAL 622 1HG1 VAL 622 -9.876 -3.624 -9.273 861 1HG2 VAL 622 2HG2 VAL 622 -7.825 -4.628 -12.858 862 2HG2 VAL 622 3HG2 VAL 622 -8.615 -5.987 -12.022 863 3HG2 VAL 622 1HG2 VAL 622 -9.597 -4.664 -12.696 864 H THR 623 H THR 623 -6.873 -3.285 -8.592 865 HA THR 623 HA THR 623 -8.405 -1.326 -7.305 866 HB THR 623 HB THR 623 -6.825 -1.847 -5.412 867 HG1 THR 623 1HG THR 623 -5.149 -3.508 -6.169 868 1HG2 THR 623 3HG2 THR 623 -8.634 -3.556 -6.131 869 2HG2 THR 623 1HG2 THR 623 -7.340 -4.393 -7.022 870 3HG2 THR 623 2HG2 THR 623 -7.239 -4.228 -5.252 871 H SER 624 H SER 624 -5.162 -1.217 -8.817 872 HA SER 624 HA SER 624 -4.272 1.106 -7.742 873 1HB SER 624 1HB SER 624 -3.960 0.063 -10.590 874 2HB SER 624 2HB SER 624 -3.011 1.380 -9.931 875 HG SER 624 HG SER 624 -2.540 -1.261 -9.709 876 H ILE 625 H ILE 625 -6.372 0.638 -10.665 877 HA ILE 625 HA ILE 625 -6.621 3.413 -11.160 878 HB ILE 625 HB ILE 625 -7.742 0.885 -12.209 879 1HG1 ILE 625 1HG1 ILE 625 -7.295 2.864 -14.196 880 2HG1 ILE 625 2HG1 ILE 625 -5.984 3.006 -13.042 881 1HG2 ILE 625 3HG2 ILE 625 -9.206 3.521 -12.413 882 2HG2 ILE 625 1HG2 ILE 625 -9.405 2.203 -13.592 883 3HG2 ILE 625 2HG2 ILE 625 -9.833 1.942 -11.884 884 1HD1 ILE 625 1HD1 ILE 625 -6.864 0.308 -14.144 885 2HD1 ILE 625 2HD1 ILE 625 -5.644 1.318 -14.955 886 3HD1 ILE 625 3HD1 ILE 625 -5.343 0.708 -13.311 887 H HIS 626 H HIS 626 -8.262 1.066 -9.072 888 HA HIS 626 HA HIS 626 -10.639 2.437 -8.700 889 1HB HIS 626 1HB HIS 626 -9.956 0.074 -7.983 890 2HB HIS 626 2HB HIS 626 -9.219 0.819 -6.579 891 HD1 HIS 626 1HD HIS 626 -11.046 -0.648 -5.227 892 HD2 HIS 626 2HD HIS 626 -12.548 2.519 -7.532 893 HE1 HIS 626 1HE HIS 626 -13.421 -0.223 -4.397 894 H SER 627 H SER 627 -7.495 2.631 -6.906 895 HA SER 627 HA SER 627 -8.517 4.732 -5.283 896 1HB SER 627 1HB SER 627 -5.993 3.152 -5.492 897 2HB SER 627 2HB SER 627 -5.807 4.776 -4.861 898 HG SER 627 HG SER 627 -6.531 4.031 -3.000 899 H LEU 628 H LEU 628 -6.164 4.366 -8.011 900 HA LEU 628 HA LEU 628 -5.125 6.846 -8.169 901 1HB LEU 628 1HB LEU 628 -5.780 4.704 -10.085 902 2HB LEU 628 2HB LEU 628 -5.560 6.289 -10.799 903 HG LEU 628 HG LEU 628 -3.506 5.174 -8.898 904 1HD1 LEU 628 3HD1 LEU 628 -4.044 4.328 -11.709 905 2HD1 LEU 628 1HD1 LEU 628 -2.351 4.539 -11.200 906 3HD1 LEU 628 2HD1 LEU 628 -3.407 3.402 -10.328 907 1HD2 LEU 628 3HD2 LEU 628 -3.557 7.608 -9.681 908 2HD2 LEU 628 1HD2 LEU 628 -2.029 6.715 -9.870 909 3HD2 LEU 628 2HD2 LEU 628 -3.085 6.980 -11.278 910 H LEU 629 H LEU 629 -8.277 5.811 -9.652 911 HA LEU 629 HA LEU 629 -8.992 8.254 -10.673 912 1HB LEU 629 1HB LEU 629 -10.213 5.714 -10.125 913 2HB LEU 629 2HB LEU 629 -11.332 6.996 -9.706 914 HG LEU 629 HG LEU 629 -11.532 6.101 -12.043 915 1HD1 LEU 629 3HD1 LEU 629 -11.222 8.976 -11.329 916 2HD1 LEU 629 1HD1 LEU 629 -11.386 8.563 -13.053 917 3HD1 LEU 629 2HD1 LEU 629 -12.649 8.076 -11.896 918 1HD2 LEU 629 3HD2 LEU 629 -8.756 6.466 -12.090 919 2HD2 LEU 629 1HD2 LEU 629 -9.811 5.988 -13.441 920 3HD2 LEU 629 2HD2 LEU 629 -9.412 7.704 -13.187 921 H ASP 630 H ASP 630 -9.449 6.945 -7.340 922 HA ASP 630 HA ASP 630 -10.920 9.125 -6.446 923 1HB ASP 630 1HB ASP 630 -9.413 6.842 -5.237 924 2HB ASP 630 2HB ASP 630 -9.654 8.217 -4.177 925 HD2 ASP 630 HD ASP 630 -11.525 8.233 -3.151 926 H GLU 631 H GLU 631 -7.474 8.497 -6.973 927 HA GLU 631 HA GLU 631 -6.555 10.522 -5.228 928 1HB GLU 631 1HB GLU 631 -5.415 8.483 -6.971 929 2HB GLU 631 2HB GLU 631 -4.572 10.002 -7.197 930 1HG GLU 631 1HG GLU 631 -4.077 10.177 -4.816 931 2HG GLU 631 2HG GLU 631 -5.138 8.834 -4.437 932 HE2 GLU 631 HE GLU 631 -2.860 6.425 -5.562 933 H GLY 632 H GLY 632 -7.070 10.227 -8.800 934 1HA GLY 632 2HA GLY 632 -7.078 11.779 -10.436 935 2HA GLY 632 1HA GLY 632 -6.159 12.853 -9.399 936 H LYS 633 H LYS 633 -9.336 11.377 -8.572 937 HA LYS 633 HA LYS 633 -10.953 13.472 -9.389 938 1HB LYS 633 1HB LYS 633 -11.571 11.104 -8.626 939 2HB LYS 633 2HB LYS 633 -11.479 11.714 -6.986 940 1HG LYS 633 1HG LYS 633 -13.782 11.935 -7.650 941 2HG LYS 633 2HG LYS 633 -13.116 13.556 -7.664 942 1HD LYS 633 1HD LYS 633 -12.565 12.718 -10.250 943 2HD LYS 633 2HD LYS 633 -14.073 11.884 -9.932 944 1HE LYS 633 1HE LYS 633 -15.032 14.126 -9.130 945 2HE LYS 633 2HE LYS 633 -13.566 14.887 -9.717 946 H GLN 634 H GLN 634 -8.892 13.055 -6.512 947 HA GLN 634 HA GLN 634 -10.053 15.163 -5.078 948 1HB GLN 634 1HB GLN 634 -7.405 13.689 -4.899 949 2HB GLN 634 2HB GLN 634 -7.754 15.040 -3.839 950 1HG GLN 634 1HG GLN 634 -10.082 13.376 -3.803 951 2HG GLN 634 2HG GLN 634 -8.708 12.296 -3.669 952 1HE2 GLN 634 1HE2 GLN 634 -10.749 13.064 -1.718 953 2HE2 GLN 634 2HE2 GLN 634 -9.924 13.694 -0.332 954 H SER 635 H SER 635 -7.911 15.013 -7.817 955 HA SER 635 HA SER 635 -6.835 17.629 -7.275 956 1HB SER 635 1HB SER 635 -5.932 15.354 -8.692 957 2HB SER 635 2HB SER 635 -6.258 16.545 -9.935 958 HG SER 635 HG SER 635 -5.004 17.910 -8.026 959 H LEU 636 H LEU 636 -9.220 15.945 -9.336 960 HA LEU 636 HA LEU 636 -9.673 17.701 -11.329 961 1HB LEU 636 1HB LEU 636 -11.149 15.650 -9.929 962 2HB LEU 636 2HB LEU 636 -12.221 16.944 -10.426 963 HG LEU 636 HG LEU 636 -11.995 15.036 -12.043 964 1HD1 LEU 636 1HD1 LEU 636 -11.248 17.800 -13.036 965 2HD1 LEU 636 2HD1 LEU 636 -11.869 16.473 -14.046 966 3HD1 LEU 636 3HD1 LEU 636 -12.890 17.167 -12.764 967 1HD2 LEU 636 3HD2 LEU 636 -9.519 14.754 -11.673 968 2HD2 LEU 636 1HD2 LEU 636 -10.046 14.752 -13.373 969 3HD2 LEU 636 2HD2 LEU 636 -9.277 16.201 -12.681 970 H THR 637 H THR 637 -11.005 17.919 -7.963 971 HA THR 637 HA THR 637 -12.326 20.372 -8.438 972 HB THR 637 HB THR 637 -13.167 19.184 -6.597 973 HG1 THR 637 1HG THR 637 -10.949 20.721 -5.448 974 1HG2 THR 637 1HG2 THR 637 -10.264 18.444 -6.151 975 2HG2 THR 637 2HG2 THR 637 -11.366 18.450 -4.753 976 3HG2 THR 637 3HG2 THR 637 -11.701 17.394 -6.146 977 H LYS 638 H LYS 638 -8.984 19.514 -7.699 978 HA LYS 638 HA LYS 638 -8.341 22.185 -6.853 979 1HB LYS 638 1HB LYS 638 -6.628 19.751 -7.435 980 2HB LYS 638 2HB LYS 638 -6.008 21.277 -6.836 981 1HG LYS 638 1HG LYS 638 -7.815 21.013 -4.940 982 2HG LYS 638 2HG LYS 638 -7.888 19.337 -5.445 983 1HD LYS 638 1HD LYS 638 -5.210 20.642 -4.851 984 2HD LYS 638 2HD LYS 638 -6.203 20.030 -3.544 985 1HE LYS 638 1HE LYS 638 -6.318 17.850 -5.127 986 2HE LYS 638 2HE LYS 638 -4.819 18.509 -5.750 987 H LEU 639 H LEU 639 -8.487 20.306 -9.840 988 HA LEU 639 HA LEU 639 -6.948 22.340 -11.242 989 1HB LEU 639 1HB LEU 639 -8.024 19.632 -12.008 990 2HB LEU 639 2HB LEU 639 -7.356 20.745 -13.185 991 HG LEU 639 HG LEU 639 -5.547 19.400 -12.735 992 1HD1 LEU 639 1HD1 LEU 639 -5.010 21.807 -12.350 993 2HD1 LEU 639 2HD1 LEU 639 -5.187 21.519 -10.602 994 3HD1 LEU 639 3HD1 LEU 639 -3.919 20.672 -11.520 995 1HD2 LEU 639 1HD2 LEU 639 -6.810 18.247 -10.823 996 2HD2 LEU 639 2HD2 LEU 639 -5.032 18.283 -10.746 997 3HD2 LEU 639 3HD2 LEU 639 -5.989 19.409 -9.753 998 H ALA 640 H ALA 640 -10.152 21.698 -10.256 999 HA ALA 640 HA ALA 640 -11.733 22.299 -12.375 1000 1HB ALA 640 2HB ALA 640 -12.206 21.823 -9.823 1001 2HB ALA 640 3HB ALA 640 -12.242 23.599 -9.703 1002 3HB ALA 640 1HB ALA 640 -13.376 22.757 -10.787 1003 H ALA 641 H ALA 641 -9.842 24.572 -10.302 1004 HA ALA 641 HA ALA 641 -10.829 26.930 -11.373 1005 1HB ALA 641 2HB ALA 641 -8.932 26.131 -9.485 1006 2HB ALA 641 1HB ALA 641 -9.352 27.807 -9.911 1007 3HB ALA 641 3HB ALA 641 -7.977 27.005 -10.706 1008 H ALA 642 H ALA 642 -8.499 24.550 -12.620 1009 HA ALA 642 HA ALA 642 -7.240 26.148 -14.514 1010 1HB ALA 642 3HB ALA 642 -6.953 23.619 -13.640 1011 2HB ALA 642 2HB ALA 642 -6.298 24.168 -15.201 1012 3HB ALA 642 1HB ALA 642 -7.843 23.287 -15.145 1013 H TRP 643 H TRP 643 -10.517 24.953 -14.296 1014 HA TRP 643 HA TRP 643 -10.944 25.349 -17.154 1015 1HB TRP 643 1HB TRP 643 -12.561 24.117 -14.937 1016 2HB TRP 643 2HB TRP 643 -13.304 24.575 -16.457 1017 HD1 TRP 643 HD TRP 643 -12.725 23.034 -18.605 1018 HE1 TRP 643 1HE TRP 643 -11.611 20.671 -18.973 1019 HE3 TRP 643 3HE TRP 643 -10.707 22.678 -13.951 1020 HZ2 TRP 643 2HZ TRP 643 -10.046 18.955 -17.313 1021 HZ3 TRP 643 3HZ TRP 643 -9.401 20.626 -13.406 1022 HH2 TRP 643 HH TRP 643 -9.057 18.804 -14.999 1023 H GLY 644 H GLY 644 -10.524 27.286 -14.553 1024 1HA GLY 644 2HA GLY 644 -12.494 29.242 -15.532 1025 2HA GLY 644 1HA GLY 644 -10.986 29.594 -14.712 1026 H GLY 645 H GLY 645 -11.962 26.998 -12.987 1027 1HA GLY 645 2HA GLY 645 -13.853 28.482 -11.279 1028 2HA GLY 645 1HA GLY 645 -12.380 27.816 -10.603 1029 H SER 646 H SER 646 -14.399 26.783 -9.334 1030 HA SER 646 HA SER 646 -14.752 24.181 -10.581 1031 1HB SER 646 1HB SER 646 -15.051 23.296 -8.329 1032 2HB SER 646 2HB SER 646 -13.585 24.255 -8.371 1033 HG SER 646 HG SER 646 -15.719 25.864 -7.726 1034 H GLY 647 H GLY 647 -16.361 27.111 -9.620 1035 1HA GLY 647 2HA GLY 647 -18.588 27.513 -9.098 1036 2HA GLY 647 1HA GLY 647 -18.991 25.842 -9.439 1037 H SER 648 H SER 648 -17.221 26.072 -12.009 1038 HA SER 648 HA SER 648 -19.112 27.674 -13.539 1039 1HB SER 648 1HB SER 648 -16.193 27.203 -13.722 1040 2HB SER 648 2HB SER 648 -17.015 27.074 -15.264 1041 HG SER 648 HG SER 648 -18.069 29.214 -14.592 1042 H GLU 649 H GLU 649 -20.356 26.686 -15.147 1043 HA GLU 649 HA GLU 649 -20.835 24.023 -15.016 1044 1HB GLU 649 1HB GLU 649 -22.161 24.303 -17.009 1045 2HB GLU 649 2HB GLU 649 -22.262 25.805 -16.112 1046 1HG GLU 649 1HG GLU 649 -20.606 26.869 -17.568 1047 2HG GLU 649 2HG GLU 649 -20.255 25.349 -18.366 1048 HE2 GLU 649 HE GLU 649 -23.779 27.131 -18.644 1049 H ALA 650 H ALA 650 -18.193 25.697 -16.595 1050 HA ALA 650 HA ALA 650 -17.574 23.871 -18.600 1051 1HB ALA 650 2HB ALA 650 -16.374 26.159 -17.243 1052 2HB ALA 650 1HB ALA 650 -16.180 25.608 -18.925 1053 3HB ALA 650 3HB ALA 650 -15.155 24.925 -17.640 1054 H TYR 651 H TYR 651 -15.819 24.224 -15.436 1055 HA TYR 651 HA TYR 651 -14.492 21.836 -15.544 1056 1HB TYR 651 1HB TYR 651 -13.932 23.384 -13.802 1057 2HB TYR 651 2HB TYR 651 -15.613 23.725 -13.443 1058 HD1 TYR 651 1HD TYR 651 -16.601 22.785 -11.545 1059 HD2 TYR 651 2HD TYR 651 -13.085 20.972 -13.176 1060 HE1 TYR 651 1HE TYR 651 -16.492 21.196 -9.563 1061 HE2 TYR 651 2HE TYR 651 -12.988 19.389 -11.189 1062 HH TYR 651 HH TYR 651 -13.744 19.064 -9.112 1063 H GLN 652 H GLN 652 -17.896 22.471 -14.724 1064 HA GLN 652 HA GLN 652 -18.397 20.138 -13.345 1065 1HB GLN 652 1HB GLN 652 -20.121 21.985 -15.022 1066 2HB GLN 652 2HB GLN 652 -20.809 20.547 -14.294 1067 1HG GLN 652 1HG GLN 652 -19.270 21.793 -12.239 1068 2HG GLN 652 2HG GLN 652 -20.134 23.091 -13.038 1069 1HE2 GLN 652 1HE2 GLN 652 -20.936 22.914 -10.664 1070 2HE2 GLN 652 2HE2 GLN 652 -22.416 22.045 -10.430 1071 H GLY 653 H GLY 653 -18.912 20.888 -16.870 1072 1HA GLY 653 2HA GLY 653 -18.932 19.555 -18.679 1073 2HA GLY 653 1HA GLY 653 -19.786 18.394 -17.682 1074 H VAL 654 H VAL 654 -16.572 19.448 -16.657 1075 HA VAL 654 HA VAL 654 -15.217 17.313 -18.012 1076 HB VAL 654 HB VAL 654 -14.453 19.446 -16.032 1077 1HG1 VAL 654 2HG1 VAL 654 -13.185 17.408 -15.453 1078 2HG1 VAL 654 3HG1 VAL 654 -12.618 17.292 -17.136 1079 3HG1 VAL 654 1HG1 VAL 654 -12.136 18.677 -16.128 1080 1HG2 VAL 654 2HG2 VAL 654 -14.661 19.402 -18.814 1081 2HG2 VAL 654 3HG2 VAL 654 -13.810 20.615 -17.828 1082 3HG2 VAL 654 1HG2 VAL 654 -12.917 19.230 -18.501 1083 H GLN 655 H GLN 655 -16.402 18.060 -14.691 1084 HA GLN 655 HA GLN 655 -15.247 15.998 -13.363 1085 1HB GLN 655 1HB GLN 655 -17.547 17.775 -12.989 1086 2HB GLN 655 2HB GLN 655 -17.844 16.202 -12.276 1087 1HG GLN 655 1HG GLN 655 -15.120 17.017 -11.671 1088 2HG GLN 655 2HG GLN 655 -16.214 18.317 -11.241 1089 1HE2 GLN 655 1HE2 GLN 655 -14.688 16.722 -9.461 1090 2HE2 GLN 655 2HE2 GLN 655 -15.765 15.856 -8.417 1091 H GLN 656 H GLN 656 -18.488 15.994 -15.016 1092 HA GLN 656 HA GLN 656 -18.991 13.321 -14.490 1093 1HB GLN 656 1HB GLN 656 -20.514 13.689 -16.661 1094 2HB GLN 656 2HB GLN 656 -20.917 14.426 -15.123 1095 1HG GLN 656 1HG GLN 656 -19.026 16.021 -16.782 1096 2HG GLN 656 2HG GLN 656 -20.608 15.806 -17.504 1097 1HE2 GLN 656 1HE2 GLN 656 -21.553 17.704 -17.232 1098 2HE2 GLN 656 2HE2 GLN 656 -21.819 18.514 -15.724 1099 H LYS 657 H LYS 657 -17.225 14.985 -17.121 1100 HA LYS 657 HA LYS 657 -17.069 12.755 -18.832 1101 1HB LYS 657 1HB LYS 657 -15.652 15.393 -18.594 1102 2HB LYS 657 2HB LYS 657 -15.011 14.169 -19.671 1103 1HG LYS 657 1HG LYS 657 -17.321 13.976 -20.723 1104 2HG LYS 657 2HG LYS 657 -17.837 15.324 -19.730 1105 1HD LYS 657 1HD LYS 657 -15.326 15.953 -21.108 1106 2HD LYS 657 2HD LYS 657 -16.557 15.462 -22.255 1107 1HE LYS 657 1HE LYS 657 -18.143 17.111 -21.020 1108 2HE LYS 657 2HE LYS 657 -16.709 17.732 -20.229 1109 H TRP 658 H TRP 658 -15.343 13.752 -15.913 1110 HA TRP 658 HA TRP 658 -13.113 12.021 -16.379 1111 1HB TRP 658 1HB TRP 658 -12.710 13.952 -15.086 1112 2HB TRP 658 2HB TRP 658 -14.078 13.646 -14.035 1113 HD1 TRP 658 HD TRP 658 -13.636 12.070 -11.922 1114 HE1 TRP 658 1HE TRP 658 -11.548 10.888 -10.823 1115 HE3 TRP 658 3HE TRP 658 -10.490 12.809 -15.848 1116 HZ2 TRP 658 2HZ TRP 658 -8.876 10.406 -11.699 1117 HZ3 TRP 658 3HZ TRP 658 -8.158 11.951 -15.644 1118 HH2 TRP 658 HH TRP 658 -7.336 10.785 -13.660 1119 H ASP 659 H ASP 659 -15.964 12.052 -14.111 1120 HA ASP 659 HA ASP 659 -15.479 9.517 -13.127 1121 1HB ASP 659 1HB ASP 659 -17.303 11.569 -12.662 1122 2HB ASP 659 2HB ASP 659 -18.334 10.319 -13.330 1123 HD2 ASP 659 HD ASP 659 -18.617 8.908 -10.268 1124 H ALA 660 H ALA 660 -17.014 10.747 -16.079 1125 HA ALA 660 HA ALA 660 -18.689 8.667 -16.751 1126 1HB ALA 660 1HB ALA 660 -18.888 10.483 -18.155 1127 2HB ALA 660 2HB ALA 660 -17.132 10.772 -18.209 1128 3HB ALA 660 3HB ALA 660 -17.848 9.455 -19.169 1129 H THR 661 H THR 661 -15.739 9.029 -18.734 1130 HA THR 661 HA THR 661 -15.492 6.346 -19.289 1131 HB THR 661 HB THR 661 -13.292 7.008 -20.159 1132 HG1 THR 661 1HG THR 661 -13.826 9.186 -18.272 1133 1HG2 THR 661 1HG2 THR 661 -15.607 8.387 -20.848 1134 2HG2 THR 661 2HG2 THR 661 -14.523 9.711 -20.357 1135 3HG2 THR 661 3HG2 THR 661 -14.034 8.597 -21.656 1136 H ALA 662 H ALA 662 -14.644 8.070 -16.354 1137 HA ALA 662 HA ALA 662 -12.651 6.421 -15.379 1138 1HB ALA 662 3HB ALA 662 -13.004 8.359 -14.148 1139 2HB ALA 662 2HB ALA 662 -13.814 7.157 -13.115 1140 3HB ALA 662 1HB ALA 662 -14.776 8.194 -14.195 1141 H THR 663 H THR 663 -15.943 6.300 -13.923 1142 HA THR 663 HA THR 663 -15.772 3.752 -12.975 1143 HB THR 663 HB THR 663 -17.581 5.146 -12.262 1144 HG1 THR 663 1HG THR 663 -18.769 3.286 -12.434 1145 1HG2 THR 663 3HG2 THR 663 -17.676 5.916 -15.069 1146 2HG2 THR 663 1HG2 THR 663 -19.281 5.336 -14.562 1147 3HG2 THR 663 2HG2 THR 663 -18.502 6.676 -13.686 1148 H GLU 664 H GLU 664 -16.225 4.778 -16.317 1149 HA GLU 664 HA GLU 664 -17.360 2.425 -17.247 1150 1HB GLU 664 1HB GLU 664 -17.364 4.465 -18.583 1151 2HB GLU 664 2HB GLU 664 -15.613 4.509 -18.622 1152 1HG GLU 664 1HG GLU 664 -16.292 3.593 -20.737 1153 2HG GLU 664 2HG GLU 664 -15.670 2.242 -19.810 1154 HE2 GLU 664 HE GLU 664 -16.907 0.603 -19.870 1155 H LEU 665 H LEU 665 -13.906 3.516 -17.043 1156 HA LEU 665 HA LEU 665 -12.966 0.996 -18.027 1157 1HB LEU 665 1HB LEU 665 -11.917 3.279 -18.375 1158 2HB LEU 665 2HB LEU 665 -11.378 3.194 -16.710 1159 HG LEU 665 HG LEU 665 -9.636 2.558 -18.343 1160 1HD1 LEU 665 1HD1 LEU 665 -10.048 1.519 -15.919 1161 2HD1 LEU 665 2HD1 LEU 665 -10.159 0.022 -16.875 1162 3HD1 LEU 665 3HD1 LEU 665 -8.691 1.025 -16.959 1163 1HD2 LEU 665 3HD2 LEU 665 -11.170 1.523 -20.005 1164 2HD2 LEU 665 1HD2 LEU 665 -9.750 0.522 -19.615 1165 3HD2 LEU 665 2HD2 LEU 665 -11.339 0.121 -18.921 1166 H ASN 666 H ASN 666 -13.789 2.445 -14.923 1167 HA ASN 666 HA ASN 666 -12.194 0.771 -13.360 1168 1HB ASN 666 1HB ASN 666 -13.670 2.974 -12.827 1169 2HB ASN 666 2HB ASN 666 -14.864 1.781 -12.357 1170 1HD2 ASN 666 1HD2 ASN 666 -13.037 3.771 -10.939 1171 2HD2 ASN 666 2HD2 ASN 666 -12.318 2.877 -9.641 1172 H ASN 667 H ASN 667 -15.685 0.729 -14.384 1173 HA ASN 667 HA ASN 667 -16.356 -1.582 -13.030 1174 1HB ASN 667 1HB ASN 667 -17.495 -0.445 -15.639 1175 2HB ASN 667 2HB ASN 667 -18.287 -1.670 -14.668 1176 1HD2 ASN 667 1HD2 ASN 667 -18.884 1.193 -15.439 1177 2HD2 ASN 667 2HD2 ASN 667 -19.299 1.994 -13.960 1178 H ALA 668 H ALA 668 -15.372 -0.964 -16.481 1179 HA ALA 668 HA ALA 668 -15.558 -3.520 -17.453 1180 1HB ALA 668 1HB ALA 668 -14.867 -1.142 -18.475 1181 2HB ALA 668 2HB ALA 668 -13.232 -1.816 -18.273 1182 3HB ALA 668 3HB ALA 668 -14.430 -2.672 -19.274 1183 H LEU 669 H LEU 669 -12.897 -1.959 -15.582 1184 HA LEU 669 HA LEU 669 -11.098 -4.088 -15.818 1185 1HB LEU 669 1HB LEU 669 -11.353 -1.593 -14.338 1186 2HB LEU 669 2HB LEU 669 -10.576 -2.845 -13.390 1187 HG LEU 669 HG LEU 669 -9.628 -2.351 -16.193 1188 1HD1 LEU 669 2HD1 LEU 669 -9.882 -0.148 -14.836 1189 2HD1 LEU 669 3HD1 LEU 669 -8.475 -0.751 -13.926 1190 3HD1 LEU 669 1HD1 LEU 669 -8.354 -0.489 -15.683 1191 1HD2 LEU 669 2HD2 LEU 669 -8.877 -4.216 -14.491 1192 2HD2 LEU 669 3HD2 LEU 669 -7.696 -3.392 -15.537 1193 3HD2 LEU 669 1HD2 LEU 669 -7.872 -2.902 -13.834 1194 H GLN 670 H GLN 670 -13.738 -3.360 -13.483 1195 HA GLN 670 HA GLN 670 -13.119 -5.392 -11.713 1196 1HB GLN 670 1HB GLN 670 -15.504 -3.694 -12.322 1197 2HB GLN 670 2HB GLN 670 -15.825 -5.167 -11.430 1198 1HG GLN 670 1HG GLN 670 -13.516 -4.101 -10.197 1199 2HG GLN 670 2HG GLN 670 -14.512 -2.698 -10.528 1200 1HE2 GLN 670 1HE2 GLN 670 -13.768 -4.236 -8.051 1201 2HE2 GLN 670 2HE2 GLN 670 -15.260 -4.559 -7.231 1202 H ASN 671 H ASN 671 -15.402 -5.309 -14.534 1203 HA ASN 671 HA ASN 671 -16.143 -7.992 -14.193 1204 1HB ASN 671 1HB ASN 671 -17.296 -6.001 -15.527 1205 2HB ASN 671 2HB ASN 671 -16.276 -6.521 -16.853 1206 1HD2 ASN 671 1HD2 ASN 671 -17.818 -7.308 -18.167 1207 2HD2 ASN 671 2HD2 ASN 671 -18.807 -8.690 -17.832 1208 H LEU 672 H LEU 672 -13.483 -6.257 -15.738 1209 HA LEU 672 HA LEU 672 -12.787 -8.350 -17.554 1210 1HB LEU 672 1HB LEU 672 -12.254 -6.154 -18.199 1211 2HB LEU 672 2HB LEU 672 -11.502 -5.782 -16.661 1212 HG LEU 672 HG LEU 672 -9.949 -6.099 -18.630 1213 1HD1 LEU 672 1HD1 LEU 672 -9.391 -6.302 -16.120 1214 2HD1 LEU 672 2HD1 LEU 672 -9.295 -8.051 -16.433 1215 3HD1 LEU 672 3HD1 LEU 672 -8.223 -6.931 -17.307 1216 1HD2 LEU 672 3HD2 LEU 672 -11.286 -8.165 -19.420 1217 2HD2 LEU 672 1HD2 LEU 672 -9.511 -8.183 -19.561 1218 3HD2 LEU 672 2HD2 LEU 672 -10.308 -9.060 -18.232 1219 H ALA 673 H ALA 673 -11.781 -7.255 -14.278 1220 HA ALA 673 HA ALA 673 -9.758 -9.304 -14.143 1221 1HB ALA 673 1HB ALA 673 -10.105 -6.826 -12.990 1222 2HB ALA 673 2HB ALA 673 -10.586 -7.916 -11.668 1223 3HB ALA 673 3HB ALA 673 -8.975 -8.072 -12.408 1224 H ARG 674 H ARG 674 -13.172 -9.018 -13.651 1225 HA ARG 674 HA ARG 674 -13.388 -10.833 -11.534 1226 1HB ARG 674 1HB ARG 674 -15.257 -9.615 -13.566 1227 2HB ARG 674 2HB ARG 674 -15.825 -11.033 -12.707 1228 1HG ARG 674 1HG ARG 674 -14.545 -9.081 -10.900 1229 2HG ARG 674 2HG ARG 674 -15.899 -8.385 -11.768 1230 1HD ARG 674 1HD ARG 674 -16.421 -11.117 -10.701 1231 2HD ARG 674 2HD ARG 674 -16.115 -9.914 -9.464 1232 HE ARG 674 HE ARG 674 -18.046 -8.676 -10.188 1233 2HH1 ARG 674 1HH ARG 674 -20.676 -9.875 -12.113 1234 1HH2 ARG 674 2HH2 ARG 674 -17.557 -11.631 -12.081 1235 2HH2 ARG 674 1HH2 ARG 674 -19.162 -11.626 -12.733 1236 H THR 675 H THR 675 -13.053 -11.103 -15.056 1237 HA THR 675 HA THR 675 -13.581 -13.990 -14.890 1238 HB THR 675 HB THR 675 -13.392 -12.145 -17.328 1239 HG1 THR 675 1HG THR 675 -15.606 -11.892 -16.950 1240 1HG2 THR 675 3HG2 THR 675 -13.214 -14.791 -17.501 1241 2HG2 THR 675 1HG2 THR 675 -14.946 -14.743 -17.092 1242 3HG2 THR 675 2HG2 THR 675 -14.354 -13.927 -18.559 1243 H ILE 676 H ILE 676 -11.063 -11.740 -14.749 1244 HA ILE 676 HA ILE 676 -9.210 -13.538 -16.115 1245 HB ILE 676 HB ILE 676 -9.142 -10.667 -15.270 1246 1HG1 ILE 676 1HG1 ILE 676 -8.708 -12.186 -17.846 1247 2HG1 ILE 676 2HG1 ILE 676 -9.969 -11.029 -17.469 1248 1HG2 ILE 676 2HG2 ILE 676 -6.897 -12.508 -15.145 1249 2HG2 ILE 676 3HG2 ILE 676 -6.617 -11.198 -16.317 1250 3HG2 ILE 676 1HG2 ILE 676 -7.018 -10.810 -14.627 1251 1HD1 ILE 676 3HD1 ILE 676 -7.915 -9.382 -17.042 1252 2HD1 ILE 676 1HD1 ILE 676 -7.059 -10.535 -18.093 1253 3HD1 ILE 676 2HD1 ILE 676 -8.504 -9.686 -18.694 1254 H SER 677 H SER 677 -9.656 -11.805 -12.956 1255 HA SER 677 HA SER 677 -7.579 -12.772 -11.602 1256 1HB SER 677 1HB SER 677 -9.054 -11.252 -10.507 1257 2HB SER 677 2HB SER 677 -10.447 -12.288 -10.743 1258 HG SER 677 HG SER 677 -8.662 -12.239 -8.655 1259 H GLU 678 H GLU 678 -10.440 -14.557 -12.706 1260 HA GLU 678 HA GLU 678 -10.206 -16.727 -10.990 1261 1HB GLU 678 1HB GLU 678 -11.605 -17.912 -12.697 1262 2HB GLU 678 2HB GLU 678 -12.242 -16.337 -12.265 1263 1HG GLU 678 1HG GLU 678 -10.819 -15.477 -14.326 1264 2HG GLU 678 2HG GLU 678 -10.817 -17.161 -14.812 1265 HE2 GLU 678 HE GLU 678 -13.795 -16.668 -16.332 1266 H ALA 679 H ALA 679 -8.518 -15.803 -13.978 1267 HA ALA 679 HA ALA 679 -7.558 -18.104 -14.962 1268 1HB ALA 679 2HB ALA 679 -5.670 -15.807 -14.427 1269 2HB ALA 679 3HB ALA 679 -5.830 -16.818 -15.883 1270 3HB ALA 679 1HB ALA 679 -7.065 -15.592 -15.511 1271 H GLY 680 H GLY 680 -6.790 -16.631 -11.816 1272 1HA GLY 680 2HA GLY 680 -5.790 -17.527 -10.005 1273 2HA GLY 680 1HA GLY 680 -4.448 -17.810 -11.097 1274 H GLN 681 H GLN 681 -7.450 -19.234 -9.730 1275 HA GLN 681 HA GLN 681 -6.372 -21.840 -10.480 1276 1HB GLN 681 1HB GLN 681 -7.233 -20.765 -7.852 1277 2HB GLN 681 2HB GLN 681 -7.904 -22.340 -8.226 1278 1HG GLN 681 1HG GLN 681 -4.973 -21.940 -8.776 1279 2HG GLN 681 2HG GLN 681 -5.460 -22.029 -7.095 1280 1HE2 GLN 681 1HE2 GLN 681 -3.865 -23.871 -8.660 1281 2HE2 GLN 681 2HE2 GLN 681 -4.643 -25.418 -8.613 1282 H ALA 682 H ALA 682 -9.262 -19.799 -9.851 1283 HA ALA 682 HA ALA 682 -11.298 -21.524 -10.214 1284 1HB ALA 682 1HB ALA 682 -10.809 -18.657 -10.965 1285 2HB ALA 682 2HB ALA 682 -12.302 -19.441 -11.535 1286 3HB ALA 682 3HB ALA 682 -11.956 -19.347 -9.792 1287 H MET 683 H MET 683 -9.847 -19.634 -12.966 1288 HA MET 683 HA MET 683 -11.066 -20.810 -14.998 1289 1HB MET 683 1HB MET 683 -9.309 -19.009 -15.137 1290 2HB MET 683 2HB MET 683 -8.064 -20.196 -14.801 1291 1HG MET 683 1HG MET 683 -9.939 -20.635 -17.143 1292 2HG MET 683 2HG MET 683 -8.602 -19.515 -17.311 1293 1HE MET 683 3HE MET 683 -9.020 -21.760 -19.080 1294 2HE MET 683 1HE MET 683 -7.874 -23.117 -18.969 1295 3HE MET 683 2HE MET 683 -9.417 -23.181 -18.084 1296 H ALA 684 H ALA 684 -8.715 -22.336 -12.856 1297 HA ALA 684 HA ALA 684 -8.360 -24.578 -14.670 1298 1HB ALA 684 2HB ALA 684 -6.562 -25.161 -13.319 1299 2HB ALA 684 3HB ALA 684 -6.591 -23.395 -13.096 1300 3HB ALA 684 1HB ALA 684 -7.296 -24.460 -11.856 1301 H SER 685 H SER 685 -9.799 -23.762 -11.456 1302 HA SER 685 HA SER 685 -10.573 -26.260 -10.730 1303 1HB SER 685 1HB SER 685 -11.784 -23.520 -10.265 1304 2HB SER 685 2HB SER 685 -12.557 -24.947 -9.604 1305 HG SER 685 HG SER 685 -11.079 -25.023 -8.063 1306 H THR 686 H THR 686 -13.198 -23.986 -11.655 1307 HA THR 686 HA THR 686 -13.998 -25.391 -13.976 1308 HB THR 686 HB THR 686 -15.094 -26.227 -11.287 1309 HG1 THR 686 1HG THR 686 -14.101 -27.937 -12.293 1310 1HG2 THR 686 3HG2 THR 686 -17.087 -25.292 -12.549 1311 2HG2 THR 686 1HG2 THR 686 -16.663 -26.352 -13.914 1312 3HG2 THR 686 2HG2 THR 686 -17.154 -27.060 -12.357 1313 H GLU 687 H GLU 687 -15.985 -24.511 -14.911 1314 HA GLU 687 HA GLU 687 -16.259 -21.774 -14.026 1315 1HB GLU 687 1HB GLU 687 -15.755 -22.136 -16.399 1316 2HB GLU 687 2HB GLU 687 -17.140 -23.196 -16.575 1317 1HG GLU 687 1HG GLU 687 -17.961 -21.143 -17.399 1318 2HG GLU 687 2HG GLU 687 -18.561 -21.156 -15.752 1319 HE2 GLU 687 HE GLU 687 -16.936 -18.542 -17.472 1320 H GLY 688 H GLY 688 -17.978 -21.133 -12.802 1321 1HA GLY 688 2HA GLY 688 -20.506 -22.622 -13.087 1322 2HA GLY 688 1HA GLY 688 -20.327 -20.972 -12.526 1323 H ASN 689 H ASN 689 -17.807 -22.967 -11.297 1324 HA ASN 689 HA ASN 689 -19.377 -23.645 -8.956 1325 1HB ASN 689 1HB ASN 689 -18.003 -25.452 -10.024 1326 2HB ASN 689 2HB ASN 689 -16.555 -24.490 -9.802 1327 1HD2 ASN 689 1HD2 ASN 689 -15.364 -25.080 -8.173 1328 2HD2 ASN 689 2HD2 ASN 689 -15.891 -25.741 -6.661 1329 H VAL 690 H VAL 690 -16.618 -21.740 -10.200 1330 HA VAL 690 HA VAL 690 -15.836 -20.914 -7.534 1331 HB VAL 690 HB VAL 690 -14.116 -19.627 -8.794 1332 1HG1 VAL 690 1HG1 VAL 690 -14.433 -22.561 -8.749 1333 2HG1 VAL 690 2HG1 VAL 690 -13.230 -21.963 -9.917 1334 3HG1 VAL 690 3HG1 VAL 690 -13.084 -21.540 -8.194 1335 1HG2 VAL 690 2HG2 VAL 690 -15.844 -20.054 -10.976 1336 2HG2 VAL 690 3HG2 VAL 690 -14.240 -19.282 -10.995 1337 3HG2 VAL 690 1HG2 VAL 690 -14.392 -21.027 -11.312 1338 H THR 691 H THR 691 -17.261 -19.525 -6.577 1339 HA THR 691 HA THR 691 -17.839 -17.067 -8.054 1340 HB THR 691 HB THR 691 -19.868 -18.966 -6.777 1341 HG1 THR 691 1HG THR 691 -20.672 -18.731 -9.004 1342 1HG2 THR 691 1HG2 THR 691 -20.062 -16.026 -7.542 1343 2HG2 THR 691 2HG2 THR 691 -21.475 -17.096 -7.705 1344 3HG2 THR 691 3HG2 THR 691 -20.730 -16.843 -6.108 1345 H GLY 692 H GLY 692 -18.120 -18.834 -4.905 1346 1HA GLY 692 2HA GLY 692 -17.469 -18.179 -2.844 1347 2HA GLY 692 1HA GLY 692 -18.462 -16.775 -3.181 1348 H MET 693 H MET 693 -15.373 -17.781 -4.779 1349 HA MET 693 HA MET 693 -13.654 -16.240 -3.360 1350 1HB MET 693 1HB MET 693 -13.773 -17.557 -5.991 1351 2HB MET 693 2HB MET 693 -12.818 -16.091 -6.089 1352 1HG MET 693 1HG MET 693 -12.177 -17.620 -3.657 1353 2HG MET 693 2HG MET 693 -11.960 -18.595 -5.097 1354 1HE MET 693 3HE MET 693 -9.400 -18.743 -4.513 1355 2HE MET 693 1HE MET 693 -8.339 -17.331 -4.295 1356 3HE MET 693 2HE MET 693 -9.612 -17.681 -3.101 1357 H PHE 694 H PHE 694 -14.885 -15.281 -6.650 1358 HA PHE 694 HA PHE 694 -14.809 -12.507 -5.687 1359 1HB PHE 694 1HB PHE 694 -14.539 -12.185 -8.318 1360 2HB PHE 694 2HB PHE 694 -13.141 -12.695 -7.393 1361 HD1 PHE 694 1HD PHE 694 -15.847 -13.899 -9.603 1362 HD2 PHE 694 2HD PHE 694 -12.129 -14.806 -7.769 1363 HE1 PHE 694 1HE PHE 694 -15.627 -15.934 -11.056 1364 HE2 PHE 694 2HE PHE 694 -11.909 -16.841 -9.222 1365 HZ PHE 694 HZ PHE 694 -13.661 -17.381 -10.848 1366 H ALA 695 H ALA 695 -16.599 -11.196 -6.067 1367 HA ALA 695 HA ALA 695 -18.785 -10.823 -6.281 1368 1HB ALA 695 3HB ALA 695 -18.023 -11.991 -8.979 1369 2HB ALA 695 1HB ALA 695 -19.609 -11.248 -8.665 1370 3HB ALA 695 2HB ALA 695 -18.126 -10.276 -8.512 No H/Q in entry = 1370 Start of MODEL 12 1 H ALA 1 H ALA 1 -12.367 35.815 -2.623 2 HA ALA 1 HA ALA 1 -10.292 34.068 -3.696 3 1HB ALA 1 2HB ALA 1 -11.500 32.315 -2.860 4 2HB ALA 1 1HB ALA 1 -12.490 32.607 -4.310 5 3HB ALA 1 3HB ALA 1 -12.999 33.266 -2.737 6 H GLU 2 H GLU 2 -9.836 34.895 -5.669 7 HA GLU 2 HA GLU 2 -12.112 35.939 -7.167 8 1HB GLU 2 1HB GLU 2 -9.590 37.225 -6.430 9 2HB GLU 2 2HB GLU 2 -9.779 37.189 -8.172 10 1HG GLU 2 1HG GLU 2 -12.263 37.927 -6.716 11 2HG GLU 2 2HG GLU 2 -10.944 39.056 -6.476 12 HE2 GLU 2 HE GLU 2 -12.068 40.514 -7.708 13 H MET 3 H MET 3 -8.647 34.897 -7.610 14 HA MET 3 HA MET 3 -9.616 33.196 -9.765 15 1HB MET 3 1HB MET 3 -7.485 35.341 -9.787 16 2HB MET 3 2HB MET 3 -7.148 33.890 -10.710 17 1HG MET 3 1HG MET 3 -9.868 34.657 -11.281 18 2HG MET 3 2HG MET 3 -8.879 36.098 -11.412 19 1HE MET 3 2HE MET 3 -9.716 36.213 -13.553 20 2HE MET 3 3HE MET 3 -8.646 35.795 -14.912 21 3HE MET 3 1HE MET 3 -10.034 34.752 -14.519 22 H LYS 4 H LYS 4 -9.338 31.188 -8.826 23 HA LYS 4 HA LYS 4 -6.845 30.723 -7.380 24 1HB LYS 4 1HB LYS 4 -7.937 28.802 -6.434 25 2HB LYS 4 2HB LYS 4 -8.994 30.189 -6.269 26 1HG LYS 4 1HG LYS 4 -9.804 29.217 -8.723 27 2HG LYS 4 2HG LYS 4 -9.337 27.730 -7.922 28 1HD LYS 4 1HD LYS 4 -11.094 29.749 -6.487 29 2HD LYS 4 2HD LYS 4 -11.799 28.627 -7.634 30 1HE LYS 4 1HE LYS 4 -11.990 27.381 -5.669 31 2HE LYS 4 2HE LYS 4 -10.445 26.798 -6.255 32 H THR 5 H THR 5 -7.949 30.640 -10.516 33 HA THR 5 HA THR 5 -7.002 28.063 -11.302 34 HB THR 5 HB THR 5 -8.770 29.291 -12.536 35 HG1 THR 5 1HG THR 5 -7.644 29.037 -14.615 36 1HG2 THR 5 3HG2 THR 5 -7.246 31.577 -12.124 37 2HG2 THR 5 1HG2 THR 5 -6.831 31.161 -13.804 38 3HG2 THR 5 2HG2 THR 5 -8.530 31.435 -13.349 39 H ASP 6 H ASP 6 -5.352 30.654 -10.040 40 HA ASP 6 HA ASP 6 -3.358 31.372 -11.549 41 1HB ASP 6 1HB ASP 6 -3.190 30.218 -8.732 42 2HB ASP 6 2HB ASP 6 -1.821 31.004 -9.494 43 HD2 ASP 6 HD ASP 6 -4.135 31.488 -7.451 44 H ALA 7 H ALA 7 -1.592 30.435 -12.660 45 HA ALA 7 HA ALA 7 -1.591 27.676 -13.112 46 1HB ALA 7 2HB ALA 7 0.107 30.039 -13.808 47 2HB ALA 7 3HB ALA 7 0.839 28.428 -13.997 48 3HB ALA 7 1HB ALA 7 -0.661 28.831 -14.866 49 H ALA 8 H ALA 8 -0.122 29.708 -10.633 50 HA ALA 8 HA ALA 8 1.957 27.945 -9.913 51 1HB ALA 8 2HB ALA 8 2.338 30.022 -9.034 52 2HB ALA 8 1HB ALA 8 1.457 29.342 -7.644 53 3HB ALA 8 3HB ALA 8 0.605 30.369 -8.823 54 H THR 9 H THR 9 -1.473 28.357 -8.873 55 HA THR 9 HA THR 9 -1.251 26.292 -6.892 56 HB THR 9 HB THR 9 -2.928 28.469 -7.398 57 HG1 THR 9 1HG THR 9 -3.907 27.552 -5.475 58 1HG2 THR 9 3HG2 THR 9 -4.360 25.834 -8.004 59 2HG2 THR 9 1HG2 THR 9 -5.208 27.292 -7.435 60 3HG2 THR 9 2HG2 THR 9 -4.359 27.309 -9.000 61 H LEU 10 H LEU 10 -2.463 26.556 -10.266 62 HA LEU 10 HA LEU 10 -3.649 24.045 -10.367 63 1HB LEU 10 1HB LEU 10 -2.414 25.814 -12.471 64 2HB LEU 10 2HB LEU 10 -3.203 24.298 -12.856 65 HG LEU 10 HG LEU 10 -4.402 26.849 -11.815 66 1HD1 LEU 10 3HD1 LEU 10 -4.244 26.393 -14.258 67 2HD1 LEU 10 1HD1 LEU 10 -5.292 24.974 -14.020 68 3HD1 LEU 10 2HD1 LEU 10 -5.910 26.605 -13.668 69 1HD2 LEU 10 3HD2 LEU 10 -5.650 24.098 -11.582 70 2HD2 LEU 10 1HD2 LEU 10 -5.238 25.214 -10.258 71 3HD2 LEU 10 2HD2 LEU 10 -6.531 25.635 -11.407 72 H ALA 11 H ALA 11 -0.313 25.074 -11.380 73 HA ALA 11 HA ALA 11 0.572 22.533 -12.043 74 1HB ALA 11 2HB ALA 11 1.567 25.015 -12.260 75 2HB ALA 11 1HB ALA 11 2.608 23.573 -12.320 76 3HB ALA 11 3HB ALA 11 2.463 24.503 -10.810 77 H GLN 12 H GLN 12 0.129 24.143 -8.908 78 HA GLN 12 HA GLN 12 1.798 22.466 -7.445 79 1HB GLN 12 1HB GLN 12 0.613 24.733 -6.821 80 2HB GLN 12 2HB GLN 12 -0.715 23.714 -6.302 81 1HG GLN 12 1HG GLN 12 0.374 23.138 -4.395 82 2HG GLN 12 2HG GLN 12 1.792 22.629 -5.289 83 1HE2 GLN 12 1HE2 GLN 12 0.254 25.140 -3.495 84 2HE2 GLN 12 2HE2 GLN 12 1.576 26.255 -3.406 85 H GLU 13 H GLU 13 -1.581 22.190 -8.574 86 HA GLU 13 HA GLU 13 -1.830 19.716 -7.082 87 1HB GLU 13 1HB GLU 13 -3.897 21.338 -8.632 88 2HB GLU 13 2HB GLU 13 -4.247 19.851 -7.773 89 1HG GLU 13 1HG GLU 13 -4.596 21.096 -5.909 90 2HG GLU 13 2HG GLU 13 -2.874 21.421 -5.874 91 HE2 GLU 13 HE GLU 13 -3.991 24.690 -5.963 92 H ALA 14 H ALA 14 -1.693 21.088 -10.382 93 HA ALA 14 HA ALA 14 -2.469 18.787 -11.767 94 1HB ALA 14 2HB ALA 14 -2.080 21.303 -12.484 95 2HB ALA 14 3HB ALA 14 -0.438 20.726 -12.854 96 3HB ALA 14 1HB ALA 14 -1.843 19.987 -13.658 97 H GLY 15 H GLY 15 0.785 20.032 -10.761 98 1HA GLY 15 2HA GLY 15 2.701 18.922 -10.346 99 2HA GLY 15 1HA GLY 15 2.417 18.168 -11.903 100 H ASN 16 H ASN 16 0.197 17.778 -9.122 101 HA ASN 16 HA ASN 16 1.378 15.271 -8.430 102 1HB ASN 16 1HB ASN 16 0.486 16.208 -6.493 103 2HB ASN 16 2HB ASN 16 -0.771 17.067 -7.362 104 1HD2 ASN 16 1HD2 ASN 16 -2.638 16.474 -6.564 105 2HD2 ASN 16 2HD2 ASN 16 -3.193 14.857 -6.287 106 H PHE 17 H PHE 17 -1.241 16.599 -10.408 107 HA PHE 17 HA PHE 17 -2.783 14.214 -10.532 108 1HB PHE 17 1HB PHE 17 -3.704 16.492 -10.940 109 2HB PHE 17 2HB PHE 17 -2.528 16.779 -12.208 110 HD1 PHE 17 1HD PHE 17 -3.080 16.330 -14.424 111 HD2 PHE 17 2HD PHE 17 -5.380 14.554 -11.332 112 HE1 PHE 17 1HE PHE 17 -4.709 15.471 -16.130 113 HE2 PHE 17 2HE PHE 17 -7.009 13.695 -13.038 114 HZ PHE 17 HZ PHE 17 -6.654 14.164 -15.416 115 H GLU 18 H GLU 18 -0.605 15.921 -12.897 116 HA GLU 18 HA GLU 18 -0.729 14.319 -14.978 117 1HB GLU 18 1HB GLU 18 1.588 15.734 -13.680 118 2HB GLU 18 2HB GLU 18 1.934 14.676 -15.033 119 1HG GLU 18 1HG GLU 18 -0.391 16.296 -15.674 120 2HG GLU 18 2HG GLU 18 0.894 17.346 -15.111 121 HE2 GLU 18 HE GLU 18 1.030 16.208 -18.736 122 H ARG 19 H ARG 19 0.905 13.548 -11.878 123 HA ARG 19 HA ARG 19 2.173 11.256 -12.797 124 1HB ARG 19 1HB ARG 19 2.166 12.705 -10.447 125 2HB ARG 19 2HB ARG 19 1.262 11.290 -9.947 126 1HG ARG 19 1HG ARG 19 3.071 9.797 -10.574 127 2HG ARG 19 2HG ARG 19 3.924 11.075 -11.417 128 1HD ARG 19 1HD ARG 19 3.607 12.132 -8.838 129 2HD ARG 19 2HD ARG 19 3.894 10.431 -8.531 130 HE ARG 19 HE ARG 19 5.746 11.553 -10.499 131 2HH1 ARG 19 1HH ARG 19 8.455 11.613 -8.326 132 1HH2 ARG 19 2HH2 ARG 19 5.157 11.100 -7.034 133 2HH2 ARG 19 1HH2 ARG 19 6.830 11.239 -6.605 134 H ILE 20 H ILE 20 -1.005 11.835 -11.156 135 HA ILE 20 HA ILE 20 -1.732 9.165 -10.877 136 HB ILE 20 HB ILE 20 -3.461 11.616 -11.242 137 1HG1 ILE 20 1HG1 ILE 20 -2.789 10.372 -8.593 138 2HG1 ILE 20 2HG1 ILE 20 -1.636 11.454 -9.348 139 1HG2 ILE 20 3HG2 ILE 20 -4.433 9.180 -11.485 140 2HG2 ILE 20 1HG2 ILE 20 -4.317 9.193 -9.709 141 3HG2 ILE 20 2HG2 ILE 20 -5.291 10.425 -10.546 142 1HD1 ILE 20 3HD1 ILE 20 -3.987 12.871 -9.681 143 2HD1 ILE 20 1HD1 ILE 20 -4.269 12.057 -8.123 144 3HD1 ILE 20 2HD1 ILE 20 -2.846 13.105 -8.334 145 H SER 21 H SER 21 -2.259 11.517 -13.571 146 HA SER 21 HA SER 21 -3.833 9.877 -15.106 147 1HB SER 21 1HB SER 21 -2.916 11.287 -17.045 148 2HB SER 21 2HB SER 21 -3.658 12.171 -15.726 149 HG SER 21 HG SER 21 -1.659 13.159 -16.312 150 H GLY 22 H GLY 22 -0.232 10.403 -15.251 151 1HA GLY 22 2HA GLY 22 1.436 9.070 -15.950 152 2HA GLY 22 1HA GLY 22 0.368 8.601 -17.258 153 H ASP 23 H ASP 23 0.598 8.017 -13.668 154 HA ASP 23 HA ASP 23 1.239 5.407 -13.787 155 1HB ASP 23 1HB ASP 23 1.028 6.881 -11.728 156 2HB ASP 23 2HB ASP 23 -0.709 6.659 -11.795 157 HD2 ASP 23 HD ASP 23 0.611 5.331 -9.346 158 H LEU 24 H LEU 24 -2.075 6.908 -13.636 159 HA LEU 24 HA LEU 24 -3.586 4.629 -13.589 160 1HB LEU 24 1HB LEU 24 -4.310 7.019 -13.347 161 2HB LEU 24 2HB LEU 24 -4.248 7.161 -15.092 162 HG LEU 24 HG LEU 24 -5.877 5.099 -15.048 163 1HD1 LEU 24 1HD1 LEU 24 -5.526 5.000 -12.465 164 2HD1 LEU 24 2HD1 LEU 24 -6.745 6.297 -12.436 165 3HD1 LEU 24 3HD1 LEU 24 -7.142 4.718 -13.156 166 1HD2 LEU 24 2HD2 LEU 24 -6.421 8.009 -14.671 167 2HD2 LEU 24 3HD2 LEU 24 -6.782 6.938 -16.046 168 3HD2 LEU 24 1HD2 LEU 24 -7.792 6.877 -14.582 169 H LYS 25 H LYS 25 -1.926 6.208 -16.346 170 HA LYS 25 HA LYS 25 -3.143 4.523 -18.285 171 1HB LYS 25 1HB LYS 25 -0.583 6.115 -18.564 172 2HB LYS 25 2HB LYS 25 -1.657 5.578 -19.840 173 1HG LYS 25 1HG LYS 25 -3.183 7.092 -17.879 174 2HG LYS 25 2HG LYS 25 -1.782 8.026 -18.365 175 1HD LYS 25 1HD LYS 25 -3.483 6.657 -20.471 176 2HD LYS 25 2HD LYS 25 -4.012 8.178 -19.780 177 1HE LYS 25 1HE LYS 25 -1.274 7.740 -21.066 178 2HE LYS 25 2HE LYS 25 -2.649 8.443 -21.895 179 H THR 26 H THR 26 0.012 4.562 -16.522 180 HA THR 26 HA THR 26 1.202 2.428 -17.807 181 HB THR 26 HB THR 26 1.391 3.836 -15.163 182 HG1 THR 26 1HG THR 26 3.391 4.239 -16.162 183 1HG2 THR 26 2HG2 THR 26 2.343 1.006 -15.668 184 2HG2 THR 26 3HG2 THR 26 3.428 2.129 -14.814 185 3HG2 THR 26 1HG2 THR 26 1.823 1.757 -14.140 186 H GLN 27 H GLN 27 -1.251 2.431 -15.187 187 HA GLN 27 HA GLN 27 -1.047 -0.346 -14.794 188 1HB GLN 27 1HB GLN 27 -3.398 1.476 -14.125 189 2HB GLN 27 2HB GLN 27 -3.040 -0.077 -13.396 190 1HG GLN 27 1HG GLN 27 -0.961 2.126 -13.299 191 2HG GLN 27 2HG GLN 27 -2.306 2.163 -12.177 192 1HE2 GLN 27 1HE2 GLN 27 0.667 1.640 -11.971 193 2HE2 GLN 27 2HE2 GLN 27 0.818 0.185 -11.044 194 H ILE 28 H ILE 28 -3.336 1.792 -16.616 195 HA ILE 28 HA ILE 28 -5.079 -0.164 -17.468 196 HB ILE 28 HB ILE 28 -4.195 2.460 -18.639 197 1HG1 ILE 28 1HG1 ILE 28 -6.798 1.607 -17.340 198 2HG1 ILE 28 2HG1 ILE 28 -5.488 2.413 -16.500 199 1HG2 ILE 28 1HG2 ILE 28 -5.691 0.330 -19.960 200 2HG2 ILE 28 2HG2 ILE 28 -6.604 1.855 -19.858 201 3HG2 ILE 28 3HG2 ILE 28 -4.996 1.830 -20.620 202 1HD1 ILE 28 2HD1 ILE 28 -5.690 4.180 -18.482 203 2HD1 ILE 28 3HD1 ILE 28 -7.326 3.495 -18.636 204 3HD1 ILE 28 1HD1 ILE 28 -6.814 4.241 -17.103 205 H ASP 29 H ASP 29 -1.974 0.969 -18.936 206 HA ASP 29 HA ASP 29 -2.152 -0.619 -21.183 207 1HB ASP 29 1HB ASP 29 -0.382 1.247 -20.199 208 2HB ASP 29 2HB ASP 29 0.559 -0.216 -19.987 209 HD2 ASP 29 HD ASP 29 1.482 0.995 -23.178 210 H GLN 30 H GLN 30 -0.791 -1.154 -17.877 211 HA GLN 30 HA GLN 30 0.509 -3.513 -18.338 212 1HB GLN 30 1HB GLN 30 -0.716 -2.169 -15.957 213 2HB GLN 30 2HB GLN 30 -0.339 -3.871 -15.777 214 1HG GLN 30 1HG GLN 30 1.996 -3.516 -16.289 215 2HG GLN 30 2HG GLN 30 1.697 -1.896 -16.888 216 1HE2 GLN 30 1HE2 GLN 30 3.015 -0.820 -15.528 217 2HE2 GLN 30 2HE2 GLN 30 2.779 -0.676 -13.818 218 H VAL 31 H VAL 31 -2.964 -2.883 -17.604 219 HA VAL 31 HA VAL 31 -3.646 -5.620 -17.381 220 HB VAL 31 HB VAL 31 -5.165 -3.050 -17.766 221 1HG1 VAL 31 1HG1 VAL 31 -6.360 -4.890 -18.957 222 2HG1 VAL 31 2HG1 VAL 31 -6.415 -5.795 -17.425 223 3HG1 VAL 31 3HG1 VAL 31 -7.261 -4.236 -17.568 224 1HG2 VAL 31 2HG2 VAL 31 -4.036 -4.183 -15.537 225 2HG2 VAL 31 3HG2 VAL 31 -5.401 -3.041 -15.526 226 3HG2 VAL 31 1HG2 VAL 31 -5.706 -4.793 -15.451 227 H GLU 32 H GLU 32 -4.101 -3.156 -20.016 228 HA GLU 32 HA GLU 32 -5.283 -4.722 -21.842 229 1HB GLU 32 1HB GLU 32 -3.574 -2.317 -21.894 230 2HB GLU 32 2HB GLU 32 -3.489 -3.232 -23.386 231 1HG GLU 32 1HG GLU 32 -6.174 -3.306 -23.042 232 2HG GLU 32 2HG GLU 32 -5.848 -1.839 -22.140 233 HE2 GLU 32 HE GLU 32 -5.364 0.088 -24.796 234 H SER 33 H SER 33 -1.779 -4.588 -21.022 235 HA SER 33 HA SER 33 -1.075 -6.356 -23.111 236 1HB SER 33 1HB SER 33 0.799 -5.165 -22.548 237 2HB SER 33 2HB SER 33 0.280 -4.928 -20.891 238 HG SER 33 HG SER 33 2.160 -6.592 -21.715 239 H THR 34 H THR 34 -1.271 -6.644 -19.486 240 HA THR 34 HA THR 34 -0.676 -9.338 -19.309 241 HB THR 34 HB THR 34 -2.128 -7.265 -17.669 242 HG1 THR 34 1HG THR 34 0.176 -7.546 -17.536 243 1HG2 THR 34 3HG2 THR 34 -3.439 -9.447 -17.362 244 2HG2 THR 34 1HG2 THR 34 -1.911 -10.206 -16.852 245 3HG2 THR 34 2HG2 THR 34 -2.607 -8.876 -15.895 246 H ALA 35 H ALA 35 -3.882 -7.750 -19.813 247 HA ALA 35 HA ALA 35 -5.438 -10.008 -19.674 248 1HB ALA 35 1HB ALA 35 -6.099 -8.017 -21.789 249 2HB ALA 35 3HB ALA 35 -5.845 -7.364 -20.153 250 3HB ALA 35 2HB ALA 35 -7.082 -8.613 -20.430 251 H GLY 36 H GLY 36 -3.285 -8.838 -22.273 252 1HA GLY 36 2HA GLY 36 -2.460 -9.915 -24.072 253 2HA GLY 36 1HA GLY 36 -4.140 -10.240 -24.451 254 H SER 37 H SER 37 -2.157 -11.446 -21.669 255 HA SER 37 HA SER 37 -1.800 -13.977 -22.840 256 1HB SER 37 1HB SER 37 -1.636 -13.770 -19.875 257 2HB SER 37 2HB SER 37 -0.467 -14.401 -21.017 258 HG SER 37 HG SER 37 -0.125 -12.056 -21.646 259 H LEU 38 H LEU 38 -4.391 -12.408 -21.110 260 HA LEU 38 HA LEU 38 -5.535 -14.862 -20.128 261 1HB LEU 38 1HB LEU 38 -6.215 -11.953 -20.012 262 2HB LEU 38 2HB LEU 38 -7.474 -13.133 -19.707 263 HG LEU 38 HG LEU 38 -6.807 -12.966 -17.575 264 1HD1 LEU 38 3HD1 LEU 38 -6.076 -15.238 -18.235 265 2HD1 LEU 38 1HD1 LEU 38 -4.433 -14.606 -18.501 266 3HD1 LEU 38 2HD1 LEU 38 -5.147 -14.571 -16.871 267 1HD2 LEU 38 1HD2 LEU 38 -4.129 -11.973 -18.581 268 2HD2 LEU 38 2HD2 LEU 38 -5.464 -11.011 -17.902 269 3HD2 LEU 38 3HD2 LEU 38 -4.560 -12.138 -16.862 270 H GLN 39 H GLN 39 -6.584 -12.286 -22.476 271 HA GLN 39 HA GLN 39 -8.705 -13.653 -23.480 272 1HB GLN 39 1HB GLN 39 -8.088 -12.268 -25.654 273 2HB GLN 39 2HB GLN 39 -8.603 -11.444 -24.196 274 1HG GLN 39 1HG GLN 39 -5.720 -11.924 -24.115 275 2HG GLN 39 2HG GLN 39 -6.151 -11.095 -25.597 276 1HE2 GLN 39 1HE2 GLN 39 -7.860 -10.944 -22.513 277 2HE2 GLN 39 2HE2 GLN 39 -7.576 -9.270 -22.170 278 H GLY 40 H GLY 40 -5.255 -14.178 -24.004 279 1HA GLY 40 2HA GLY 40 -4.153 -15.438 -25.580 280 2HA GLY 40 1HA GLY 40 -5.672 -15.830 -26.362 281 H GLN 41 H GLN 41 -6.163 -16.226 -23.042 282 HA GLN 41 HA GLN 41 -5.734 -19.080 -23.349 283 1HB GLN 41 1HB GLN 41 -4.625 -17.296 -21.179 284 2HB GLN 41 2HB GLN 41 -5.074 -18.941 -20.773 285 1HG GLN 41 1HG GLN 41 -2.901 -19.356 -21.438 286 2HG GLN 41 2HG GLN 41 -3.667 -19.491 -23.008 287 1HE2 GLN 41 1HE2 GLN 41 -1.566 -17.691 -20.972 288 2HE2 GLN 41 2HE2 GLN 41 -1.056 -16.483 -22.104 289 H TRP 42 H TRP 42 -7.889 -19.677 -23.446 290 HA TRP 42 HA TRP 42 -9.400 -19.446 -21.035 291 1HB TRP 42 1HB TRP 42 -10.311 -17.913 -23.474 292 2HB TRP 42 2HB TRP 42 -11.359 -18.343 -22.137 293 HD1 TRP 42 HD TRP 42 -9.454 -15.467 -23.238 294 HE1 TRP 42 1HE TRP 42 -8.837 -13.752 -21.330 295 HE3 TRP 42 3HE TRP 42 -10.429 -18.617 -19.367 296 HZ2 TRP 42 2HZ TRP 42 -8.825 -13.902 -18.480 297 HZ3 TRP 42 3HZ TRP 42 -10.089 -17.754 -17.054 298 HH2 TRP 42 HH TRP 42 -9.316 -15.484 -16.579 299 H ARG 43 H ARG 43 -11.511 -20.711 -21.318 300 HA ARG 43 HA ARG 43 -10.968 -22.827 -23.217 301 1HB ARG 43 1HB ARG 43 -12.812 -22.716 -20.777 302 2HB ARG 43 2HB ARG 43 -12.650 -24.120 -21.813 303 1HG ARG 43 1HG ARG 43 -10.108 -22.937 -20.724 304 2HG ARG 43 2HG ARG 43 -11.146 -23.768 -19.583 305 1HD ARG 43 1HD ARG 43 -10.921 -25.338 -22.036 306 2HD ARG 43 2HD ARG 43 -9.323 -24.945 -21.435 307 HE ARG 43 HE ARG 43 -11.088 -25.848 -19.300 308 2HH1 ARG 43 1HH ARG 43 -9.712 -29.029 -19.078 309 1HH2 ARG 43 2HH2 ARG 43 -8.987 -26.978 -21.920 310 2HH2 ARG 43 1HH2 ARG 43 -8.694 -28.520 -21.187 311 H GLY 44 H GLY 44 -13.600 -20.659 -21.991 312 1HA GLY 44 2HA GLY 44 -15.669 -21.527 -23.636 313 2HA GLY 44 1HA GLY 44 -14.759 -20.340 -24.551 314 H ALA 45 H ALA 45 -16.540 -20.906 -21.476 315 HA ALA 45 HA ALA 45 -17.909 -18.531 -21.536 316 1HB ALA 45 3HB ALA 45 -18.772 -19.258 -19.543 317 2HB ALA 45 1HB ALA 45 -17.949 -20.765 -20.010 318 3HB ALA 45 2HB ALA 45 -17.171 -19.645 -18.867 319 H ALA 46 H ALA 46 -15.110 -19.271 -19.328 320 HA ALA 46 HA ALA 46 -14.723 -16.720 -18.425 321 1HB ALA 46 2HB ALA 46 -12.374 -18.515 -19.009 322 2HB ALA 46 1HB ALA 46 -13.619 -19.051 -17.856 323 3HB ALA 46 3HB ALA 46 -12.723 -17.541 -17.561 324 H GLY 47 H GLY 47 -13.965 -18.139 -21.580 325 1HA GLY 47 2HA GLY 47 -13.050 -17.280 -23.445 326 2HA GLY 47 1HA GLY 47 -12.037 -16.270 -22.433 327 H THR 48 H THR 48 -15.491 -16.542 -23.537 328 HA THR 48 HA THR 48 -15.543 -13.981 -24.649 329 HB THR 48 HB THR 48 -17.945 -14.451 -24.858 330 HG1 THR 48 1HG THR 48 -17.292 -16.560 -22.923 331 1HG2 THR 48 1HG2 THR 48 -16.023 -16.249 -25.763 332 2HG2 THR 48 2HG2 THR 48 -17.085 -17.300 -24.796 333 3HG2 THR 48 3HG2 THR 48 -17.758 -16.354 -26.146 334 H ALA 49 H ALA 49 -16.136 -15.128 -21.330 335 HA ALA 49 HA ALA 49 -17.427 -12.811 -20.424 336 1HB ALA 49 1HB ALA 49 -15.929 -15.115 -19.185 337 2HB ALA 49 3HB ALA 49 -17.644 -14.664 -19.029 338 3HB ALA 49 2HB ALA 49 -16.396 -13.727 -18.174 339 H ALA 50 H ALA 50 -13.950 -13.859 -20.257 340 HA ALA 50 HA ALA 50 -13.113 -11.382 -19.165 341 1HB ALA 50 2HB ALA 50 -10.965 -12.335 -19.231 342 2HB ALA 50 3HB ALA 50 -12.029 -13.754 -19.078 343 3HB ALA 50 1HB ALA 50 -11.342 -13.323 -20.662 344 H GLN 51 H GLN 51 -12.858 -12.887 -22.463 345 HA GLN 51 HA GLN 51 -11.562 -10.899 -23.721 346 1HB GLN 51 1HB GLN 51 -12.031 -12.891 -24.934 347 2HB GLN 51 2HB GLN 51 -13.756 -12.776 -24.648 348 1HG GLN 51 1HG GLN 51 -12.608 -10.429 -26.072 349 2HG GLN 51 2HG GLN 51 -12.469 -11.935 -26.956 350 1HE2 GLN 51 1HE2 GLN 51 -14.505 -9.418 -25.913 351 2HE2 GLN 51 2HE2 GLN 51 -16.014 -9.988 -26.542 352 H ALA 52 H ALA 52 -15.174 -11.177 -23.371 353 HA ALA 52 HA ALA 52 -15.750 -8.745 -24.601 354 1HB ALA 52 2HB ALA 52 -17.341 -10.624 -24.137 355 2HB ALA 52 1HB ALA 52 -17.952 -9.039 -23.607 356 3HB ALA 52 3HB ALA 52 -17.300 -10.186 -22.412 357 H ALA 53 H ALA 53 -14.388 -9.527 -21.469 358 HA ALA 53 HA ALA 53 -15.189 -7.063 -20.240 359 1HB ALA 53 2HB ALA 53 -14.659 -9.383 -19.165 360 2HB ALA 53 1HB ALA 53 -14.102 -7.908 -18.338 361 3HB ALA 53 3HB ALA 53 -12.959 -8.874 -19.301 362 H VAL 54 H VAL 54 -12.049 -8.486 -21.403 363 HA VAL 54 HA VAL 54 -10.595 -6.128 -21.035 364 HB VAL 54 HB VAL 54 -9.152 -7.817 -21.257 365 1HG1 VAL 54 2HG1 VAL 54 -11.289 -9.127 -22.929 366 2HG1 VAL 54 3HG1 VAL 54 -9.638 -9.792 -22.892 367 3HG1 VAL 54 1HG1 VAL 54 -10.575 -9.654 -21.385 368 1HG2 VAL 54 3HG2 VAL 54 -8.827 -6.254 -23.287 369 2HG2 VAL 54 1HG2 VAL 54 -7.997 -7.829 -23.299 370 3HG2 VAL 54 2HG2 VAL 54 -9.483 -7.599 -24.251 371 H VAL 55 H VAL 55 -12.521 -7.417 -23.782 372 HA VAL 55 HA VAL 55 -11.690 -5.560 -25.682 373 HB VAL 55 HB VAL 55 -13.201 -7.756 -25.703 374 1HG1 VAL 55 1HG1 VAL 55 -15.185 -5.463 -25.675 375 2HG1 VAL 55 2HG1 VAL 55 -15.552 -7.078 -26.326 376 3HG1 VAL 55 3HG1 VAL 55 -15.140 -6.885 -24.606 377 1HG2 VAL 55 1HG2 VAL 55 -13.052 -5.453 -27.636 378 2HG2 VAL 55 2HG2 VAL 55 -12.307 -7.067 -27.733 379 3HG2 VAL 55 3HG2 VAL 55 -14.054 -6.876 -28.012 380 H ARG 56 H ARG 56 -14.511 -5.515 -23.398 381 HA ARG 56 HA ARG 56 -15.407 -3.038 -24.233 382 1HB ARG 56 1HB ARG 56 -15.774 -4.722 -21.742 383 2HB ARG 56 2HB ARG 56 -16.395 -3.084 -21.741 384 1HG ARG 56 1HG ARG 56 -17.501 -3.730 -24.037 385 2HG ARG 56 2HG ARG 56 -17.178 -5.386 -23.563 386 1HD ARG 56 1HD ARG 56 -18.880 -5.396 -22.039 387 2HD ARG 56 2HD ARG 56 -18.394 -3.855 -21.360 388 HE ARG 56 HE ARG 56 -20.416 -4.287 -23.425 389 2HH1 ARG 56 1HH ARG 56 -21.051 -0.908 -23.918 390 1HH2 ARG 56 2HH2 ARG 56 -18.146 -1.918 -22.087 391 2HH2 ARG 56 1HH2 ARG 56 -19.032 -0.552 -22.677 392 H PHE 57 H PHE 57 -13.131 -4.066 -21.625 393 HA PHE 57 HA PHE 57 -12.839 -1.540 -20.457 394 1HB PHE 57 1HB PHE 57 -11.975 -3.299 -19.150 395 2HB PHE 57 2HB PHE 57 -11.500 -4.230 -20.556 396 HD1 PHE 57 1HD PHE 57 -10.462 -1.673 -18.163 397 HD2 PHE 57 2HD PHE 57 -9.315 -3.907 -21.584 398 HE1 PHE 57 1HE PHE 57 -8.071 -1.005 -17.798 399 HE2 PHE 57 2HE PHE 57 -6.924 -3.239 -21.218 400 HZ PHE 57 HZ PHE 57 -6.330 -1.796 -19.330 401 H GLN 58 H GLN 58 -11.202 -3.177 -23.203 402 HA GLN 58 HA GLN 58 -9.080 -1.414 -23.397 403 1HB GLN 58 1HB GLN 58 -10.483 -3.198 -25.417 404 2HB GLN 58 2HB GLN 58 -9.098 -2.225 -25.868 405 1HG GLN 58 1HG GLN 58 -8.506 -3.599 -23.379 406 2HG GLN 58 2HG GLN 58 -9.104 -4.766 -24.541 407 1HE2 GLN 58 1HE2 GLN 58 -6.844 -5.512 -24.231 408 2HE2 GLN 58 2HE2 GLN 58 -5.613 -4.891 -25.280 409 H GLU 59 H GLU 59 -12.287 -1.459 -25.101 410 HA GLU 59 HA GLU 59 -11.823 0.819 -26.587 411 1HB GLU 59 1HB GLU 59 -14.464 -0.294 -25.541 412 2HB GLU 59 2HB GLU 59 -14.316 0.888 -26.826 413 1HG GLU 59 1HG GLU 59 -12.571 -1.383 -27.378 414 2HG GLU 59 2HG GLU 59 -14.196 -1.954 -27.059 415 HE2 GLU 59 HE GLU 59 -15.157 -1.323 -30.123 416 H ALA 60 H ALA 60 -12.741 0.354 -23.198 417 HA ALA 60 HA ALA 60 -13.628 3.066 -22.862 418 1HB ALA 60 1HB ALA 60 -13.077 0.743 -20.981 419 2HB ALA 60 2HB ALA 60 -13.630 2.340 -20.423 420 3HB ALA 60 3HB ALA 60 -14.656 1.371 -21.508 421 H ALA 61 H ALA 61 -10.622 1.201 -22.652 422 HA ALA 61 HA ALA 61 -9.164 2.824 -20.959 423 1HB ALA 61 3HB ALA 61 -8.656 0.531 -22.140 424 2HB ALA 61 1HB ALA 61 -7.952 1.555 -23.415 425 3HB ALA 61 2HB ALA 61 -7.315 1.637 -21.754 426 H ASN 62 H ASN 62 -9.809 3.092 -24.502 427 HA ASN 62 HA ASN 62 -8.094 5.181 -24.978 428 1HB ASN 62 1HB ASN 62 -10.823 4.858 -26.315 429 2HB ASN 62 2HB ASN 62 -9.364 5.519 -27.027 430 1HD2 ASN 62 1HD2 ASN 62 -10.984 2.633 -25.895 431 2HD2 ASN 62 2HD2 ASN 62 -10.016 1.463 -26.728 432 H LYS 63 H LYS 63 -11.696 5.200 -24.371 433 HA LYS 63 HA LYS 63 -12.112 7.891 -24.348 434 1HB LYS 63 1HB LYS 63 -13.425 5.549 -23.028 435 2HB LYS 63 2HB LYS 63 -13.914 7.156 -22.529 436 1HG LYS 63 1HG LYS 63 -14.630 7.757 -24.733 437 2HG LYS 63 2HG LYS 63 -13.735 6.448 -25.479 438 1HD LYS 63 1HD LYS 63 -16.233 6.203 -23.744 439 2HD LYS 63 2HD LYS 63 -16.104 5.853 -25.456 440 1HE LYS 63 1HE LYS 63 -14.103 4.237 -24.368 441 2HE LYS 63 2HE LYS 63 -15.343 4.179 -23.131 442 H GLN 64 H GLN 64 -10.730 5.805 -21.779 443 HA GLN 64 HA GLN 64 -10.739 7.896 -19.879 444 1HB GLN 64 1HB GLN 64 -10.203 5.081 -19.926 445 2HB GLN 64 2HB GLN 64 -8.777 5.858 -19.267 446 1HG GLN 64 1HG GLN 64 -11.595 6.501 -18.290 447 2HG GLN 64 2HG GLN 64 -10.616 5.235 -17.576 448 1HE2 GLN 64 1HE2 GLN 64 -10.483 6.224 -15.601 449 2HE2 GLN 64 2HE2 GLN 64 -9.532 7.637 -15.288 450 H LYS 65 H LYS 65 -8.471 6.639 -22.332 451 HA LYS 65 HA LYS 65 -6.192 7.974 -21.352 452 1HB LYS 65 1HB LYS 65 -6.958 6.381 -23.695 453 2HB LYS 65 2HB LYS 65 -5.799 7.640 -24.071 454 1HG LYS 65 1HG LYS 65 -4.617 5.584 -23.401 455 2HG LYS 65 2HG LYS 65 -4.318 6.852 -22.229 456 1HD LYS 65 1HD LYS 65 -4.984 5.353 -20.651 457 2HD LYS 65 2HD LYS 65 -6.617 5.659 -21.209 458 1HE LYS 65 1HE LYS 65 -6.232 3.245 -21.225 459 2HE LYS 65 2HE LYS 65 -6.375 3.795 -22.883 460 H GLN 66 H GLN 66 -8.988 8.933 -23.311 461 HA GLN 66 HA GLN 66 -7.729 11.286 -24.265 462 1HB GLN 66 1HB GLN 66 -9.568 10.139 -25.493 463 2HB GLN 66 2HB GLN 66 -10.676 10.500 -24.184 464 1HG GLN 66 1HG GLN 66 -11.142 12.316 -25.546 465 2HG GLN 66 2HG GLN 66 -9.833 13.015 -24.614 466 1HE2 GLN 66 1HE2 GLN 66 -11.010 12.714 -27.606 467 2HE2 GLN 66 2HE2 GLN 66 -9.577 12.819 -28.574 468 H GLU 67 H GLU 67 -10.327 10.577 -21.821 469 HA GLU 67 HA GLU 67 -10.697 13.151 -20.993 470 1HB GLU 67 1HB GLU 67 -11.865 12.230 -19.150 471 2HB GLU 67 2HB GLU 67 -11.999 11.000 -20.391 472 1HG GLU 67 1HG GLU 67 -11.184 9.559 -18.825 473 2HG GLU 67 2HG GLU 67 -9.621 10.277 -19.158 474 HE2 GLU 67 HE GLU 67 -8.909 11.730 -16.817 475 H LEU 68 H LEU 68 -8.064 10.882 -20.301 476 HA LEU 68 HA LEU 68 -7.096 12.240 -18.011 477 1HB LEU 68 1HB LEU 68 -6.527 9.879 -19.489 478 2HB LEU 68 2HB LEU 68 -5.040 10.800 -19.372 479 HG LEU 68 HG LEU 68 -5.082 10.765 -16.988 480 1HD1 LEU 68 3HD1 LEU 68 -7.947 10.079 -17.359 481 2HD1 LEU 68 1HD1 LEU 68 -7.113 9.330 -15.976 482 3HD1 LEU 68 2HD1 LEU 68 -7.152 11.102 -16.138 483 1HD2 LEU 68 3HD2 LEU 68 -5.655 8.129 -18.315 484 2HD2 LEU 68 1HD2 LEU 68 -4.117 8.784 -17.703 485 3HD2 LEU 68 2HD2 LEU 68 -5.361 8.221 -16.562 486 H ASP 69 H ASP 69 -5.954 12.110 -21.462 487 HA ASP 69 HA ASP 69 -4.043 14.072 -21.098 488 1HB ASP 69 1HB ASP 69 -4.692 12.379 -23.115 489 2HB ASP 69 2HB ASP 69 -5.453 13.825 -23.747 490 HD2 ASP 69 HD ASP 69 -3.500 12.718 -25.075 491 H GLU 70 H GLU 70 -7.412 14.166 -22.482 492 HA GLU 70 HA GLU 70 -7.564 16.744 -23.197 493 1HB GLU 70 1HB GLU 70 -9.841 16.395 -23.330 494 2HB GLU 70 2HB GLU 70 -9.333 14.731 -23.122 495 1HG GLU 70 1HG GLU 70 -9.735 14.882 -20.677 496 2HG GLU 70 2HG GLU 70 -10.163 16.575 -20.831 497 HE2 GLU 70 HE GLU 70 -11.639 14.047 -23.120 498 H ILE 71 H ILE 71 -8.066 15.387 -19.878 499 HA ILE 71 HA ILE 71 -8.577 17.964 -18.765 500 HB ILE 71 HB ILE 71 -8.272 15.174 -17.746 501 1HG1 ILE 71 1HG1 ILE 71 -10.450 17.148 -17.099 502 2HG1 ILE 71 2HG1 ILE 71 -10.424 16.344 -18.656 503 1HG2 ILE 71 3HG2 ILE 71 -7.821 17.671 -16.173 504 2HG2 ILE 71 1HG2 ILE 71 -8.767 16.360 -15.429 505 3HG2 ILE 71 2HG2 ILE 71 -7.107 16.051 -15.991 506 1HD1 ILE 71 1HD1 ILE 71 -10.141 14.130 -17.294 507 2HD1 ILE 71 2HD1 ILE 71 -10.672 15.099 -15.899 508 3HD1 ILE 71 3HD1 ILE 71 -11.743 14.907 -17.308 509 H SER 72 H SER 72 -5.815 15.610 -18.632 510 HA SER 72 HA SER 72 -4.165 17.144 -17.106 511 1HB SER 72 1HB SER 72 -2.454 15.665 -17.741 512 2HB SER 72 2HB SER 72 -3.899 14.717 -18.035 513 HG SER 72 HG SER 72 -2.235 14.756 -19.798 514 H THR 73 H THR 73 -5.211 17.590 -20.424 515 HA THR 73 HA THR 73 -3.021 19.436 -20.993 516 HB THR 73 HB THR 73 -5.264 18.123 -22.591 517 HG1 THR 73 1HG THR 73 -3.256 17.376 -23.665 518 1HG2 THR 73 3HG2 THR 73 -4.085 20.700 -23.129 519 2HG2 THR 73 1HG2 THR 73 -3.344 19.525 -24.241 520 3HG2 THR 73 2HG2 THR 73 -5.112 19.727 -24.208 521 H ASN 74 H ASN 74 -6.464 19.368 -20.128 522 HA ASN 74 HA ASN 74 -7.263 21.796 -20.948 523 1HB ASN 74 1HB ASN 74 -8.004 19.900 -18.848 524 2HB ASN 74 2HB ASN 74 -8.221 21.535 -18.258 525 1HD2 ASN 74 1HD2 ASN 74 -9.682 19.051 -19.790 526 2HD2 ASN 74 2HD2 ASN 74 -10.923 19.869 -20.679 527 H ILE 75 H ILE 75 -5.653 20.963 -17.781 528 HA ILE 75 HA ILE 75 -5.469 23.577 -16.844 529 HB ILE 75 HB ILE 75 -3.603 21.289 -16.226 530 1HG1 ILE 75 1HG1 ILE 75 -5.593 21.324 -14.283 531 2HG1 ILE 75 2HG1 ILE 75 -6.482 21.540 -15.778 532 1HG2 ILE 75 2HG2 ILE 75 -3.464 23.863 -15.370 533 2HG2 ILE 75 3HG2 ILE 75 -4.506 23.147 -14.117 534 3HG2 ILE 75 1HG2 ILE 75 -2.898 22.455 -14.439 535 1HD1 ILE 75 2HD1 ILE 75 -4.886 19.578 -16.645 536 2HD1 ILE 75 3HD1 ILE 75 -4.761 19.225 -14.905 537 3HD1 ILE 75 1HD1 ILE 75 -6.352 19.214 -15.703 538 H ARG 76 H ARG 76 -3.214 21.570 -18.824 539 HA ARG 76 HA ARG 76 -1.092 23.248 -18.809 540 1HB ARG 76 1HB ARG 76 -2.174 21.534 -21.101 541 2HB ARG 76 2HB ARG 76 -0.574 22.249 -21.102 542 1HG ARG 76 1HG ARG 76 -1.242 20.720 -18.631 543 2HG ARG 76 2HG ARG 76 -1.171 19.750 -20.088 544 1HD ARG 76 1HD ARG 76 1.074 19.688 -19.445 545 2HD ARG 76 2HD ARG 76 1.102 21.072 -20.520 546 HE ARG 76 HE ARG 76 1.402 22.506 -18.670 547 2HH1 ARG 76 1HH ARG 76 1.747 21.780 -15.291 548 1HH2 ARG 76 2HH2 ARG 76 0.592 19.247 -17.541 549 2HH2 ARG 76 1HH2 ARG 76 0.975 19.590 -15.887 550 H GLN 77 H GLN 77 -4.100 23.374 -20.779 551 HA GLN 77 HA GLN 77 -3.135 25.528 -22.359 552 1HB GLN 77 1HB GLN 77 -5.934 24.361 -22.030 553 2HB GLN 77 2HB GLN 77 -5.499 25.564 -23.228 554 1HG GLN 77 1HG GLN 77 -3.609 23.337 -23.316 555 2HG GLN 77 2HG GLN 77 -5.250 22.736 -23.452 556 1HE2 GLN 77 1HE2 GLN 77 -6.306 22.911 -25.304 557 2HE2 GLN 77 2HE2 GLN 77 -5.785 23.786 -26.705 558 H ALA 78 H ALA 78 -4.524 25.171 -19.206 559 HA ALA 78 HA ALA 78 -6.000 27.544 -19.038 560 1HB ALA 78 3HB ALA 78 -4.487 26.376 -16.707 561 2HB ALA 78 1HB ALA 78 -6.141 27.032 -16.769 562 3HB ALA 78 2HB ALA 78 -5.790 25.435 -17.471 563 H GLY 79 H GLY 79 -2.556 26.867 -19.154 564 1HA GLY 79 2HA GLY 79 -2.033 29.720 -18.577 565 2HA GLY 79 1HA GLY 79 -1.168 28.755 -19.757 566 H VAL 80 H VAL 80 -1.442 26.384 -17.679 567 HA VAL 80 HA VAL 80 0.416 27.316 -15.654 568 HB VAL 80 HB VAL 80 -0.650 24.524 -15.976 569 1HG1 VAL 80 1HG1 VAL 80 0.861 25.993 -13.983 570 2HG1 VAL 80 2HG1 VAL 80 -0.643 25.341 -13.288 571 3HG1 VAL 80 3HG1 VAL 80 0.514 24.250 -14.089 572 1HG2 VAL 80 2HG2 VAL 80 -2.119 26.965 -14.967 573 2HG2 VAL 80 3HG2 VAL 80 -2.663 25.732 -16.130 574 3HG2 VAL 80 1HG2 VAL 80 -2.522 25.325 -14.403 575 H GLN 81 H GLN 81 2.345 27.704 -16.807 576 HA GLN 81 HA GLN 81 3.651 25.249 -17.600 577 1HB GLN 81 1HB GLN 81 4.648 26.685 -19.587 578 2HB GLN 81 2HB GLN 81 3.105 25.875 -19.773 579 1HG GLN 81 1HG GLN 81 2.046 28.094 -18.882 580 2HG GLN 81 2HG GLN 81 3.612 28.817 -19.189 581 1HE2 GLN 81 1HE2 GLN 81 0.633 28.021 -20.460 582 2HE2 GLN 81 2HE2 GLN 81 0.946 28.220 -22.152 583 H TYR 82 H TYR 82 3.592 27.637 -15.489 584 HA TYR 82 HA TYR 82 6.457 27.659 -15.179 585 1HB TYR 82 1HB TYR 82 6.531 30.151 -15.215 586 2HB TYR 82 2HB TYR 82 5.863 29.595 -16.737 587 HD1 TYR 82 1HD TYR 82 5.410 31.811 -14.024 588 HD2 TYR 82 2HD TYR 82 3.218 29.422 -16.817 589 HE1 TYR 82 1HE TYR 82 3.350 33.256 -13.655 590 HE2 TYR 82 2HE TYR 82 1.166 30.876 -16.438 591 HH TYR 82 HH TYR 82 1.206 33.454 -14.014 592 H SER 83 H SER 83 5.953 26.487 -13.239 593 HA SER 83 HA SER 83 5.066 28.279 -11.155 594 1HB SER 83 1HB SER 83 3.002 27.188 -11.479 595 2HB SER 83 2HB SER 83 3.754 25.661 -11.896 596 HG SER 83 HG SER 83 3.964 26.817 -9.254 597 H ARG 84 H ARG 84 6.134 24.880 -11.908 598 HA ARG 84 HA ARG 84 7.612 24.845 -9.457 599 1HB ARG 84 1HB ARG 84 6.390 22.813 -10.229 600 2HB ARG 84 2HB ARG 84 7.345 22.776 -11.697 601 1HG ARG 84 1HG ARG 84 9.296 22.080 -10.586 602 2HG ARG 84 2HG ARG 84 8.809 22.787 -9.058 603 1HD ARG 84 1HD ARG 84 7.240 20.468 -10.242 604 2HD ARG 84 2HD ARG 84 8.710 20.170 -9.336 605 HE ARG 84 HE ARG 84 7.661 21.018 -7.350 606 2HH1 ARG 84 1HH ARG 84 4.257 21.446 -6.806 607 1HH2 ARG 84 2HH2 ARG 84 5.492 21.124 -10.150 608 2HH2 ARG 84 1HH2 ARG 84 4.065 21.342 -9.192 609 H ALA 85 H ALA 85 8.251 26.619 -11.941 610 HA ALA 85 HA ALA 85 10.710 25.574 -12.951 611 1HB ALA 85 3HB ALA 85 8.886 27.339 -13.878 612 2HB ALA 85 1HB ALA 85 10.046 28.479 -13.155 613 3HB ALA 85 2HB ALA 85 10.585 27.337 -14.410 614 H ASP 86 H ASP 86 11.174 25.223 -10.384 615 HA ASP 86 HA ASP 86 12.385 27.634 -9.350 616 1HB ASP 86 1HB ASP 86 10.917 25.832 -8.048 617 2HB ASP 86 2HB ASP 86 12.423 24.941 -7.962 618 HD2 ASP 86 HD ASP 86 13.259 25.429 -5.771 619 H GLU 87 H GLU 87 13.638 26.564 -11.678 620 HA GLU 87 HA GLU 87 15.770 24.867 -10.777 621 1HB GLU 87 1HB GLU 87 14.572 25.635 -13.342 622 2HB GLU 87 2HB GLU 87 16.321 25.707 -13.413 623 1HG GLU 87 1HG GLU 87 16.570 23.406 -12.843 624 2HG GLU 87 2HG GLU 87 14.955 23.298 -12.171 625 HE2 GLU 87 HE GLU 87 16.362 21.955 -14.370 626 H GLU 88 H GLU 88 15.218 27.938 -10.102 627 HA GLU 88 HA GLU 88 17.256 29.411 -11.194 628 1HB GLU 88 1HB GLU 88 16.981 30.866 -9.152 629 2HB GLU 88 2HB GLU 88 15.474 30.483 -9.960 630 1HG GLU 88 1HG GLU 88 14.802 28.951 -8.281 631 2HG GLU 88 2HG GLU 88 16.440 28.698 -7.711 632 HE2 GLU 88 HE GLU 88 13.690 30.429 -7.321 633 H GLN 89 H GLN 89 17.389 26.745 -8.984 634 HA GLN 89 HA GLN 89 19.954 27.587 -7.953 635 1HB GLN 89 1HB GLN 89 17.818 25.783 -7.083 636 2HB GLN 89 2HB GLN 89 19.376 24.982 -7.017 637 1HG GLN 89 1HG GLN 89 20.283 26.580 -5.505 638 2HG GLN 89 2HG GLN 89 19.081 27.789 -5.907 639 1HE2 GLN 89 1HE2 GLN 89 18.531 28.089 -3.765 640 2HE2 GLN 89 2HE2 GLN 89 17.582 26.959 -2.857 641 H GLN 90 H GLN 90 19.283 26.732 -10.860 642 HA GLN 90 HA GLN 90 20.418 24.233 -11.274 643 1HB GLN 90 1HB GLN 90 20.634 25.023 -13.661 644 2HB GLN 90 2HB GLN 90 19.034 25.240 -12.981 645 1HG GLN 90 1HG GLN 90 19.136 27.468 -13.376 646 2HG GLN 90 2HG GLN 90 20.560 27.605 -12.364 647 1HE2 GLN 90 1HE2 GLN 90 22.609 27.525 -13.250 648 2HE2 GLN 90 2HE2 GLN 90 22.924 27.732 -14.940 649 H GLN 91 H GLN 91 21.826 27.183 -10.245 650 HA GLN 91 HA GLN 91 24.355 26.660 -11.503 651 1HB GLN 91 1HB GLN 91 23.068 28.969 -10.626 652 2HB GLN 91 2HB GLN 91 24.271 28.715 -9.377 653 1HG GLN 91 1HG GLN 91 25.456 28.238 -12.002 654 2HG GLN 91 2HG GLN 91 24.679 29.808 -11.978 655 1HE2 GLN 91 1HE2 GLN 91 27.147 30.133 -12.291 656 2HE2 GLN 91 2HE2 GLN 91 28.045 30.530 -10.865 657 H ALA 92 H ALA 92 22.637 25.677 -8.698 658 HA ALA 92 HA ALA 92 25.169 24.887 -7.428 659 1HB ALA 92 3HB ALA 92 24.321 25.414 -5.331 660 2HB ALA 92 1HB ALA 92 23.582 26.695 -6.321 661 3HB ALA 92 2HB ALA 92 22.628 25.265 -5.860 662 H LEU 93 H LEU 93 23.647 23.503 -9.546 663 HA LEU 93 HA LEU 93 22.579 21.256 -7.992 664 1HB LEU 93 1HB LEU 93 21.592 22.676 -10.242 665 2HB LEU 93 2HB LEU 93 22.023 21.069 -10.793 666 HG LEU 93 HG LEU 93 19.649 21.320 -10.081 667 1HD1 LEU 93 2HD1 LEU 93 21.535 19.260 -9.214 668 2HD1 LEU 93 3HD1 LEU 93 20.051 19.311 -8.233 669 3HD1 LEU 93 1HD1 LEU 93 19.944 19.110 -9.998 670 1HD2 LEU 93 3HD2 LEU 93 20.677 22.700 -7.927 671 2HD2 LEU 93 1HD2 LEU 93 19.006 22.110 -8.095 672 3HD2 LEU 93 2HD2 LEU 93 20.209 21.137 -7.215 673 H SER 94 H SER 94 25.165 21.172 -7.698 674 HA SER 94 HA SER 94 26.135 19.520 -9.897 675 1HB SER 94 1HB SER 94 28.435 20.105 -9.058 676 2HB SER 94 2HB SER 94 27.529 21.486 -9.643 677 HG SER 94 HG SER 94 28.182 22.277 -7.728 678 H SER 95 H SER 95 26.068 19.978 -6.305 679 HA SER 95 HA SER 95 27.320 17.594 -5.690 680 1HB SER 95 1HB SER 95 27.056 19.350 -4.029 681 2HB SER 95 2HB SER 95 25.309 19.286 -4.151 682 HG SER 95 HG SER 95 26.633 16.863 -3.464 683 H GLN 96 H GLN 96 24.211 18.237 -7.056 684 HA GLN 96 HA GLN 96 22.981 15.904 -5.948 685 1HB GLN 96 1HB GLN 96 21.881 18.187 -6.702 686 2HB GLN 96 2HB GLN 96 21.887 17.466 -8.299 687 1HG GLN 96 1HG GLN 96 20.657 16.159 -5.826 688 2HG GLN 96 2HG GLN 96 19.747 17.062 -7.022 689 1HE2 GLN 96 1HE2 GLN 96 19.226 16.178 -8.943 690 2HE2 GLN 96 2HE2 GLN 96 19.559 14.543 -9.409 691 H MET 97 H MET 97 23.740 17.028 -9.332 692 HA MET 97 HA MET 97 23.470 14.393 -10.317 693 1HB MET 97 1HB MET 97 24.330 15.491 -12.452 694 2HB MET 97 2HB MET 97 22.960 16.325 -11.747 695 1HG MET 97 1HG MET 97 24.178 18.229 -11.523 696 2HG MET 97 2HG MET 97 25.374 17.391 -10.554 697 1HE MET 97 3HE MET 97 25.740 19.754 -12.371 698 2HE MET 97 1HE MET 97 27.356 19.153 -11.931 699 3HE MET 97 2HE MET 97 26.958 19.470 -13.637 700 H GLY 98 H GLY 98 25.089 12.930 -11.029 701 1HA GLY 98 2HA GLY 98 27.504 12.943 -9.566 702 2HA GLY 98 1HA GLY 98 27.815 13.483 -11.204 703 H PHE 99 H PHE 99 26.054 10.875 -9.390 704 HA PHE 99 HA PHE 99 27.362 8.836 -10.799 705 1HB PHE 99 1HB PHE 99 25.011 9.213 -8.922 706 2HB PHE 99 2HB PHE 99 25.092 7.678 -9.764 707 HD1 PHE 99 1HD PHE 99 27.109 9.930 -7.595 708 HD2 PHE 99 2HD PHE 99 26.432 5.960 -8.933 709 HE1 PHE 99 1HE PHE 99 28.732 9.075 -5.881 710 HE2 PHE 99 2HE PHE 99 28.054 5.105 -7.219 711 HZ PHE 99 HZ PHE 99 29.185 6.673 -5.714 712 H MET 601 H MET 601 9.003 -19.125 -18.297 713 HA MET 601 HA MET 601 7.787 -19.433 -20.351 714 1HB MET 601 1HB MET 601 9.765 -19.448 -21.837 715 2HB MET 601 2HB MET 601 10.173 -18.589 -20.365 716 1HG MET 601 1HG MET 601 10.763 -21.330 -19.838 717 2HG MET 601 2HG MET 601 11.364 -21.022 -21.455 718 1HE MET 601 3HE MET 601 13.519 -20.098 -21.930 719 2HE MET 601 1HE MET 601 14.710 -19.775 -20.647 720 3HE MET 601 2HE MET 601 13.894 -21.355 -20.727 721 H THR 602 H THR 602 7.332 -21.926 -18.845 722 HA THR 602 HA THR 602 8.202 -24.240 -19.917 723 HB THR 602 HB THR 602 5.406 -23.360 -19.044 724 HG1 THR 602 1HG THR 602 6.305 -24.627 -17.151 725 1HG2 THR 602 3HG2 THR 602 5.911 -25.724 -20.426 726 2HG2 THR 602 1HG2 THR 602 6.220 -26.206 -18.740 727 3HG2 THR 602 2HG2 THR 602 4.639 -25.528 -19.197 728 H GLU 603 H GLU 603 6.205 -21.808 -21.531 729 HA GLU 603 HA GLU 603 6.759 -22.986 -24.004 730 1HB GLU 603 1HB GLU 603 4.469 -23.606 -24.698 731 2HB GLU 603 2HB GLU 603 5.000 -24.585 -23.346 732 1HG GLU 603 1HG GLU 603 3.220 -22.110 -23.134 733 2HG GLU 603 2HG GLU 603 2.658 -23.768 -23.046 734 HE2 GLU 603 HE GLU 603 4.142 -24.976 -21.090 735 H GLN 604 H GLN 604 6.834 -21.307 -25.449 736 HA GLN 604 HA GLN 604 6.176 -18.754 -24.608 737 1HB GLN 604 1HB GLN 604 7.536 -19.957 -26.784 738 2HB GLN 604 2HB GLN 604 6.276 -18.987 -27.519 739 1HG GLN 604 1HG GLN 604 7.458 -17.100 -27.104 740 2HG GLN 604 2HG GLN 604 7.406 -17.427 -25.383 741 1HE2 GLN 604 1HE2 GLN 604 9.539 -16.176 -26.588 742 2HE2 GLN 604 2HE2 GLN 604 10.951 -17.178 -26.522 743 H GLN 605 H GLN 605 4.434 -21.157 -26.635 744 HA GLN 605 HA GLN 605 2.541 -19.705 -27.790 745 1HB GLN 605 1HB GLN 605 2.170 -22.343 -26.307 746 2HB GLN 605 2HB GLN 605 0.999 -21.688 -27.434 747 1HG GLN 605 1HG GLN 605 3.455 -21.548 -28.827 748 2HG GLN 605 2HG GLN 605 3.527 -23.082 -27.982 749 1HE2 GLN 605 1HE2 GLN 605 3.184 -24.487 -29.571 750 2HE2 GLN 605 2HE2 GLN 605 1.770 -24.574 -30.567 751 H TRP 606 H TRP 606 2.612 -20.676 -24.312 752 HA TRP 606 HA TRP 606 1.060 -18.387 -23.617 753 1HB TRP 606 1HB TRP 606 -0.906 -19.367 -22.848 754 2HB TRP 606 2HB TRP 606 -0.667 -20.031 -24.453 755 HD1 TRP 606 HD TRP 606 0.133 -22.690 -24.547 756 HE1 TRP 606 1HE TRP 606 -0.220 -24.736 -22.917 757 HE3 TRP 606 3HE TRP 606 -1.070 -19.905 -20.467 758 HZ2 TRP 606 2HZ TRP 606 -0.946 -24.954 -20.166 759 HZ3 TRP 606 3HZ TRP 606 -1.587 -21.113 -18.348 760 HH2 TRP 606 HH TRP 606 -1.540 -23.549 -18.158 761 H ASN 607 H ASN 607 2.882 -17.922 -22.301 762 HA ASN 607 HA ASN 607 4.204 -19.762 -20.768 763 1HB ASN 607 1HB ASN 607 3.720 -16.785 -20.218 764 2HB ASN 607 2HB ASN 607 4.946 -17.747 -19.417 765 1HD2 ASN 607 1HD2 ASN 607 6.852 -17.230 -20.161 766 2HD2 ASN 607 2HD2 ASN 607 7.312 -17.015 -21.817 767 H PHE 608 H PHE 608 3.365 -21.005 -19.087 768 HA PHE 608 HA PHE 608 0.878 -20.558 -17.951 769 1HB PHE 608 1HB PHE 608 2.635 -22.596 -18.055 770 2HB PHE 608 2HB PHE 608 3.213 -21.932 -16.540 771 HD1 PHE 608 1HD PHE 608 1.368 -24.479 -17.697 772 HD2 PHE 608 2HD PHE 608 0.922 -21.207 -15.033 773 HE1 PHE 608 1HE PHE 608 -0.428 -25.727 -16.465 774 HE2 PHE 608 2HE PHE 608 -0.874 -22.455 -13.801 775 HZ PHE 608 HZ PHE 608 -1.527 -24.700 -14.532 776 H ALA 609 H ALA 609 4.189 -19.641 -16.851 777 HA ALA 609 HA ALA 609 3.229 -18.614 -14.363 778 1HB ALA 609 1HB ALA 609 5.886 -18.086 -15.743 779 2HB ALA 609 3HB ALA 609 5.533 -19.582 -14.846 780 3HB ALA 609 2HB ALA 609 5.525 -18.015 -14.001 781 H GLY 610 H GLY 610 2.763 -17.614 -17.504 782 1HA GLY 610 2HA GLY 610 2.733 -15.526 -18.516 783 2HA GLY 610 1HA GLY 610 3.159 -14.761 -16.998 784 H ILE 611 H ILE 611 0.496 -16.896 -18.274 785 HA ILE 611 HA ILE 611 -1.463 -14.918 -17.770 786 HB ILE 611 HB ILE 611 -1.828 -16.397 -19.552 787 1HG1 ILE 611 1HG1 ILE 611 -3.697 -16.074 -17.504 788 2HG1 ILE 611 2HG1 ILE 611 -4.016 -16.504 -19.172 789 1HG2 ILE 611 2HG2 ILE 611 -1.249 -18.597 -17.574 790 2HG2 ILE 611 3HG2 ILE 611 -2.113 -18.904 -19.099 791 3HG2 ILE 611 1HG2 ILE 611 -0.459 -18.247 -19.130 792 1HD1 ILE 611 1HD1 ILE 611 -3.269 -18.597 -17.091 793 2HD1 ILE 611 2HD1 ILE 611 -4.953 -18.099 -17.384 794 3HD1 ILE 611 3HD1 ILE 611 -4.009 -18.856 -18.689 795 H GLU 612 H GLU 612 0.151 -17.318 -15.820 796 HA GLU 612 HA GLU 612 -1.902 -17.795 -14.005 797 1HB GLU 612 1HB GLU 612 -0.062 -19.301 -13.990 798 2HB GLU 612 2HB GLU 612 1.119 -18.010 -13.886 799 1HG GLU 612 1HG GLU 612 0.226 -17.444 -11.581 800 2HG GLU 612 2HG GLU 612 -0.843 -18.829 -11.691 801 HE2 GLU 612 HE GLU 612 3.128 -19.290 -11.508 802 H ALA 613 H ALA 613 0.887 -15.468 -13.941 803 HA ALA 613 HA ALA 613 -0.197 -14.211 -11.576 804 1HB ALA 613 2HB ALA 613 2.294 -14.651 -12.157 805 2HB ALA 613 1HB ALA 613 1.860 -13.055 -11.498 806 3HB ALA 613 3HB ALA 613 2.140 -13.251 -13.245 807 H ALA 614 H ALA 614 -0.553 -14.024 -15.010 808 HA ALA 614 HA ALA 614 -0.800 -11.381 -15.562 809 1HB ALA 614 3HB ALA 614 -2.443 -13.775 -16.458 810 2HB ALA 614 1HB ALA 614 -2.595 -12.162 -17.195 811 3HB ALA 614 2HB ALA 614 -1.046 -13.036 -17.277 812 H ALA 615 H ALA 615 -3.356 -13.546 -14.155 813 HA ALA 615 HA ALA 615 -5.309 -11.600 -13.908 814 1HB ALA 615 1HB ALA 615 -6.404 -13.435 -13.222 815 2HB ALA 615 2HB ALA 615 -4.863 -14.324 -13.162 816 3HB ALA 615 3HB ALA 615 -5.448 -13.459 -11.721 817 H SER 616 H SER 616 -2.747 -12.663 -11.572 818 HA SER 616 HA SER 616 -3.491 -11.063 -9.499 819 1HB SER 616 1HB SER 616 -1.350 -12.763 -10.110 820 2HB SER 616 2HB SER 616 -0.566 -11.219 -9.844 821 HG SER 616 HG SER 616 -1.589 -11.083 -7.763 822 H ALA 617 H ALA 617 -1.868 -10.259 -12.549 823 HA ALA 617 HA ALA 617 -0.909 -7.719 -11.668 824 1HB ALA 617 1HB ALA 617 -0.391 -9.434 -13.771 825 2HB ALA 617 3HB ALA 617 0.162 -7.746 -13.664 826 3HB ALA 617 2HB ALA 617 -1.324 -8.140 -14.560 827 H ILE 618 H ILE 618 -3.811 -8.997 -13.367 828 HA ILE 618 HA ILE 618 -4.865 -6.511 -14.087 829 HB ILE 618 HB ILE 618 -6.222 -9.150 -13.527 830 1HG1 ILE 618 1HG1 ILE 618 -4.452 -9.237 -15.256 831 2HG1 ILE 618 2HG1 ILE 618 -6.053 -9.564 -15.889 832 1HG2 ILE 618 3HG2 ILE 618 -7.250 -6.701 -14.987 833 2HG2 ILE 618 1HG2 ILE 618 -8.057 -8.286 -14.916 834 3HG2 ILE 618 2HG2 ILE 618 -7.835 -7.333 -13.429 835 1HD1 ILE 618 3HD1 ILE 618 -5.448 -6.693 -15.973 836 2HD1 ILE 618 1HD1 ILE 618 -4.241 -7.653 -16.862 837 3HD1 ILE 618 2HD1 ILE 618 -5.965 -7.778 -17.286 838 H GLN 619 H GLN 619 -5.245 -8.552 -11.132 839 HA GLN 619 HA GLN 619 -7.173 -7.020 -9.929 840 1HB GLN 619 1HB GLN 619 -5.257 -9.102 -9.146 841 2HB GLN 619 2HB GLN 619 -5.543 -7.972 -7.838 842 1HG GLN 619 1HG GLN 619 -7.810 -9.255 -9.425 843 2HG GLN 619 2HG GLN 619 -7.148 -9.979 -7.973 844 1HE2 GLN 619 1HE2 GLN 619 -9.764 -8.630 -8.810 845 2HE2 GLN 619 2HE2 GLN 619 -10.131 -7.531 -7.522 846 H GLY 620 H GLY 620 -3.588 -6.937 -9.273 847 1HA GLY 620 2HA GLY 620 -2.240 -5.260 -8.625 848 2HA GLY 620 1HA GLY 620 -3.578 -4.699 -7.643 849 H ASN 621 H ASN 621 -3.640 -4.983 -11.226 850 HA ASN 621 HA ASN 621 -3.023 -2.269 -11.631 851 1HB ASN 621 1HB ASN 621 -4.107 -4.531 -13.343 852 2HB ASN 621 2HB ASN 621 -4.144 -2.899 -13.979 853 1HD2 ASN 621 1HD2 ASN 621 -1.961 -1.682 -13.293 854 2HD2 ASN 621 2HD2 ASN 621 -0.515 -2.488 -13.801 855 H VAL 622 H VAL 622 -5.965 -4.254 -11.178 856 HA VAL 622 HA VAL 622 -7.824 -2.371 -12.131 857 HB VAL 622 HB VAL 622 -7.939 -4.766 -10.313 858 1HG1 VAL 622 1HG1 VAL 622 -10.144 -2.810 -10.968 859 2HG1 VAL 622 2HG1 VAL 622 -10.494 -4.520 -10.619 860 3HG1 VAL 622 3HG1 VAL 622 -9.691 -3.508 -9.395 861 1HG2 VAL 622 2HG2 VAL 622 -7.772 -4.584 -13.027 862 2HG2 VAL 622 3HG2 VAL 622 -8.528 -5.938 -12.153 863 3HG2 VAL 622 1HG2 VAL 622 -9.537 -4.621 -12.798 864 H THR 623 H THR 623 -6.730 -3.217 -8.768 865 HA THR 623 HA THR 623 -8.210 -1.207 -7.509 866 HB THR 623 HB THR 623 -6.649 -1.721 -5.616 867 HG1 THR 623 1HG THR 623 -4.636 -2.071 -6.524 868 1HG2 THR 623 3HG2 THR 623 -8.310 -3.595 -6.883 869 2HG2 THR 623 1HG2 THR 623 -6.742 -4.434 -6.796 870 3HG2 THR 623 2HG2 THR 623 -7.511 -3.828 -5.309 871 H SER 624 H SER 624 -4.981 -1.170 -9.057 872 HA SER 624 HA SER 624 -4.055 1.166 -8.040 873 1HB SER 624 1HB SER 624 -3.624 -0.430 -10.497 874 2HB SER 624 2HB SER 624 -3.230 1.266 -10.696 875 HG SER 624 HG SER 624 -1.651 -0.533 -9.650 876 H ILE 625 H ILE 625 -6.232 0.641 -10.891 877 HA ILE 625 HA ILE 625 -6.443 3.418 -11.451 878 HB ILE 625 HB ILE 625 -7.609 0.884 -12.452 879 1HG1 ILE 625 1HG1 ILE 625 -7.087 2.679 -14.532 880 2HG1 ILE 625 2HG1 ILE 625 -5.834 3.011 -13.353 881 1HG2 ILE 625 2HG2 ILE 625 -9.008 3.543 -12.623 882 2HG2 ILE 625 3HG2 ILE 625 -9.154 2.339 -13.926 883 3HG2 ILE 625 1HG2 ILE 625 -9.678 1.931 -12.274 884 1HD1 ILE 625 2HD1 ILE 625 -6.541 0.220 -14.371 885 2HD1 ILE 625 3HD1 ILE 625 -5.185 1.207 -14.967 886 3HD1 ILE 625 1HD1 ILE 625 -5.196 0.635 -13.282 887 H HIS 626 H HIS 626 -8.094 1.103 -9.336 888 HA HIS 626 HA HIS 626 -10.456 2.520 -8.978 889 1HB HIS 626 1HB HIS 626 -9.816 0.130 -8.280 890 2HB HIS 626 2HB HIS 626 -9.100 0.855 -6.854 891 HD1 HIS 626 1HD HIS 626 -10.999 -0.634 -5.597 892 HD2 HIS 626 2HD HIS 626 -12.360 2.650 -7.824 893 HE1 HIS 626 1HE HIS 626 -13.380 -0.170 -4.805 894 H SER 627 H SER 627 -7.284 2.664 -7.246 895 HA SER 627 HA SER 627 -8.261 4.734 -5.552 896 1HB SER 627 1HB SER 627 -5.582 3.368 -5.945 897 2HB SER 627 2HB SER 627 -5.701 4.805 -4.950 898 HG SER 627 HG SER 627 -7.680 2.917 -4.366 899 H LEU 628 H LEU 628 -5.958 4.409 -8.330 900 HA LEU 628 HA LEU 628 -4.928 6.898 -8.462 901 1HB LEU 628 1HB LEU 628 -5.627 4.801 -10.429 902 2HB LEU 628 2HB LEU 628 -5.338 6.400 -11.085 903 HG LEU 628 HG LEU 628 -3.324 5.326 -9.161 904 1HD1 LEU 628 1HD1 LEU 628 -4.091 3.937 -11.610 905 2HD1 LEU 628 2HD1 LEU 628 -2.378 4.421 -11.600 906 3HD1 LEU 628 3HD1 LEU 628 -3.029 3.421 -10.278 907 1HD2 LEU 628 1HD2 LEU 628 -3.396 7.620 -10.460 908 2HD2 LEU 628 2HD2 LEU 628 -1.865 6.749 -10.204 909 3HD2 LEU 628 3HD2 LEU 628 -2.698 6.642 -11.773 910 H LEU 629 H LEU 629 -8.097 5.859 -9.904 911 HA LEU 629 HA LEU 629 -8.838 8.305 -10.902 912 1HB LEU 629 1HB LEU 629 -10.054 5.759 -10.317 913 2HB LEU 629 2HB LEU 629 -11.166 7.057 -9.930 914 HG LEU 629 HG LEU 629 -11.392 6.138 -12.239 915 1HD1 LEU 629 1HD1 LEU 629 -10.986 9.008 -11.587 916 2HD1 LEU 629 2HD1 LEU 629 -11.104 8.578 -13.310 917 3HD1 LEU 629 3HD1 LEU 629 -12.424 8.153 -12.195 918 1HD2 LEU 629 3HD2 LEU 629 -8.709 6.096 -12.364 919 2HD2 LEU 629 1HD2 LEU 629 -9.757 6.151 -13.802 920 3HD2 LEU 629 2HD2 LEU 629 -9.016 7.646 -13.183 921 H ASP 630 H ASP 630 -9.237 6.974 -7.570 922 HA ASP 630 HA ASP 630 -10.712 9.127 -6.634 923 1HB ASP 630 1HB ASP 630 -10.535 6.955 -5.455 924 2HB ASP 630 2HB ASP 630 -8.822 7.213 -5.186 925 HD2 ASP 630 HD ASP 630 -11.620 8.975 -2.988 926 H GLU 631 H GLU 631 -7.246 8.524 -7.165 927 HA GLU 631 HA GLU 631 -6.343 10.587 -5.469 928 1HB GLU 631 1HB GLU 631 -5.191 8.574 -7.257 929 2HB GLU 631 2HB GLU 631 -4.359 10.107 -7.426 930 1HG GLU 631 1HG GLU 631 -4.776 8.505 -4.867 931 2HG GLU 631 2HG GLU 631 -3.254 8.874 -5.653 932 HE2 GLU 631 HE GLU 631 -3.380 11.985 -5.574 933 H GLY 632 H GLY 632 -6.784 10.256 -9.056 934 1HA GLY 632 2HA GLY 632 -6.884 11.799 -10.692 935 2HA GLY 632 1HA GLY 632 -5.954 12.885 -9.678 936 H LYS 633 H LYS 633 -9.122 11.394 -8.826 937 HA LYS 633 HA LYS 633 -10.759 13.472 -9.623 938 1HB LYS 633 1HB LYS 633 -11.368 11.121 -8.839 939 2HB LYS 633 2HB LYS 633 -11.218 11.720 -7.199 940 1HG LYS 633 1HG LYS 633 -13.549 11.926 -7.822 941 2HG LYS 633 2HG LYS 633 -12.886 13.547 -7.768 942 1HD LYS 633 1HD LYS 633 -12.380 12.822 -10.403 943 2HD LYS 633 2HD LYS 633 -13.895 11.996 -10.093 944 1HE LYS 633 1HE LYS 633 -14.996 14.070 -9.452 945 2HE LYS 633 2HE LYS 633 -13.476 14.941 -9.415 946 H GLN 634 H GLN 634 -8.674 13.089 -6.752 947 HA GLN 634 HA GLN 634 -9.813 15.189 -5.313 948 1HB GLN 634 1HB GLN 634 -7.062 13.887 -5.218 949 2HB GLN 634 2HB GLN 634 -7.560 15.125 -4.081 950 1HG GLN 634 1HG GLN 634 -9.563 12.963 -4.396 951 2HG GLN 634 2HG GLN 634 -8.019 12.387 -3.801 952 1HE2 GLN 634 1HE2 GLN 634 -10.722 12.776 -2.570 953 2HE2 GLN 634 2HE2 GLN 634 -10.461 13.687 -1.120 954 H SER 635 H SER 635 -7.603 15.045 -8.044 955 HA SER 635 HA SER 635 -6.631 17.699 -7.574 956 1HB SER 635 1HB SER 635 -5.770 15.429 -9.061 957 2HB SER 635 2HB SER 635 -6.098 16.675 -10.249 958 HG SER 635 HG SER 635 -4.537 17.213 -7.881 959 H LEU 636 H LEU 636 -9.066 15.976 -9.535 960 HA LEU 636 HA LEU 636 -9.607 17.738 -11.514 961 1HB LEU 636 1HB LEU 636 -10.997 15.638 -10.090 962 2HB LEU 636 2HB LEU 636 -12.109 16.903 -10.572 963 HG LEU 636 HG LEU 636 -11.782 14.949 -12.173 964 1HD1 LEU 636 1HD1 LEU 636 -12.267 17.693 -12.620 965 2HD1 LEU 636 2HD1 LEU 636 -11.218 17.139 -13.948 966 3HD1 LEU 636 3HD1 LEU 636 -12.759 16.309 -13.625 967 1HD2 LEU 636 2HD2 LEU 636 -9.082 15.615 -11.891 968 2HD2 LEU 636 3HD2 LEU 636 -9.797 14.460 -13.042 969 3HD2 LEU 636 1HD2 LEU 636 -9.521 16.149 -13.531 970 H THR 637 H THR 637 -10.878 17.870 -8.119 971 HA THR 637 HA THR 637 -12.301 20.264 -8.501 972 HB THR 637 HB THR 637 -12.956 19.020 -6.615 973 HG1 THR 637 1HG THR 637 -12.379 20.471 -4.942 974 1HG2 THR 637 3HG2 THR 637 -9.980 18.522 -6.292 975 2HG2 THR 637 1HG2 THR 637 -11.038 18.418 -4.865 976 3HG2 THR 637 2HG2 THR 637 -11.319 17.349 -6.260 977 H LYS 638 H LYS 638 -8.881 19.579 -7.928 978 HA LYS 638 HA LYS 638 -8.306 22.259 -7.107 979 1HB LYS 638 1HB LYS 638 -6.534 19.934 -7.911 980 2HB LYS 638 2HB LYS 638 -5.934 21.477 -7.337 981 1HG LYS 638 1HG LYS 638 -6.823 21.171 -5.161 982 2HG LYS 638 2HG LYS 638 -8.010 19.999 -5.699 983 1HD LYS 638 1HD LYS 638 -6.519 18.236 -5.623 984 2HD LYS 638 2HD LYS 638 -5.168 19.211 -6.165 985 1HE LYS 638 1HE LYS 638 -5.365 18.328 -3.620 986 2HE LYS 638 2HE LYS 638 -4.572 19.840 -4.020 987 H LEU 639 H LEU 639 -8.198 20.331 -10.137 988 HA LEU 639 HA LEU 639 -7.052 22.543 -11.581 989 1HB LEU 639 1HB LEU 639 -8.056 19.826 -12.432 990 2HB LEU 639 2HB LEU 639 -7.364 21.005 -13.528 991 HG LEU 639 HG LEU 639 -5.540 19.687 -13.125 992 1HD1 LEU 639 3HD1 LEU 639 -5.231 22.132 -12.311 993 2HD1 LEU 639 1HD1 LEU 639 -5.135 21.403 -10.690 994 3HD1 LEU 639 2HD1 LEU 639 -3.972 20.926 -11.950 995 1HD2 LEU 639 3HD2 LEU 639 -6.940 18.413 -11.308 996 2HD2 LEU 639 1HD2 LEU 639 -5.164 18.290 -11.339 997 3HD2 LEU 639 2HD2 LEU 639 -5.961 19.375 -10.175 998 H ALA 640 H ALA 640 -10.128 21.707 -10.394 999 HA ALA 640 HA ALA 640 -11.901 22.196 -12.373 1000 1HB ALA 640 1HB ALA 640 -12.130 21.764 -9.776 1001 2HB ALA 640 3HB ALA 640 -13.429 22.596 -10.664 1002 3HB ALA 640 2HB ALA 640 -12.266 23.538 -9.701 1003 H ALA 641 H ALA 641 -10.012 24.627 -10.479 1004 HA ALA 641 HA ALA 641 -11.204 26.887 -11.576 1005 1HB ALA 641 3HB ALA 641 -9.381 28.059 -10.602 1006 2HB ALA 641 1HB ALA 641 -9.620 26.633 -9.563 1007 3HB ALA 641 2HB ALA 641 -8.294 26.658 -10.750 1008 H ALA 642 H ALA 642 -8.724 24.644 -12.805 1009 HA ALA 642 HA ALA 642 -7.569 26.194 -14.755 1010 1HB ALA 642 2HB ALA 642 -7.261 23.677 -13.918 1011 2HB ALA 642 1HB ALA 642 -6.715 24.194 -15.531 1012 3HB ALA 642 3HB ALA 642 -8.263 23.335 -15.348 1013 H TRP 643 H TRP 643 -10.862 25.050 -14.468 1014 HA TRP 643 HA TRP 643 -11.340 25.592 -17.305 1015 1HB TRP 643 1HB TRP 643 -12.919 24.144 -15.185 1016 2HB TRP 643 2HB TRP 643 -13.629 24.632 -16.711 1017 HD1 TRP 643 HD TRP 643 -12.987 23.163 -18.866 1018 HE1 TRP 643 1HE TRP 643 -11.710 20.896 -19.305 1019 HE3 TRP 643 3HE TRP 643 -10.908 22.831 -14.238 1020 HZ2 TRP 643 2HZ TRP 643 -10.012 19.255 -17.703 1021 HZ3 TRP 643 3HZ TRP 643 -9.453 20.864 -13.757 1022 HH2 TRP 643 HH TRP 643 -8.994 19.114 -15.400 1023 H GLY 644 H GLY 644 -11.756 26.763 -13.998 1024 1HA GLY 644 2HA GLY 644 -13.939 28.490 -14.373 1025 2HA GLY 644 1HA GLY 644 -12.474 29.351 -14.804 1026 H GLY 645 H GLY 645 -13.834 27.221 -12.197 1027 1HA GLY 645 2HA GLY 645 -13.152 29.066 -10.149 1028 2HA GLY 645 1HA GLY 645 -11.980 27.764 -10.214 1029 H SER 646 H SER 646 -13.403 25.502 -10.855 1030 HA SER 646 HA SER 646 -14.731 23.967 -10.085 1031 1HB SER 646 1HB SER 646 -15.110 23.865 -7.616 1032 2HB SER 646 2HB SER 646 -13.439 24.194 -8.030 1033 HG SER 646 HG SER 646 -15.430 26.085 -7.120 1034 H GLY 647 H GLY 647 -16.998 23.478 -9.086 1035 1HA GLY 647 2HA GLY 647 -18.886 25.367 -8.469 1036 2HA GLY 647 1HA GLY 647 -19.216 23.826 -9.234 1037 H SER 648 H SER 648 -17.313 24.787 -11.555 1038 HA SER 648 HA SER 648 -19.158 26.706 -12.722 1039 1HB SER 648 1HB SER 648 -17.390 27.374 -14.178 1040 2HB SER 648 2HB SER 648 -16.642 27.176 -12.606 1041 HG SER 648 HG SER 648 -15.792 26.076 -14.809 1042 H GLU 649 H GLU 649 -20.274 26.237 -14.661 1043 HA GLU 649 HA GLU 649 -20.986 23.686 -15.153 1044 1HB GLU 649 1HB GLU 649 -21.848 24.515 -17.337 1045 2HB GLU 649 2HB GLU 649 -22.220 25.614 -16.023 1046 1HG GLU 649 1HG GLU 649 -19.868 26.712 -16.750 1047 2HG GLU 649 2HG GLU 649 -20.248 25.947 -18.280 1048 HE2 GLU 649 HE GLU 649 -21.043 27.415 -19.470 1049 H ALA 650 H ALA 650 -18.292 25.561 -16.645 1050 HA ALA 650 HA ALA 650 -17.594 23.746 -18.613 1051 1HB ALA 650 1HB ALA 650 -16.218 25.914 -17.055 1052 2HB ALA 650 2HB ALA 650 -15.225 24.835 -18.065 1053 3HB ALA 650 3HB ALA 650 -16.532 25.792 -18.802 1054 H TYR 651 H TYR 651 -16.069 24.137 -15.329 1055 HA TYR 651 HA TYR 651 -14.535 21.835 -15.475 1056 1HB TYR 651 1HB TYR 651 -14.098 23.429 -13.728 1057 2HB TYR 651 2HB TYR 651 -15.801 23.631 -13.367 1058 HD1 TYR 651 1HD TYR 651 -13.240 20.878 -13.280 1059 HD2 TYR 651 2HD TYR 651 -16.535 22.795 -11.338 1060 HE1 TYR 651 1HE TYR 651 -13.020 19.281 -11.313 1061 HE2 TYR 651 2HE TYR 651 -16.304 21.192 -9.378 1062 HH TYR 651 HH TYR 651 -14.449 19.838 -8.372 1063 H GLN 652 H GLN 652 -17.976 22.302 -14.688 1064 HA GLN 652 HA GLN 652 -18.366 19.915 -13.353 1065 1HB GLN 652 1HB GLN 652 -20.193 21.708 -14.984 1066 2HB GLN 652 2HB GLN 652 -20.799 20.242 -14.240 1067 1HG GLN 652 1HG GLN 652 -19.345 21.449 -12.166 1068 2HG GLN 652 2HG GLN 652 -20.069 22.817 -12.988 1069 1HE2 GLN 652 1HE2 GLN 652 -20.544 21.335 -10.382 1070 2HE2 GLN 652 2HE2 GLN 652 -22.251 21.051 -10.320 1071 H GLY 653 H GLY 653 -18.818 20.752 -16.861 1072 1HA GLY 653 2HA GLY 653 -18.812 19.468 -18.704 1073 2HA GLY 653 1HA GLY 653 -19.643 18.255 -17.751 1074 H VAL 654 H VAL 654 -16.457 19.395 -16.699 1075 HA VAL 654 HA VAL 654 -15.049 17.304 -18.074 1076 HB VAL 654 HB VAL 654 -14.312 19.429 -16.068 1077 1HG1 VAL 654 3HG1 VAL 654 -12.967 17.378 -15.641 1078 2HG1 VAL 654 1HG1 VAL 654 -12.416 17.422 -17.333 1079 3HG1 VAL 654 2HG1 VAL 654 -11.991 18.748 -16.224 1080 1HG2 VAL 654 2HG2 VAL 654 -14.565 19.397 -18.882 1081 2HG2 VAL 654 3HG2 VAL 654 -13.882 20.684 -17.860 1082 3HG2 VAL 654 1HG2 VAL 654 -12.819 19.427 -18.538 1083 H GLN 655 H GLN 655 -16.170 18.035 -14.720 1084 HA GLN 655 HA GLN 655 -14.961 15.948 -13.458 1085 1HB GLN 655 1HB GLN 655 -17.200 17.771 -12.950 1086 2HB GLN 655 2HB GLN 655 -17.488 16.201 -12.228 1087 1HG GLN 655 1HG GLN 655 -14.711 17.133 -11.831 1088 2HG GLN 655 2HG GLN 655 -15.891 18.237 -11.152 1089 1HE2 GLN 655 1HE2 GLN 655 -14.584 17.371 -9.247 1090 2HE2 GLN 655 2HE2 GLN 655 -15.251 16.024 -8.386 1091 H GLN 656 H GLN 656 -18.131 16.033 -15.198 1092 HA GLN 656 HA GLN 656 -18.792 13.398 -14.562 1093 1HB GLN 656 1HB GLN 656 -19.789 15.525 -16.393 1094 2HB GLN 656 2HB GLN 656 -20.163 13.890 -16.899 1095 1HG GLN 656 1HG GLN 656 -21.909 13.971 -15.445 1096 2HG GLN 656 2HG GLN 656 -20.724 13.814 -14.163 1097 1HE2 GLN 656 1HE2 GLN 656 -21.452 16.464 -16.423 1098 2HE2 GLN 656 2HE2 GLN 656 -21.799 17.679 -15.238 1099 H LYS 657 H LYS 657 -16.898 14.917 -17.186 1100 HA LYS 657 HA LYS 657 -16.811 12.616 -18.825 1101 1HB LYS 657 1HB LYS 657 -15.172 15.153 -18.687 1102 2HB LYS 657 2HB LYS 657 -14.842 13.887 -19.852 1103 1HG LYS 657 1HG LYS 657 -17.021 14.108 -20.870 1104 2HG LYS 657 2HG LYS 657 -17.629 15.073 -19.540 1105 1HD LYS 657 1HD LYS 657 -17.064 16.910 -20.749 1106 2HD LYS 657 2HD LYS 657 -15.390 16.527 -20.400 1107 1HE LYS 657 1HE LYS 657 -15.412 14.997 -22.461 1108 2HE LYS 657 2HE LYS 657 -16.994 15.645 -22.843 1109 H TRP 658 H TRP 658 -15.078 13.702 -15.943 1110 HA TRP 658 HA TRP 658 -12.866 11.936 -16.322 1111 1HB TRP 658 1HB TRP 658 -12.456 13.882 -15.069 1112 2HB TRP 658 2HB TRP 658 -13.859 13.639 -14.048 1113 HD1 TRP 658 HD TRP 658 -13.604 11.741 -12.067 1114 HE1 TRP 658 1HE TRP 658 -11.539 10.696 -10.798 1115 HE3 TRP 658 3HE TRP 658 -10.110 13.203 -15.460 1116 HZ2 TRP 658 2HZ TRP 658 -8.740 10.600 -11.343 1117 HZ3 TRP 658 3HZ TRP 658 -7.734 12.593 -15.016 1118 HH2 TRP 658 HH TRP 658 -7.027 11.337 -13.041 1119 H ASP 659 H ASP 659 -15.772 12.033 -14.129 1120 HA ASP 659 HA ASP 659 -15.305 9.502 -13.092 1121 1HB ASP 659 1HB ASP 659 -17.235 11.604 -12.828 1122 2HB ASP 659 2HB ASP 659 -18.142 10.143 -13.163 1123 HD2 ASP 659 HD ASP 659 -16.113 10.359 -9.706 1124 H ALA 660 H ALA 660 -16.862 10.741 -16.034 1125 HA ALA 660 HA ALA 660 -18.560 8.663 -16.671 1126 1HB ALA 660 2HB ALA 660 -18.756 10.537 -18.028 1127 2HB ALA 660 3HB ALA 660 -16.995 10.729 -18.201 1128 3HB ALA 660 1HB ALA 660 -17.843 9.447 -19.099 1129 H THR 661 H THR 661 -15.641 9.037 -18.702 1130 HA THR 661 HA THR 661 -15.403 6.364 -19.290 1131 HB THR 661 HB THR 661 -13.206 7.028 -20.165 1132 HG1 THR 661 1HG THR 661 -13.696 9.344 -18.426 1133 1HG2 THR 661 2HG2 THR 661 -15.409 8.274 -21.031 1134 2HG2 THR 661 3HG2 THR 661 -14.681 9.675 -20.207 1135 3HG2 THR 661 1HG2 THR 661 -13.802 8.861 -21.525 1136 H ALA 662 H ALA 662 -14.541 8.035 -16.332 1137 HA ALA 662 HA ALA 662 -12.545 6.368 -15.392 1138 1HB ALA 662 3HB ALA 662 -12.871 8.262 -14.106 1139 2HB ALA 662 2HB ALA 662 -13.737 7.065 -13.113 1140 3HB ALA 662 1HB ALA 662 -14.645 8.150 -14.193 1141 H THR 663 H THR 663 -15.830 6.228 -13.921 1142 HA THR 663 HA THR 663 -15.663 3.668 -13.013 1143 HB THR 663 HB THR 663 -17.479 5.019 -12.272 1144 HG1 THR 663 1HG THR 663 -19.211 3.612 -12.863 1145 1HG2 THR 663 3HG2 THR 663 -17.544 5.894 -15.057 1146 2HG2 THR 663 1HG2 THR 663 -19.161 5.342 -14.559 1147 3HG2 THR 663 2HG2 THR 663 -18.340 6.630 -13.645 1148 H GLU 664 H GLU 664 -16.050 4.729 -16.341 1149 HA GLU 664 HA GLU 664 -17.197 2.378 -17.299 1150 1HB GLU 664 1HB GLU 664 -17.144 4.543 -18.537 1151 2HB GLU 664 2HB GLU 664 -15.410 4.392 -18.734 1152 1HG GLU 664 1HG GLU 664 -16.947 3.600 -20.694 1153 2HG GLU 664 2HG GLU 664 -15.594 2.583 -20.241 1154 HE2 GLU 664 HE GLU 664 -18.844 2.760 -20.557 1155 H LEU 665 H LEU 665 -13.759 3.507 -17.067 1156 HA LEU 665 HA LEU 665 -12.794 1.005 -18.088 1157 1HB LEU 665 1HB LEU 665 -11.765 3.270 -18.474 1158 2HB LEU 665 2HB LEU 665 -11.251 3.255 -16.799 1159 HG LEU 665 HG LEU 665 -9.421 2.609 -18.238 1160 1HD1 LEU 665 1HD1 LEU 665 -10.128 1.327 -15.967 1161 2HD1 LEU 665 2HD1 LEU 665 -10.034 -0.050 -17.090 1162 3HD1 LEU 665 3HD1 LEU 665 -8.623 1.011 -16.863 1163 1HD2 LEU 665 2HD2 LEU 665 -10.809 1.752 -20.113 1164 2HD2 LEU 665 3HD2 LEU 665 -9.450 0.685 -19.683 1165 3HD2 LEU 665 1HD2 LEU 665 -11.104 0.269 -19.172 1166 H ASN 666 H ASN 666 -13.652 2.410 -14.984 1167 HA ASN 666 HA ASN 666 -12.004 0.759 -13.436 1168 1HB ASN 666 1HB ASN 666 -13.755 2.908 -12.979 1169 2HB ASN 666 2HB ASN 666 -14.581 1.572 -12.201 1170 1HD2 ASN 666 1HD2 ASN 666 -13.398 3.860 -10.965 1171 2HD2 ASN 666 2HD2 ASN 666 -12.157 3.322 -9.883 1172 H ASN 667 H ASN 667 -15.505 0.693 -14.424 1173 HA ASN 667 HA ASN 667 -16.121 -1.647 -13.076 1174 1HB ASN 667 1HB ASN 667 -18.204 -1.515 -14.200 1175 2HB ASN 667 2HB ASN 667 -17.662 0.150 -14.244 1176 1HD2 ASN 667 1HD2 ASN 667 -17.890 1.111 -16.101 1177 2HD2 ASN 667 2HD2 ASN 667 -17.813 0.397 -17.678 1178 H ALA 668 H ALA 668 -14.890 -0.905 -16.383 1179 HA ALA 668 HA ALA 668 -15.201 -3.459 -17.476 1180 1HB ALA 668 3HB ALA 668 -14.644 -1.126 -18.537 1181 2HB ALA 668 2HB ALA 668 -13.970 -2.600 -19.271 1182 3HB ALA 668 1HB ALA 668 -12.954 -1.584 -18.220 1183 H LEU 669 H LEU 669 -12.630 -1.936 -15.482 1184 HA LEU 669 HA LEU 669 -10.783 -4.042 -15.816 1185 1HB LEU 669 1HB LEU 669 -11.040 -1.572 -14.267 1186 2HB LEU 669 2HB LEU 669 -10.181 -2.838 -13.412 1187 HG LEU 669 HG LEU 669 -9.421 -2.128 -16.238 1188 1HD1 LEU 669 2HD1 LEU 669 -9.537 -0.061 -14.726 1189 2HD1 LEU 669 3HD1 LEU 669 -8.164 -0.781 -13.851 1190 3HD1 LEU 669 1HD1 LEU 669 -8.008 -0.382 -15.579 1191 1HD2 LEU 669 2HD2 LEU 669 -8.585 -4.168 -14.771 1192 2HD2 LEU 669 3HD2 LEU 669 -7.487 -3.276 -15.851 1193 3HD2 LEU 669 1HD2 LEU 669 -7.492 -2.932 -14.105 1194 H GLN 670 H GLN 670 -13.279 -3.266 -13.318 1195 HA GLN 670 HA GLN 670 -12.656 -5.358 -11.641 1196 1HB GLN 670 1HB GLN 670 -15.166 -3.747 -12.155 1197 2HB GLN 670 2HB GLN 670 -15.215 -5.091 -11.032 1198 1HG GLN 670 1HG GLN 670 -14.116 -3.910 -9.428 1199 2HG GLN 670 2HG GLN 670 -12.847 -3.441 -10.541 1200 1HE2 GLN 670 1HE2 GLN 670 -12.604 -1.345 -10.484 1201 2HE2 GLN 670 2HE2 GLN 670 -13.848 -0.141 -10.530 1202 H ASN 671 H ASN 671 -15.142 -5.158 -14.285 1203 HA ASN 671 HA ASN 671 -16.078 -7.718 -13.994 1204 1HB ASN 671 1HB ASN 671 -16.576 -5.562 -15.691 1205 2HB ASN 671 2HB ASN 671 -15.898 -6.733 -16.804 1206 1HD2 ASN 671 1HD2 ASN 671 -17.441 -7.724 -17.844 1207 2HD2 ASN 671 2HD2 ASN 671 -18.910 -8.365 -17.187 1208 H LEU 672 H LEU 672 -13.123 -6.404 -15.443 1209 HA LEU 672 HA LEU 672 -12.546 -8.676 -17.062 1210 1HB LEU 672 1HB LEU 672 -11.710 -6.540 -17.698 1211 2HB LEU 672 2HB LEU 672 -10.945 -6.293 -16.141 1212 HG LEU 672 HG LEU 672 -9.788 -8.652 -17.093 1213 1HD1 LEU 672 3HD1 LEU 672 -10.634 -6.942 -19.339 1214 2HD1 LEU 672 1HD1 LEU 672 -8.914 -7.402 -19.350 1215 3HD1 LEU 672 2HD1 LEU 672 -10.171 -8.661 -19.304 1216 1HD2 LEU 672 1HD2 LEU 672 -8.935 -6.390 -15.947 1217 2HD2 LEU 672 2HD2 LEU 672 -7.842 -7.541 -16.752 1218 3HD2 LEU 672 3HD2 LEU 672 -8.388 -6.081 -17.613 1219 H ALA 673 H ALA 673 -11.189 -7.388 -13.944 1220 HA ALA 673 HA ALA 673 -9.590 -9.642 -13.479 1221 1HB ALA 673 2HB ALA 673 -10.219 -7.125 -12.249 1222 2HB ALA 673 3HB ALA 673 -10.354 -8.402 -11.017 1223 3HB ALA 673 1HB ALA 673 -8.839 -8.203 -11.929 1224 H ARG 674 H ARG 674 -13.015 -9.143 -13.331 1225 HA ARG 674 HA ARG 674 -13.542 -10.927 -11.238 1226 1HB ARG 674 1HB ARG 674 -15.135 -9.602 -13.433 1227 2HB ARG 674 2HB ARG 674 -15.869 -10.975 -12.627 1228 1HG ARG 674 1HG ARG 674 -14.774 -9.391 -10.536 1229 2HG ARG 674 2HG ARG 674 -15.496 -8.243 -11.645 1230 1HD ARG 674 1HD ARG 674 -17.473 -10.158 -11.571 1231 2HD ARG 674 2HD ARG 674 -16.809 -10.333 -9.959 1232 HE ARG 674 HE ARG 674 -18.183 -7.951 -11.047 1233 2HH1 ARG 674 1HH ARG 674 -18.210 -6.340 -7.970 1234 1HH2 ARG 674 2HH2 ARG 674 -16.268 -9.316 -8.397 1235 2HH2 ARG 674 1HH2 ARG 674 -16.727 -8.086 -7.266 1236 H THR 675 H THR 675 -13.096 -11.209 -14.778 1237 HA THR 675 HA THR 675 -13.640 -14.095 -14.580 1238 HB THR 675 HB THR 675 -13.540 -12.247 -17.023 1239 HG1 THR 675 1HG THR 675 -15.259 -12.012 -15.230 1240 1HG2 THR 675 3HG2 THR 675 -13.301 -14.918 -17.163 1241 2HG2 THR 675 1HG2 THR 675 -15.047 -14.864 -16.821 1242 3HG2 THR 675 2HG2 THR 675 -14.397 -14.052 -18.266 1243 H ILE 676 H ILE 676 -11.131 -11.817 -14.558 1244 HA ILE 676 HA ILE 676 -9.306 -13.613 -15.953 1245 HB ILE 676 HB ILE 676 -9.154 -10.758 -15.029 1246 1HG1 ILE 676 1HG1 ILE 676 -9.185 -12.191 -17.671 1247 2HG1 ILE 676 2HG1 ILE 676 -10.172 -10.851 -17.123 1248 1HG2 ILE 676 2HG2 ILE 676 -6.977 -12.627 -15.110 1249 2HG2 ILE 676 3HG2 ILE 676 -6.771 -11.417 -16.399 1250 3HG2 ILE 676 1HG2 ILE 676 -6.965 -10.893 -14.709 1251 1HD1 ILE 676 1HD1 ILE 676 -7.746 -9.655 -16.944 1252 2HD1 ILE 676 2HD1 ILE 676 -7.386 -10.837 -18.225 1253 3HD1 ILE 676 3HD1 ILE 676 -8.703 -9.659 -18.446 1254 H SER 677 H SER 677 -9.653 -11.881 -12.780 1255 HA SER 677 HA SER 677 -7.536 -12.896 -11.501 1256 1HB SER 677 1HB SER 677 -9.202 -11.269 -10.572 1257 2HB SER 677 2HB SER 677 -10.334 -12.584 -10.325 1258 HG SER 677 HG SER 677 -8.160 -11.811 -8.780 1259 H GLU 678 H GLU 678 -10.514 -14.579 -12.456 1260 HA GLU 678 HA GLU 678 -10.309 -16.733 -10.728 1261 1HB GLU 678 1HB GLU 678 -11.630 -17.896 -12.694 1262 2HB GLU 678 2HB GLU 678 -12.377 -16.589 -11.796 1263 1HG GLU 678 1HG GLU 678 -12.361 -15.171 -13.596 1264 2HG GLU 678 2HG GLU 678 -10.738 -15.631 -14.069 1265 HE2 GLU 678 HE GLU 678 -14.162 -16.981 -14.902 1266 H ALA 679 H ALA 679 -8.474 -15.822 -13.574 1267 HA ALA 679 HA ALA 679 -7.668 -18.179 -14.643 1268 1HB ALA 679 1HB ALA 679 -5.972 -15.725 -14.026 1269 2HB ALA 679 2HB ALA 679 -5.591 -16.976 -15.234 1270 3HB ALA 679 3HB ALA 679 -7.022 -15.939 -15.447 1271 H GLY 680 H GLY 680 -7.036 -16.915 -11.415 1272 1HA GLY 680 2HA GLY 680 -6.030 -17.835 -9.629 1273 2HA GLY 680 1HA GLY 680 -4.705 -18.214 -10.711 1274 H GLN 681 H GLN 681 -7.814 -19.411 -9.371 1275 HA GLN 681 HA GLN 681 -6.921 -22.090 -10.110 1276 1HB GLN 681 1HB GLN 681 -7.667 -20.945 -7.509 1277 2HB GLN 681 2HB GLN 681 -8.623 -22.365 -7.885 1278 1HG GLN 681 1HG GLN 681 -6.263 -23.394 -8.597 1279 2HG GLN 681 2HG GLN 681 -5.624 -22.129 -7.567 1280 1HE2 GLN 681 1HE2 GLN 681 -6.203 -22.048 -5.363 1281 2HE2 GLN 681 2HE2 GLN 681 -6.732 -23.455 -4.502 1282 H ALA 682 H ALA 682 -9.663 -19.827 -9.606 1283 HA ALA 682 HA ALA 682 -11.834 -21.333 -9.985 1284 1HB ALA 682 3HB ALA 682 -11.009 -18.601 -10.912 1285 2HB ALA 682 1HB ALA 682 -12.543 -19.266 -11.523 1286 3HB ALA 682 2HB ALA 682 -12.289 -19.079 -9.771 1287 H MET 683 H MET 683 -10.132 -19.811 -12.819 1288 HA MET 683 HA MET 683 -11.389 -21.060 -14.788 1289 1HB MET 683 1HB MET 683 -9.130 -19.515 -14.565 1290 2HB MET 683 2HB MET 683 -8.379 -21.039 -14.993 1291 1HG MET 683 1HG MET 683 -10.599 -19.663 -16.585 1292 2HG MET 683 2HG MET 683 -8.900 -19.662 -17.014 1293 1HE MET 683 3HE MET 683 -7.620 -21.972 -16.639 1294 2HE MET 683 1HE MET 683 -8.121 -23.389 -17.592 1295 3HE MET 683 2HE MET 683 -7.755 -21.851 -18.410 1296 H ALA 684 H ALA 684 -8.990 -22.516 -12.584 1297 HA ALA 684 HA ALA 684 -8.620 -24.870 -14.132 1298 1HB ALA 684 2HB ALA 684 -7.311 -23.660 -12.062 1299 2HB ALA 684 1HB ALA 684 -7.072 -25.359 -12.535 1300 3HB ALA 684 3HB ALA 684 -8.174 -24.955 -11.197 1301 H SER 685 H SER 685 -10.681 -23.922 -11.317 1302 HA SER 685 HA SER 685 -11.709 -26.211 -10.538 1303 1HB SER 685 1HB SER 685 -13.215 -23.636 -11.155 1304 2HB SER 685 2HB SER 685 -13.939 -24.967 -10.274 1305 HG SER 685 HG SER 685 -12.910 -24.341 -8.508 1306 H THR 686 H THR 686 -13.748 -24.356 -12.884 1307 HA THR 686 HA THR 686 -13.743 -26.333 -14.888 1308 HB THR 686 HB THR 686 -15.779 -26.542 -12.658 1309 HG1 THR 686 1HG THR 686 -14.613 -28.392 -14.609 1310 1HG2 THR 686 3HG2 THR 686 -16.992 -26.096 -14.932 1311 2HG2 THR 686 1HG2 THR 686 -16.274 -27.635 -15.463 1312 3HG2 THR 686 2HG2 THR 686 -17.396 -27.606 -14.081 1313 H GLU 687 H GLU 687 -14.876 -25.678 -16.740 1314 HA GLU 687 HA GLU 687 -15.215 -22.923 -16.903 1315 1HB GLU 687 1HB GLU 687 -15.863 -23.329 -19.204 1316 2HB GLU 687 2HB GLU 687 -14.580 -24.451 -18.797 1317 1HG GLU 687 1HG GLU 687 -16.661 -26.020 -18.104 1318 2HG GLU 687 2HG GLU 687 -17.511 -24.996 -19.244 1319 HE2 GLU 687 HE GLU 687 -16.421 -26.373 -21.935 1320 H GLY 688 H GLY 688 -16.944 -21.623 -16.438 1321 1HA GLY 688 2HA GLY 688 -19.644 -22.689 -16.625 1322 2HA GLY 688 1HA GLY 688 -19.163 -21.025 -16.360 1323 H ASN 689 H ASN 689 -17.408 -23.270 -14.383 1324 HA ASN 689 HA ASN 689 -19.339 -22.934 -12.239 1325 1HB ASN 689 1HB ASN 689 -17.349 -25.015 -12.984 1326 2HB ASN 689 2HB ASN 689 -17.304 -24.607 -11.280 1327 1HD2 ASN 689 1HD2 ASN 689 -18.595 -25.692 -10.017 1328 2HD2 ASN 689 2HD2 ASN 689 -20.084 -26.466 -10.444 1329 H VAL 690 H VAL 690 -16.889 -21.225 -13.532 1330 HA VAL 690 HA VAL 690 -15.139 -20.925 -11.290 1331 HB VAL 690 HB VAL 690 -14.471 -18.873 -12.779 1332 1HG1 VAL 690 2HG1 VAL 690 -13.643 -21.530 -12.575 1333 2HG1 VAL 690 3HG1 VAL 690 -13.786 -21.247 -14.326 1334 3HG1 VAL 690 1HG1 VAL 690 -12.751 -20.191 -13.336 1335 1HG2 VAL 690 1HG2 VAL 690 -16.691 -19.366 -14.145 1336 2HG2 VAL 690 2HG2 VAL 690 -15.216 -18.779 -14.950 1337 3HG2 VAL 690 3HG2 VAL 690 -15.630 -20.509 -15.004 1338 H THR 691 H THR 691 -15.382 -19.604 -9.553 1339 HA THR 691 HA THR 691 -17.744 -17.890 -9.529 1340 HB THR 691 HB THR 691 -15.821 -18.629 -7.267 1341 HG1 THR 691 1HG THR 691 -16.730 -20.541 -8.266 1342 1HG2 THR 691 2HG2 THR 691 -18.274 -17.061 -7.452 1343 2HG2 THR 691 3HG2 THR 691 -18.573 -18.533 -6.497 1344 3HG2 THR 691 1HG2 THR 691 -17.285 -17.404 -6.013 1345 H GLY 692 H GLY 692 -15.034 -17.380 -10.985 1346 1HA GLY 692 2HA GLY 692 -14.078 -15.405 -11.584 1347 2HA GLY 692 1HA GLY 692 -13.453 -15.503 -9.950 1348 H MET 693 H MET 693 -16.942 -15.137 -10.595 1349 HA MET 693 HA MET 693 -16.821 -12.302 -10.288 1350 1HB MET 693 1HB MET 693 -18.950 -14.414 -10.742 1351 2HB MET 693 2HB MET 693 -19.471 -12.848 -10.153 1352 1HG MET 693 1HG MET 693 -17.803 -12.040 -12.171 1353 2HG MET 693 2HG MET 693 -18.315 -13.586 -12.819 1354 1HE MET 693 1HE MET 693 -19.442 -12.482 -14.831 1355 2HE MET 693 2HE MET 693 -20.397 -13.836 -14.181 1356 3HE MET 693 3HE MET 693 -21.212 -12.345 -14.710 1357 H PHE 694 H PHE 694 -15.726 -13.837 -8.046 1358 HA PHE 694 HA PHE 694 -17.764 -13.621 -5.994 1359 1HB PHE 694 1HB PHE 694 -15.665 -14.486 -4.648 1360 2HB PHE 694 2HB PHE 694 -16.364 -15.576 -5.829 1361 HD1 PHE 694 1HD PHE 694 -14.782 -16.768 -6.987 1362 HD2 PHE 694 2HD PHE 694 -13.925 -12.739 -5.965 1363 HE1 PHE 694 1HE PHE 694 -12.556 -16.950 -8.134 1364 HE2 PHE 694 2HE PHE 694 -11.700 -12.921 -7.112 1365 HZ PHE 694 HZ PHE 694 -11.042 -15.024 -8.183 1366 H ALA 695 H ALA 695 -17.090 -12.567 -3.853 1367 HA ALA 695 HA ALA 695 -15.492 -10.163 -4.419 1368 1HB ALA 695 3HB ALA 695 -18.226 -10.520 -3.247 1369 2HB ALA 695 1HB ALA 695 -17.183 -9.264 -2.540 1370 3HB ALA 695 2HB ALA 695 -17.585 -9.214 -4.273 No H/Q in entry = 1370 Start of MODEL 13 1 H ALA 1 H ALA 1 -8.530 41.025 -7.228 2 HA ALA 1 HA ALA 1 -6.183 39.318 -7.612 3 1HB ALA 1 1HB ALA 1 -8.024 37.683 -8.364 4 2HB ALA 1 3HB ALA 1 -9.182 38.875 -7.725 5 3HB ALA 1 2HB ALA 1 -7.990 38.121 -6.639 6 H GLU 2 H GLU 2 -5.369 38.866 -9.654 7 HA GLU 2 HA GLU 2 -6.605 40.431 -11.779 8 1HB GLU 2 1HB GLU 2 -3.733 39.518 -11.345 9 2HB GLU 2 2HB GLU 2 -4.287 40.177 -12.871 10 1HG GLU 2 1HG GLU 2 -3.618 42.162 -11.904 11 2HG GLU 2 2HG GLU 2 -5.244 42.121 -11.251 12 HE2 GLU 2 HE GLU 2 -2.078 42.224 -10.496 13 H MET 3 H MET 3 -4.627 37.400 -11.339 14 HA MET 3 HA MET 3 -5.574 36.316 -13.749 15 1HB MET 3 1HB MET 3 -4.089 35.242 -11.307 16 2HB MET 3 2HB MET 3 -4.553 34.156 -12.602 17 1HG MET 3 1HG MET 3 -2.729 34.802 -13.788 18 2HG MET 3 2HG MET 3 -3.357 36.436 -13.859 19 1HE MET 3 2HE MET 3 -0.982 36.636 -14.264 20 2HE MET 3 3HE MET 3 -0.199 37.658 -13.035 21 3HE MET 3 1HE MET 3 0.285 35.955 -13.215 22 H LYS 4 H LYS 4 -6.605 33.976 -13.732 23 HA LYS 4 HA LYS 4 -9.136 34.259 -12.468 24 1HB LYS 4 1HB LYS 4 -9.008 33.325 -14.679 25 2HB LYS 4 2HB LYS 4 -7.891 32.079 -14.161 26 1HG LYS 4 1HG LYS 4 -9.606 30.734 -13.539 27 2HG LYS 4 2HG LYS 4 -10.225 31.963 -12.454 28 1HD LYS 4 1HD LYS 4 -10.751 32.522 -15.327 29 2HD LYS 4 2HD LYS 4 -11.516 31.060 -14.739 30 1HE LYS 4 1HE LYS 4 -12.569 32.326 -12.878 31 2HE LYS 4 2HE LYS 4 -11.751 33.790 -13.384 32 H THR 5 H THR 5 -6.687 31.574 -12.291 33 HA THR 5 HA THR 5 -7.498 31.251 -9.475 34 HB THR 5 HB THR 5 -8.137 29.181 -10.252 35 HG1 THR 5 1HG THR 5 -6.364 28.016 -9.623 36 1HG2 THR 5 1HG2 THR 5 -7.851 29.977 -12.680 37 2HG2 THR 5 2HG2 THR 5 -6.167 29.409 -12.582 38 3HG2 THR 5 3HG2 THR 5 -7.509 28.251 -12.415 39 H ASP 6 H ASP 6 -4.744 29.995 -11.446 40 HA ASP 6 HA ASP 6 -2.809 31.653 -10.734 41 1HB ASP 6 1HB ASP 6 -3.645 30.003 -8.401 42 2HB ASP 6 2HB ASP 6 -1.921 29.967 -8.714 43 HD2 ASP 6 HD ASP 6 -2.080 33.646 -8.482 44 H ALA 7 H ALA 7 -0.973 30.861 -11.836 45 HA ALA 7 HA ALA 7 -1.148 28.325 -13.071 46 1HB ALA 7 3HB ALA 7 0.789 30.618 -12.970 47 2HB ALA 7 1HB ALA 7 1.360 29.055 -13.602 48 3HB ALA 7 2HB ALA 7 -0.022 29.874 -14.368 49 H ALA 8 H ALA 8 0.846 29.701 -10.381 50 HA ALA 8 HA ALA 8 2.421 27.468 -9.944 51 1HB ALA 8 1HB ALA 8 2.153 28.559 -7.455 52 2HB ALA 8 3HB ALA 8 1.581 29.906 -8.469 53 3HB ALA 8 2HB ALA 8 3.206 29.226 -8.727 54 H THR 9 H THR 9 -0.797 28.384 -8.548 55 HA THR 9 HA THR 9 -1.030 26.156 -6.876 56 HB THR 9 HB THR 9 -2.446 28.494 -7.454 57 HG1 THR 9 1HG THR 9 -3.701 27.606 -5.673 58 1HG2 THR 9 2HG2 THR 9 -4.058 26.022 -8.268 59 2HG2 THR 9 3HG2 THR 9 -4.807 27.553 -7.754 60 3HG2 THR 9 1HG2 THR 9 -3.810 27.501 -9.227 61 H LEU 10 H LEU 10 -2.370 26.681 -10.207 62 HA LEU 10 HA LEU 10 -3.436 24.117 -10.415 63 1HB LEU 10 1HB LEU 10 -2.471 25.998 -12.574 64 2HB LEU 10 2HB LEU 10 -3.481 24.589 -12.831 65 HG LEU 10 HG LEU 10 -4.310 26.890 -11.050 66 1HD1 LEU 10 1HD1 LEU 10 -4.651 26.539 -14.027 67 2HD1 LEU 10 2HD1 LEU 10 -5.769 27.526 -13.054 68 3HD1 LEU 10 3HD1 LEU 10 -4.041 27.948 -13.125 69 1HD2 LEU 10 2HD2 LEU 10 -5.385 24.320 -11.475 70 2HD2 LEU 10 3HD2 LEU 10 -6.117 25.686 -10.600 71 3HD2 LEU 10 1HD2 LEU 10 -6.452 25.458 -12.333 72 H ALA 11 H ALA 11 -0.165 25.434 -11.063 73 HA ALA 11 HA ALA 11 0.771 23.061 -12.309 74 1HB ALA 11 3HB ALA 11 2.050 25.544 -11.130 75 2HB ALA 11 1HB ALA 11 3.026 24.203 -11.775 76 3HB ALA 11 2HB ALA 11 1.898 25.076 -12.840 77 H GLN 12 H GLN 12 0.354 24.200 -8.984 78 HA GLN 12 HA GLN 12 2.185 22.347 -7.889 79 1HB GLN 12 1HB GLN 12 0.364 24.448 -6.928 80 2HB GLN 12 2HB GLN 12 0.381 23.062 -5.857 81 1HG GLN 12 1HG GLN 12 2.143 24.562 -5.130 82 2HG GLN 12 2HG GLN 12 2.911 23.157 -5.842 83 1HE2 GLN 12 1HE2 GLN 12 2.974 26.414 -5.681 84 2HE2 GLN 12 2HE2 GLN 12 3.746 26.823 -7.177 85 H GLU 13 H GLU 13 -1.254 22.345 -8.781 86 HA GLU 13 HA GLU 13 -1.620 19.829 -7.404 87 1HB GLU 13 1HB GLU 13 -3.660 21.426 -9.009 88 2HB GLU 13 2HB GLU 13 -3.996 20.114 -7.897 89 1HG GLU 13 1HG GLU 13 -3.680 21.429 -6.016 90 2HG GLU 13 2HG GLU 13 -2.416 22.387 -6.761 91 HE2 GLU 13 HE GLU 13 -4.384 24.478 -5.997 92 H ALA 14 H ALA 14 -1.882 21.275 -10.721 93 HA ALA 14 HA ALA 14 -2.579 18.992 -12.086 94 1HB ALA 14 1HB ALA 14 -2.458 21.383 -12.920 95 2HB ALA 14 2HB ALA 14 -0.697 21.170 -13.069 96 3HB ALA 14 3HB ALA 14 -1.800 20.166 -14.040 97 H GLY 15 H GLY 15 0.471 19.907 -10.564 98 1HA GLY 15 2HA GLY 15 2.477 18.893 -10.449 99 2HA GLY 15 1HA GLY 15 2.192 18.220 -12.042 100 H ASN 16 H ASN 16 0.462 17.812 -8.869 101 HA ASN 16 HA ASN 16 1.461 15.257 -8.439 102 1HB ASN 16 1HB ASN 16 -0.147 15.146 -6.629 103 2HB ASN 16 2HB ASN 16 0.349 16.823 -6.733 104 1HD2 ASN 16 1HD2 ASN 16 -1.252 18.157 -6.452 105 2HD2 ASN 16 2HD2 ASN 16 -2.879 17.991 -7.022 106 H PHE 17 H PHE 17 -1.186 16.591 -10.374 107 HA PHE 17 HA PHE 17 -2.708 14.204 -10.546 108 1HB PHE 17 1HB PHE 17 -3.607 16.504 -10.940 109 2HB PHE 17 2HB PHE 17 -2.443 16.770 -12.222 110 HD1 PHE 17 1HD PHE 17 -5.388 14.718 -11.290 111 HD2 PHE 17 2HD PHE 17 -2.942 16.171 -14.438 112 HE1 PHE 17 1HE PHE 17 -7.044 13.862 -12.971 113 HE2 PHE 17 2HE PHE 17 -4.598 15.315 -16.119 114 HZ PHE 17 HZ PHE 17 -6.629 14.171 -15.366 115 H GLU 18 H GLU 18 -0.493 15.928 -12.863 116 HA GLU 18 HA GLU 18 -0.606 14.337 -14.962 117 1HB GLU 18 1HB GLU 18 1.551 15.926 -13.685 118 2HB GLU 18 2HB GLU 18 2.135 14.700 -14.792 119 1HG GLU 18 1HG GLU 18 1.391 15.843 -16.618 120 2HG GLU 18 2HG GLU 18 -0.187 16.116 -15.906 121 HE2 GLU 18 HE GLU 18 0.480 19.367 -15.386 122 H ARG 19 H ARG 19 0.859 13.519 -11.816 123 HA ARG 19 HA ARG 19 2.177 11.232 -12.766 124 1HB ARG 19 1HB ARG 19 2.184 12.702 -10.407 125 2HB ARG 19 2HB ARG 19 1.341 11.250 -9.904 126 1HG ARG 19 1HG ARG 19 3.195 9.887 -10.215 127 2HG ARG 19 2HG ARG 19 3.804 10.828 -11.562 128 1HD ARG 19 1HD ARG 19 3.929 12.588 -9.337 129 2HD ARG 19 2HD ARG 19 4.465 11.041 -8.713 130 HE ARG 19 HE ARG 19 6.369 11.143 -10.098 131 2HH1 ARG 19 1HH ARG 19 7.408 13.582 -12.343 132 1HH2 ARG 19 2HH2 ARG 19 4.072 13.667 -11.049 133 2HH2 ARG 19 1HH2 ARG 19 5.193 14.465 -12.101 134 H ILE 20 H ILE 20 -1.004 11.901 -11.195 135 HA ILE 20 HA ILE 20 -1.751 9.232 -10.830 136 HB ILE 20 HB ILE 20 -3.443 11.704 -11.215 137 1HG1 ILE 20 1HG1 ILE 20 -2.711 10.451 -8.575 138 2HG1 ILE 20 2HG1 ILE 20 -1.637 11.603 -9.343 139 1HG2 ILE 20 2HG2 ILE 20 -4.485 9.319 -11.455 140 2HG2 ILE 20 3HG2 ILE 20 -4.312 9.275 -9.684 141 3HG2 ILE 20 1HG2 ILE 20 -5.287 10.552 -10.452 142 1HD1 ILE 20 1HD1 ILE 20 -4.017 12.938 -9.598 143 2HD1 ILE 20 2HD1 ILE 20 -4.303 12.042 -8.087 144 3HD1 ILE 20 3HD1 ILE 20 -2.911 13.143 -8.219 145 H SER 21 H SER 21 -2.300 11.560 -13.544 146 HA SER 21 HA SER 21 -3.871 9.865 -15.042 147 1HB SER 21 1HB SER 21 -3.609 12.288 -15.487 148 2HB SER 21 2HB SER 21 -1.939 12.041 -15.959 149 HG SER 21 HG SER 21 -2.793 11.850 -17.925 150 H GLY 22 H GLY 22 -0.290 10.322 -14.903 151 1HA GLY 22 2HA GLY 22 1.414 9.111 -15.732 152 2HA GLY 22 1HA GLY 22 0.365 8.617 -17.046 153 H ASP 23 H ASP 23 0.591 8.037 -13.455 154 HA ASP 23 HA ASP 23 1.275 5.427 -13.602 155 1HB ASP 23 1HB ASP 23 1.149 6.849 -11.526 156 2HB ASP 23 2HB ASP 23 -0.598 6.716 -11.562 157 HD2 ASP 23 HD ASP 23 0.279 5.045 -9.089 158 H LEU 24 H LEU 24 -2.030 6.932 -13.435 159 HA LEU 24 HA LEU 24 -3.539 4.643 -13.322 160 1HB LEU 24 1HB LEU 24 -4.331 6.961 -13.030 161 2HB LEU 24 2HB LEU 24 -4.174 7.227 -14.755 162 HG LEU 24 HG LEU 24 -5.799 5.152 -14.923 163 1HD1 LEU 24 2HD1 LEU 24 -5.623 4.917 -12.342 164 2HD1 LEU 24 3HD1 LEU 24 -6.804 6.248 -12.311 165 3HD1 LEU 24 1HD1 LEU 24 -7.205 4.721 -13.134 166 1HD2 LEU 24 1HD2 LEU 24 -6.249 8.047 -14.615 167 2HD2 LEU 24 2HD2 LEU 24 -6.781 6.922 -15.888 168 3HD2 LEU 24 3HD2 LEU 24 -7.691 7.034 -14.362 169 H LYS 25 H LYS 25 -2.321 6.406 -16.248 170 HA LYS 25 HA LYS 25 -3.442 4.616 -18.081 171 1HB LYS 25 1HB LYS 25 -2.871 6.551 -19.121 172 2HB LYS 25 2HB LYS 25 -1.465 6.824 -18.112 173 1HG LYS 25 1HG LYS 25 -0.059 5.589 -19.479 174 2HG LYS 25 2HG LYS 25 -1.310 4.445 -19.923 175 1HD LYS 25 1HD LYS 25 -0.714 5.803 -21.881 176 2HD LYS 25 2HD LYS 25 -2.362 6.160 -21.405 177 1HE LYS 25 1HE LYS 25 -1.745 8.351 -21.387 178 2HE LYS 25 2HE LYS 25 -0.895 7.997 -19.895 179 H THR 26 H THR 26 -0.259 4.716 -16.392 180 HA THR 26 HA THR 26 0.990 2.669 -17.763 181 HB THR 26 HB THR 26 1.132 3.881 -14.991 182 HG1 THR 26 1HG THR 26 2.830 3.412 -17.340 183 1HG2 THR 26 3HG2 THR 26 2.173 1.208 -15.780 184 2HG2 THR 26 1HG2 THR 26 3.436 2.335 -15.230 185 3HG2 THR 26 2HG2 THR 26 2.066 1.944 -14.163 186 H GLN 27 H GLN 27 -1.107 2.423 -14.817 187 HA GLN 27 HA GLN 27 -0.902 -0.331 -14.666 188 1HB GLN 27 1HB GLN 27 -3.221 1.432 -13.759 189 2HB GLN 27 2HB GLN 27 -2.871 -0.183 -13.175 190 1HG GLN 27 1HG GLN 27 -0.868 2.108 -12.960 191 2HG GLN 27 2HG GLN 27 -2.041 1.761 -11.705 192 1HE2 GLN 27 1HE2 GLN 27 0.793 0.675 -13.406 193 2HE2 GLN 27 2HE2 GLN 27 1.275 -0.585 -12.319 194 H ILE 28 H ILE 28 -3.231 1.825 -16.378 195 HA ILE 28 HA ILE 28 -5.031 -0.131 -17.164 196 HB ILE 28 HB ILE 28 -4.218 2.525 -18.317 197 1HG1 ILE 28 1HG1 ILE 28 -6.697 1.592 -16.840 198 2HG1 ILE 28 2HG1 ILE 28 -5.380 2.516 -16.146 199 1HG2 ILE 28 1HG2 ILE 28 -5.554 0.443 -19.726 200 2HG2 ILE 28 2HG2 ILE 28 -6.748 1.706 -19.346 201 3HG2 ILE 28 3HG2 ILE 28 -5.261 2.124 -20.230 202 1HD1 ILE 28 2HD1 ILE 28 -6.785 3.547 -18.624 203 2HD1 ILE 28 3HD1 ILE 28 -7.512 3.785 -17.016 204 3HD1 ILE 28 1HD1 ILE 28 -5.905 4.460 -17.375 205 H ASP 29 H ASP 29 -1.865 0.871 -18.511 206 HA ASP 29 HA ASP 29 -2.144 -0.556 -20.886 207 1HB ASP 29 1HB ASP 29 -0.330 1.227 -19.896 208 2HB ASP 29 2HB ASP 29 0.572 -0.254 -19.640 209 HD2 ASP 29 HD ASP 29 -0.192 2.058 -21.781 210 H GLN 30 H GLN 30 -0.847 -1.289 -17.600 211 HA GLN 30 HA GLN 30 0.412 -3.649 -18.150 212 1HB GLN 30 1HB GLN 30 -1.134 -2.875 -15.636 213 2HB GLN 30 2HB GLN 30 0.042 -4.170 -15.730 214 1HG GLN 30 1HG GLN 30 0.486 -1.189 -15.839 215 2HG GLN 30 2HG GLN 30 1.359 -2.402 -14.924 216 1HE2 GLN 30 1HE2 GLN 30 1.881 -0.248 -17.127 217 2HE2 GLN 30 2HE2 GLN 30 2.991 -1.021 -18.208 218 H VAL 31 H VAL 31 -3.054 -3.036 -17.299 219 HA VAL 31 HA VAL 31 -3.792 -5.746 -17.300 220 HB VAL 31 HB VAL 31 -5.302 -3.155 -17.627 221 1HG1 VAL 31 2HG1 VAL 31 -6.408 -5.197 -18.741 222 2HG1 VAL 31 3HG1 VAL 31 -6.619 -5.821 -17.087 223 3HG1 VAL 31 1HG1 VAL 31 -7.368 -4.276 -17.557 224 1HG2 VAL 31 2HG2 VAL 31 -4.131 -4.329 -15.407 225 2HG2 VAL 31 3HG2 VAL 31 -5.420 -3.103 -15.389 226 3HG2 VAL 31 1HG2 VAL 31 -5.834 -4.831 -15.284 227 H GLU 32 H GLU 32 -4.139 -3.136 -19.805 228 HA GLU 32 HA GLU 32 -5.334 -4.584 -21.728 229 1HB GLU 32 1HB GLU 32 -3.354 -2.315 -21.769 230 2HB GLU 32 2HB GLU 32 -3.765 -3.070 -23.296 231 1HG GLU 32 1HG GLU 32 -6.234 -2.741 -22.685 232 2HG GLU 32 2HG GLU 32 -5.700 -1.793 -21.311 233 HE2 GLU 32 HE GLU 32 -3.442 -0.547 -23.248 234 H SER 33 H SER 33 -1.870 -4.608 -20.786 235 HA SER 33 HA SER 33 -1.186 -6.295 -22.976 236 1HB SER 33 1HB SER 33 0.700 -5.112 -22.436 237 2HB SER 33 2HB SER 33 0.218 -4.899 -20.765 238 HG SER 33 HG SER 33 1.578 -7.117 -21.983 239 H THR 34 H THR 34 -1.372 -6.616 -19.356 240 HA THR 34 HA THR 34 -0.744 -9.299 -19.185 241 HB THR 34 HB THR 34 -2.283 -7.273 -17.556 242 HG1 THR 34 1HG THR 34 -0.054 -9.162 -17.254 243 1HG2 THR 34 3HG2 THR 34 -3.479 -9.540 -17.281 244 2HG2 THR 34 1HG2 THR 34 -1.923 -10.191 -16.714 245 3HG2 THR 34 2HG2 THR 34 -2.732 -8.895 -15.800 246 H ALA 35 H ALA 35 -3.963 -7.761 -19.747 247 HA ALA 35 HA ALA 35 -5.485 -10.046 -19.637 248 1HB ALA 35 3HB ALA 35 -6.091 -8.002 -21.739 249 2HB ALA 35 2HB ALA 35 -5.972 -7.437 -20.055 250 3HB ALA 35 1HB ALA 35 -7.146 -8.702 -20.488 251 H GLY 36 H GLY 36 -3.206 -8.912 -22.111 252 1HA GLY 36 2HA GLY 36 -2.322 -9.997 -23.878 253 2HA GLY 36 1HA GLY 36 -3.990 -10.224 -24.367 254 H SER 37 H SER 37 -2.080 -11.593 -21.594 255 HA SER 37 HA SER 37 -1.834 -14.105 -22.774 256 1HB SER 37 1HB SER 37 -1.359 -12.898 -20.082 257 2HB SER 37 2HB SER 37 -1.582 -14.636 -20.099 258 HG SER 37 HG SER 37 0.085 -14.618 -21.901 259 H LEU 38 H LEU 38 -4.308 -12.552 -20.720 260 HA LEU 38 HA LEU 38 -5.646 -14.910 -19.973 261 1HB LEU 38 1HB LEU 38 -6.274 -11.988 -20.013 262 2HB LEU 38 2HB LEU 38 -7.576 -13.131 -19.751 263 HG LEU 38 HG LEU 38 -6.970 -12.641 -17.593 264 1HD1 LEU 38 1HD1 LEU 38 -6.596 -15.159 -18.313 265 2HD1 LEU 38 2HD1 LEU 38 -4.921 -14.802 -17.828 266 3HD1 LEU 38 3HD1 LEU 38 -6.249 -14.597 -16.660 267 1HD2 LEU 38 3HD2 LEU 38 -4.513 -11.792 -18.786 268 2HD2 LEU 38 1HD2 LEU 38 -5.184 -11.395 -17.186 269 3HD2 LEU 38 2HD2 LEU 38 -4.146 -12.827 -17.385 270 H GLN 39 H GLN 39 -6.622 -12.388 -22.409 271 HA GLN 39 HA GLN 39 -8.628 -13.853 -23.514 272 1HB GLN 39 1HB GLN 39 -8.027 -12.420 -25.640 273 2HB GLN 39 2HB GLN 39 -8.578 -11.616 -24.183 274 1HG GLN 39 1HG GLN 39 -5.698 -11.992 -24.030 275 2HG GLN 39 2HG GLN 39 -6.097 -11.238 -25.561 276 1HE2 GLN 39 1HE2 GLN 39 -7.851 -11.023 -22.496 277 2HE2 GLN 39 2HE2 GLN 39 -7.648 -9.323 -22.233 278 H GLY 40 H GLY 40 -5.156 -14.271 -23.799 279 1HA GLY 40 2HA GLY 40 -3.901 -15.452 -25.327 280 2HA GLY 40 1HA GLY 40 -5.348 -15.879 -26.220 281 H GLN 41 H GLN 41 -6.178 -16.386 -23.024 282 HA GLN 41 HA GLN 41 -5.631 -19.206 -23.330 283 1HB GLN 41 1HB GLN 41 -3.813 -18.040 -21.886 284 2HB GLN 41 2HB GLN 41 -5.065 -17.834 -20.678 285 1HG GLN 41 1HG GLN 41 -4.114 -20.486 -21.858 286 2HG GLN 41 2HG GLN 41 -3.802 -19.904 -20.234 287 1HE2 GLN 41 1HE2 GLN 41 -6.172 -18.866 -19.447 288 2HE2 GLN 41 2HE2 GLN 41 -7.399 -20.084 -19.349 289 H TRP 42 H TRP 42 -7.772 -19.824 -23.530 290 HA TRP 42 HA TRP 42 -9.394 -19.617 -21.180 291 1HB TRP 42 1HB TRP 42 -10.231 -18.151 -23.687 292 2HB TRP 42 2HB TRP 42 -11.316 -18.566 -22.375 293 HD1 TRP 42 HD TRP 42 -9.429 -15.683 -23.486 294 HE1 TRP 42 1HE TRP 42 -8.905 -13.910 -21.603 295 HE3 TRP 42 3HE TRP 42 -10.471 -18.754 -19.569 296 HZ2 TRP 42 2HZ TRP 42 -8.982 -13.988 -18.752 297 HZ3 TRP 42 3HZ TRP 42 -10.221 -17.827 -17.269 298 HH2 TRP 42 HH TRP 42 -9.505 -15.532 -16.828 299 H ARG 43 H ARG 43 -11.105 -21.205 -21.260 300 HA ARG 43 HA ARG 43 -10.676 -23.084 -23.424 301 1HB ARG 43 1HB ARG 43 -11.913 -23.409 -20.647 302 2HB ARG 43 2HB ARG 43 -11.902 -24.692 -21.840 303 1HG ARG 43 1HG ARG 43 -9.224 -23.677 -21.713 304 2HG ARG 43 2HG ARG 43 -9.768 -23.854 -20.056 305 1HD ARG 43 1HD ARG 43 -10.624 -26.222 -20.809 306 2HD ARG 43 2HD ARG 43 -9.600 -25.993 -22.213 307 HE ARG 43 HE ARG 43 -8.201 -25.444 -19.705 308 2HH1 ARG 43 1HH ARG 43 -6.357 -28.387 -19.759 309 1HH2 ARG 43 2HH2 ARG 43 -9.155 -28.008 -21.958 310 2HH2 ARG 43 1HH2 ARG 43 -7.888 -29.082 -21.466 311 H GLY 44 H GLY 44 -13.279 -21.513 -21.439 312 1HA GLY 44 2HA GLY 44 -15.488 -22.525 -22.801 313 2HA GLY 44 1HA GLY 44 -14.970 -21.090 -23.662 314 H ALA 45 H ALA 45 -16.727 -19.755 -23.085 315 HA ALA 45 HA ALA 45 -18.006 -18.465 -21.813 316 1HB ALA 45 1HB ALA 45 -18.958 -19.742 -20.228 317 2HB ALA 45 3HB ALA 45 -17.613 -19.319 -19.143 318 3HB ALA 45 2HB ALA 45 -17.520 -20.787 -20.144 319 H ALA 46 H ALA 46 -15.185 -19.302 -19.668 320 HA ALA 46 HA ALA 46 -14.832 -16.790 -18.630 321 1HB ALA 46 1HB ALA 46 -12.368 -18.352 -19.198 322 2HB ALA 46 3HB ALA 46 -13.659 -19.238 -18.351 323 3HB ALA 46 2HB ALA 46 -13.004 -17.737 -17.653 324 H GLY 47 H GLY 47 -13.809 -18.147 -21.778 325 1HA GLY 47 2HA GLY 47 -12.880 -17.195 -23.589 326 2HA GLY 47 1HA GLY 47 -11.984 -16.146 -22.509 327 H THR 48 H THR 48 -15.366 -16.594 -23.774 328 HA THR 48 HA THR 48 -15.518 -14.053 -24.901 329 HB THR 48 HB THR 48 -18.062 -14.644 -24.748 330 HG1 THR 48 1HG THR 48 -17.684 -16.027 -22.831 331 1HG2 THR 48 3HG2 THR 48 -16.162 -16.785 -25.845 332 2HG2 THR 48 1HG2 THR 48 -17.865 -16.560 -26.311 333 3HG2 THR 48 2HG2 THR 48 -16.657 -15.323 -26.731 334 H ALA 49 H ALA 49 -15.990 -15.146 -21.566 335 HA ALA 49 HA ALA 49 -17.418 -12.842 -20.741 336 1HB ALA 49 3HB ALA 49 -15.922 -15.092 -19.381 337 2HB ALA 49 2HB ALA 49 -17.668 -14.749 -19.387 338 3HB ALA 49 1HB ALA 49 -16.563 -13.722 -18.442 339 H ALA 50 H ALA 50 -13.947 -13.882 -20.499 340 HA ALA 50 HA ALA 50 -13.133 -11.432 -19.338 341 1HB ALA 50 1HB ALA 50 -10.836 -12.433 -20.229 342 2HB ALA 50 3HB ALA 50 -11.831 -13.885 -20.488 343 3HB ALA 50 2HB ALA 50 -11.692 -13.181 -18.859 344 H GLN 51 H GLN 51 -12.848 -12.844 -22.674 345 HA GLN 51 HA GLN 51 -11.540 -10.825 -23.866 346 1HB GLN 51 1HB GLN 51 -11.977 -12.741 -25.175 347 2HB GLN 51 2HB GLN 51 -13.696 -12.710 -24.836 348 1HG GLN 51 1HG GLN 51 -12.594 -10.302 -26.241 349 2HG GLN 51 2HG GLN 51 -12.606 -11.791 -27.167 350 1HE2 GLN 51 1HE2 GLN 51 -14.328 -9.108 -26.334 351 2HE2 GLN 51 2HE2 GLN 51 -15.943 -9.621 -26.695 352 H ALA 52 H ALA 52 -15.157 -11.107 -23.580 353 HA ALA 52 HA ALA 52 -15.718 -8.640 -24.737 354 1HB ALA 52 2HB ALA 52 -17.291 -10.573 -24.284 355 2HB ALA 52 1HB ALA 52 -17.928 -8.973 -23.836 356 3HB ALA 52 3HB ALA 52 -17.312 -10.070 -22.577 357 H ALA 53 H ALA 53 -14.410 -9.516 -21.599 358 HA ALA 53 HA ALA 53 -15.204 -7.076 -20.322 359 1HB ALA 53 2HB ALA 53 -14.684 -9.441 -19.314 360 2HB ALA 53 1HB ALA 53 -14.174 -7.985 -18.427 361 3HB ALA 53 3HB ALA 53 -12.989 -8.903 -19.387 362 H VAL 54 H VAL 54 -12.034 -8.492 -21.415 363 HA VAL 54 HA VAL 54 -10.573 -6.163 -20.986 364 HB VAL 54 HB VAL 54 -9.138 -7.849 -21.256 365 1HG1 VAL 54 1HG1 VAL 54 -11.292 -9.096 -22.947 366 2HG1 VAL 54 2HG1 VAL 54 -9.644 -9.768 -22.965 367 3HG1 VAL 54 3HG1 VAL 54 -10.553 -9.679 -21.436 368 1HG2 VAL 54 3HG2 VAL 54 -8.797 -6.235 -23.246 369 2HG2 VAL 54 1HG2 VAL 54 -7.976 -7.814 -23.292 370 3HG2 VAL 54 2HG2 VAL 54 -9.456 -7.553 -24.244 371 H VAL 55 H VAL 55 -12.475 -7.338 -23.802 372 HA VAL 55 HA VAL 55 -11.605 -5.414 -25.619 373 HB VAL 55 HB VAL 55 -13.121 -7.604 -25.745 374 1HG1 VAL 55 3HG1 VAL 55 -15.108 -5.310 -25.719 375 2HG1 VAL 55 1HG1 VAL 55 -15.456 -6.934 -26.360 376 3HG1 VAL 55 2HG1 VAL 55 -15.067 -6.722 -24.636 377 1HG2 VAL 55 3HG2 VAL 55 -12.936 -5.233 -27.593 378 2HG2 VAL 55 1HG2 VAL 55 -12.181 -6.839 -27.730 379 3HG2 VAL 55 2HG2 VAL 55 -13.924 -6.646 -28.037 380 H ARG 56 H ARG 56 -14.464 -5.450 -23.383 381 HA ARG 56 HA ARG 56 -15.367 -2.959 -24.136 382 1HB ARG 56 1HB ARG 56 -15.834 -4.877 -21.918 383 2HB ARG 56 2HB ARG 56 -16.124 -3.212 -21.452 384 1HG ARG 56 1HG ARG 56 -18.220 -3.964 -22.304 385 2HG ARG 56 2HG ARG 56 -17.545 -2.995 -23.600 386 1HD ARG 56 1HD ARG 56 -16.502 -5.384 -24.333 387 2HD ARG 56 2HD ARG 56 -17.885 -5.985 -23.441 388 HE ARG 56 HE ARG 56 -18.427 -3.847 -25.425 389 2HH1 ARG 56 1HH ARG 56 -20.439 -5.928 -27.344 390 1HH2 ARG 56 2HH2 ARG 56 -18.513 -7.306 -24.660 391 2HH2 ARG 56 1HH2 ARG 56 -19.634 -7.684 -25.925 392 H PHE 57 H PHE 57 -13.081 -4.027 -21.550 393 HA PHE 57 HA PHE 57 -12.796 -1.507 -20.354 394 1HB PHE 57 1HB PHE 57 -11.966 -3.288 -19.050 395 2HB PHE 57 2HB PHE 57 -11.465 -4.204 -20.457 396 HD1 PHE 57 1HD PHE 57 -10.496 -1.509 -18.144 397 HD2 PHE 57 2HD PHE 57 -9.237 -4.034 -21.313 398 HE1 PHE 57 1HE PHE 57 -8.112 -0.844 -17.727 399 HE2 PHE 57 2HE PHE 57 -6.853 -3.370 -20.896 400 HZ PHE 57 HZ PHE 57 -6.319 -1.783 -19.107 401 H GLN 58 H GLN 58 -11.093 -3.166 -23.056 402 HA GLN 58 HA GLN 58 -8.962 -1.440 -23.232 403 1HB GLN 58 1HB GLN 58 -10.403 -3.194 -25.239 404 2HB GLN 58 2HB GLN 58 -9.071 -2.181 -25.757 405 1HG GLN 58 1HG GLN 58 -8.381 -3.603 -23.290 406 2HG GLN 58 2HG GLN 58 -8.901 -4.732 -24.525 407 1HE2 GLN 58 1HE2 GLN 58 -6.834 -5.566 -24.729 408 2HE2 GLN 58 2HE2 GLN 58 -5.555 -4.740 -25.555 409 H GLU 59 H GLU 59 -12.053 -1.409 -25.160 410 HA GLU 59 HA GLU 59 -11.544 0.908 -26.504 411 1HB GLU 59 1HB GLU 59 -14.137 -0.390 -25.599 412 2HB GLU 59 2HB GLU 59 -14.141 1.069 -26.570 413 1HG GLU 59 1HG GLU 59 -12.535 -1.369 -27.423 414 2HG GLU 59 2HG GLU 59 -14.243 -1.241 -27.797 415 HE2 GLU 59 HE GLU 59 -11.625 0.456 -30.037 416 H ALA 60 H ALA 60 -12.681 0.392 -23.168 417 HA ALA 60 HA ALA 60 -13.428 3.137 -22.804 418 1HB ALA 60 2HB ALA 60 -13.142 0.715 -20.998 419 2HB ALA 60 1HB ALA 60 -14.635 1.518 -21.541 420 3HB ALA 60 3HB ALA 60 -13.563 2.327 -20.373 421 H ALA 61 H ALA 61 -10.539 1.111 -22.478 422 HA ALA 61 HA ALA 61 -9.105 2.628 -20.661 423 1HB ALA 61 2HB ALA 61 -8.661 0.320 -21.861 424 2HB ALA 61 3HB ALA 61 -7.793 1.329 -23.043 425 3HB ALA 61 1HB ALA 61 -7.292 1.330 -21.335 426 H ASN 62 H ASN 62 -9.355 2.897 -24.267 427 HA ASN 62 HA ASN 62 -7.565 4.977 -24.501 428 1HB ASN 62 1HB ASN 62 -10.021 4.784 -26.279 429 2HB ASN 62 2HB ASN 62 -8.375 5.179 -26.736 430 1HD2 ASN 62 1HD2 ASN 62 -10.573 2.633 -25.748 431 2HD2 ASN 62 2HD2 ASN 62 -9.668 1.283 -26.347 432 H LYS 63 H LYS 63 -11.186 4.900 -24.169 433 HA LYS 63 HA LYS 63 -11.718 7.572 -24.392 434 1HB LYS 63 1HB LYS 63 -13.246 5.461 -24.070 435 2HB LYS 63 2HB LYS 63 -13.164 5.880 -22.371 436 1HG LYS 63 1HG LYS 63 -14.956 7.222 -22.904 437 2HG LYS 63 2HG LYS 63 -13.699 8.349 -23.373 438 1HD LYS 63 1HD LYS 63 -15.334 8.184 -25.188 439 2HD LYS 63 2HD LYS 63 -13.816 7.494 -25.727 440 1HE LYS 63 1HE LYS 63 -14.695 5.384 -25.919 441 2HE LYS 63 2HE LYS 63 -15.586 5.511 -24.415 442 H GLN 64 H GLN 64 -10.349 5.745 -21.638 443 HA GLN 64 HA GLN 64 -10.602 7.925 -19.860 444 1HB GLN 64 1HB GLN 64 -9.525 5.169 -19.812 445 2HB GLN 64 2HB GLN 64 -8.617 6.281 -18.806 446 1HG GLN 64 1HG GLN 64 -11.533 6.656 -18.530 447 2HG GLN 64 2HG GLN 64 -11.035 5.026 -18.122 448 1HE2 GLN 64 1HE2 GLN 64 -9.049 4.864 -16.727 449 2HE2 GLN 64 2HE2 GLN 64 -8.908 5.958 -15.392 450 H LYS 65 H LYS 65 -7.973 6.556 -21.919 451 HA LYS 65 HA LYS 65 -5.919 8.173 -20.988 452 1HB LYS 65 1HB LYS 65 -6.436 6.409 -23.278 453 2HB LYS 65 2HB LYS 65 -5.338 7.722 -23.654 454 1HG LYS 65 1HG LYS 65 -3.805 6.215 -22.786 455 2HG LYS 65 2HG LYS 65 -4.240 7.040 -21.302 456 1HD LYS 65 1HD LYS 65 -4.617 4.888 -20.566 457 2HD LYS 65 2HD LYS 65 -6.191 5.158 -21.289 458 1HE LYS 65 1HE LYS 65 -4.916 4.288 -23.506 459 2HE LYS 65 2HE LYS 65 -3.882 3.517 -22.320 460 H GLN 66 H GLN 66 -8.529 8.758 -23.370 461 HA GLN 66 HA GLN 66 -7.430 11.126 -24.357 462 1HB GLN 66 1HB GLN 66 -9.528 9.520 -25.062 463 2HB GLN 66 2HB GLN 66 -10.404 10.841 -24.315 464 1HG GLN 66 1HG GLN 66 -10.158 11.358 -26.678 465 2HG GLN 66 2HG GLN 66 -9.137 12.464 -25.780 466 1HE2 GLN 66 1HE2 GLN 66 -7.343 12.837 -26.818 467 2HE2 GLN 66 2HE2 GLN 66 -6.343 11.687 -27.643 468 H GLU 67 H GLU 67 -10.041 10.500 -21.904 469 HA GLU 67 HA GLU 67 -10.401 13.179 -21.288 470 1HB GLU 67 1HB GLU 67 -11.239 10.558 -20.214 471 2HB GLU 67 2HB GLU 67 -11.095 11.784 -18.971 472 1HG GLU 67 1HG GLU 67 -13.384 11.638 -20.102 473 2HG GLU 67 2HG GLU 67 -12.670 13.238 -20.061 474 HE2 GLU 67 HE GLU 67 -14.025 12.879 -23.165 475 H LEU 68 H LEU 68 -7.927 10.853 -20.383 476 HA LEU 68 HA LEU 68 -7.125 12.149 -17.991 477 1HB LEU 68 1HB LEU 68 -6.046 10.008 -19.771 478 2HB LEU 68 2HB LEU 68 -4.968 10.759 -18.611 479 HG LEU 68 HG LEU 68 -7.496 9.199 -18.051 480 1HD1 LEU 68 3HD1 LEU 68 -4.659 8.595 -18.064 481 2HD1 LEU 68 1HD1 LEU 68 -5.387 8.280 -16.471 482 3HD1 LEU 68 2HD1 LEU 68 -6.062 7.507 -17.925 483 1HD2 LEU 68 3HD2 LEU 68 -6.162 11.257 -16.404 484 2HD2 LEU 68 1HD2 LEU 68 -7.830 10.637 -16.354 485 3HD2 LEU 68 2HD2 LEU 68 -6.516 9.721 -15.577 486 H ASP 69 H ASP 69 -5.812 12.093 -21.377 487 HA ASP 69 HA ASP 69 -3.841 13.971 -20.824 488 1HB ASP 69 1HB ASP 69 -4.590 12.371 -22.983 489 2HB ASP 69 2HB ASP 69 -4.936 13.980 -23.585 490 HD2 ASP 69 HD ASP 69 -2.138 12.139 -22.289 491 H GLU 70 H GLU 70 -7.104 14.186 -22.429 492 HA GLU 70 HA GLU 70 -7.132 16.787 -23.093 493 1HB GLU 70 1HB GLU 70 -9.413 16.522 -23.380 494 2HB GLU 70 2HB GLU 70 -8.948 14.839 -23.237 495 1HG GLU 70 1HG GLU 70 -9.507 14.860 -20.817 496 2HG GLU 70 2HG GLU 70 -9.899 16.566 -20.903 497 HE2 GLU 70 HE GLU 70 -11.103 14.236 -23.437 498 H ILE 71 H ILE 71 -7.891 15.358 -19.857 499 HA ILE 71 HA ILE 71 -8.486 17.883 -18.699 500 HB ILE 71 HB ILE 71 -8.011 15.111 -17.637 501 1HG1 ILE 71 1HG1 ILE 71 -10.483 16.863 -17.583 502 2HG1 ILE 71 2HG1 ILE 71 -10.139 15.704 -18.852 503 1HG2 ILE 71 2HG2 ILE 71 -7.761 17.608 -16.183 504 2HG2 ILE 71 3HG2 ILE 71 -9.102 16.619 -15.556 505 3HG2 ILE 71 1HG2 ILE 71 -7.460 15.937 -15.649 506 1HD1 ILE 71 1HD1 ILE 71 -10.165 14.902 -15.915 507 2HD1 ILE 71 2HD1 ILE 71 -11.632 14.880 -16.922 508 3HD1 ILE 71 3HD1 ILE 71 -10.249 13.842 -17.342 509 H SER 72 H SER 72 -5.608 15.705 -18.796 510 HA SER 72 HA SER 72 -4.073 17.194 -17.056 511 1HB SER 72 1HB SER 72 -2.311 15.797 -17.692 512 2HB SER 72 2HB SER 72 -3.699 14.829 -18.149 513 HG SER 72 HG SER 72 -1.910 15.096 -19.788 514 H THR 73 H THR 73 -5.027 17.731 -20.401 515 HA THR 73 HA THR 73 -2.923 19.708 -20.812 516 HB THR 73 HB THR 73 -5.027 18.317 -22.513 517 HG1 THR 73 1HG THR 73 -3.043 17.264 -22.560 518 1HG2 THR 73 2HG2 THR 73 -4.162 21.036 -22.897 519 2HG2 THR 73 3HG2 THR 73 -3.266 20.028 -24.059 520 3HG2 THR 73 1HG2 THR 73 -5.046 20.006 -24.049 521 H ASN 74 H ASN 74 -6.346 19.451 -19.961 522 HA ASN 74 HA ASN 74 -7.231 21.893 -20.712 523 1HB ASN 74 1HB ASN 74 -7.902 19.910 -18.603 524 2HB ASN 74 2HB ASN 74 -8.380 21.541 -18.175 525 1HD2 ASN 74 1HD2 ASN 74 -8.838 18.853 -20.306 526 2HD2 ASN 74 2HD2 ASN 74 -10.259 19.408 -21.126 527 H ILE 75 H ILE 75 -4.937 20.966 -18.179 528 HA ILE 75 HA ILE 75 -5.161 23.362 -16.661 529 HB ILE 75 HB ILE 75 -2.823 21.471 -16.694 530 1HG1 ILE 75 1HG1 ILE 75 -4.765 20.045 -16.619 531 2HG1 ILE 75 2HG1 ILE 75 -4.026 20.100 -15.031 532 1HG2 ILE 75 3HG2 ILE 75 -3.117 23.753 -15.323 533 2HG2 ILE 75 1HG2 ILE 75 -3.952 22.645 -14.208 534 3HG2 ILE 75 2HG2 ILE 75 -2.263 22.332 -14.675 535 1HD1 ILE 75 1HD1 ILE 75 -6.396 21.830 -15.874 536 2HD1 ILE 75 2HD1 ILE 75 -6.528 20.311 -14.955 537 3HD1 ILE 75 3HD1 ILE 75 -5.698 21.715 -14.241 538 H ARG 76 H ARG 76 -2.949 22.126 -19.236 539 HA ARG 76 HA ARG 76 -1.183 24.200 -19.184 540 1HB ARG 76 1HB ARG 76 -2.167 22.366 -21.401 541 2HB ARG 76 2HB ARG 76 -0.985 23.609 -21.758 542 1HG ARG 76 1HG ARG 76 0.113 21.445 -21.211 543 2HG ARG 76 2HG ARG 76 0.561 22.695 -20.067 544 1HD ARG 76 1HD ARG 76 -1.042 21.840 -18.410 545 2HD ARG 76 2HD ARG 76 -1.696 20.696 -19.566 546 HE ARG 76 HE ARG 76 0.705 20.352 -17.992 547 2HH1 ARG 76 1HH ARG 76 1.872 17.550 -19.681 548 1HH2 ARG 76 2HH2 ARG 76 -0.679 19.578 -21.161 549 2HH2 ARG 76 1HH2 ARG 76 0.303 18.169 -21.384 550 H GLN 77 H GLN 77 -4.396 23.900 -20.768 551 HA GLN 77 HA GLN 77 -4.103 26.335 -22.186 552 1HB GLN 77 1HB GLN 77 -6.547 24.607 -21.600 553 2HB GLN 77 2HB GLN 77 -6.561 25.992 -22.674 554 1HG GLN 77 1HG GLN 77 -4.325 24.314 -23.411 555 2HG GLN 77 2HG GLN 77 -5.741 23.292 -23.259 556 1HE2 GLN 77 1HE2 GLN 77 -7.141 23.209 -24.857 557 2HE2 GLN 77 2HE2 GLN 77 -7.239 24.287 -26.209 558 H ALA 78 H ALA 78 -4.994 25.405 -18.943 559 HA ALA 78 HA ALA 78 -6.744 27.512 -18.335 560 1HB ALA 78 3HB ALA 78 -4.893 26.354 -16.276 561 2HB ALA 78 1HB ALA 78 -6.644 26.662 -16.189 562 3HB ALA 78 2HB ALA 78 -6.032 25.257 -17.094 563 H GLY 79 H GLY 79 -3.319 27.377 -18.963 564 1HA GLY 79 2HA GLY 79 -3.080 30.168 -18.025 565 2HA GLY 79 1HA GLY 79 -2.227 29.466 -19.385 566 H VAL 80 H VAL 80 -1.987 26.865 -17.601 567 HA VAL 80 HA VAL 80 0.030 27.851 -15.733 568 HB VAL 80 HB VAL 80 -0.934 25.016 -15.996 569 1HG1 VAL 80 1HG1 VAL 80 0.727 26.545 -14.153 570 2HG1 VAL 80 2HG1 VAL 80 -0.608 25.719 -13.314 571 3HG1 VAL 80 3HG1 VAL 80 0.526 24.784 -14.318 572 1HG2 VAL 80 2HG2 VAL 80 -2.933 26.489 -15.893 573 2HG2 VAL 80 3HG2 VAL 80 -2.751 25.462 -14.450 574 3HG2 VAL 80 1HG2 VAL 80 -2.311 27.186 -14.378 575 H GLN 81 H GLN 81 1.758 28.366 -17.126 576 HA GLN 81 HA GLN 81 3.010 25.998 -18.235 577 1HB GLN 81 1HB GLN 81 3.730 27.703 -20.177 578 2HB GLN 81 2HB GLN 81 2.267 26.746 -20.286 579 1HG GLN 81 1HG GLN 81 0.891 28.570 -20.035 580 2HG GLN 81 2HG GLN 81 1.914 29.305 -18.817 581 1HE2 GLN 81 1HE2 GLN 81 2.967 31.056 -19.350 582 2HE2 GLN 81 2HE2 GLN 81 3.375 31.592 -20.946 583 H TYR 82 H TYR 82 3.185 28.214 -15.946 584 HA TYR 82 HA TYR 82 6.075 28.314 -16.042 585 1HB TYR 82 1HB TYR 82 6.027 30.800 -15.737 586 2HB TYR 82 2HB TYR 82 5.208 30.388 -17.230 587 HD1 TYR 82 1HD TYR 82 4.961 32.169 -14.169 588 HD2 TYR 82 2HD TYR 82 2.599 30.104 -17.079 589 HE1 TYR 82 1HE TYR 82 2.890 33.417 -13.385 590 HE2 TYR 82 2HE TYR 82 0.536 31.359 -16.284 591 HH TYR 82 HH TYR 82 -0.213 32.980 -15.039 592 H SER 83 H SER 83 5.955 26.903 -14.212 593 HA SER 83 HA SER 83 5.289 28.367 -11.810 594 1HB SER 83 1HB SER 83 3.329 27.174 -11.709 595 2HB SER 83 2HB SER 83 3.907 25.923 -12.792 596 HG SER 83 HG SER 83 3.780 25.888 -10.070 597 H ARG 84 H ARG 84 6.496 25.218 -13.174 598 HA ARG 84 HA ARG 84 8.310 25.001 -10.969 599 1HB ARG 84 1HB ARG 84 7.216 23.226 -13.058 600 2HB ARG 84 2HB ARG 84 8.940 22.990 -12.851 601 1HG ARG 84 1HG ARG 84 8.027 23.162 -10.213 602 2HG ARG 84 2HG ARG 84 6.717 22.319 -11.016 603 1HD ARG 84 1HD ARG 84 9.563 21.436 -11.558 604 2HD ARG 84 2HD ARG 84 8.810 20.972 -10.045 605 HE ARG 84 HE ARG 84 7.011 20.431 -12.233 606 2HH1 ARG 84 1HH ARG 84 7.765 17.055 -12.553 607 1HH2 ARG 84 2HH2 ARG 84 9.968 19.198 -10.719 608 2HH2 ARG 84 1HH2 ARG 84 9.710 17.570 -11.251 609 H ALA 85 H ALA 85 8.441 27.148 -13.222 610 HA ALA 85 HA ALA 85 10.754 26.513 -14.745 611 1HB ALA 85 1HB ALA 85 10.254 29.353 -14.473 612 2HB ALA 85 2HB ALA 85 10.024 28.302 -15.891 613 3HB ALA 85 3HB ALA 85 8.717 28.483 -14.697 614 H ASP 86 H ASP 86 11.661 25.721 -12.405 615 HA ASP 86 HA ASP 86 13.200 27.994 -11.418 616 1HB ASP 86 1HB ASP 86 12.739 25.426 -9.863 617 2HB ASP 86 2HB ASP 86 13.239 26.987 -9.244 618 HD2 ASP 86 HD ASP 86 11.155 25.421 -8.358 619 H GLU 87 H GLU 87 13.988 26.540 -13.748 620 HA GLU 87 HA GLU 87 15.656 24.377 -13.031 621 1HB GLU 87 1HB GLU 87 14.835 25.788 -15.489 622 2HB GLU 87 2HB GLU 87 16.504 25.257 -15.544 623 1HG GLU 87 1HG GLU 87 15.662 22.952 -14.738 624 2HG GLU 87 2HG GLU 87 14.038 23.537 -15.037 625 HE2 GLU 87 HE GLU 87 16.741 22.272 -17.252 626 H GLU 88 H GLU 88 15.922 27.623 -12.370 627 HA GLU 88 HA GLU 88 18.355 28.434 -13.191 628 1HB GLU 88 1HB GLU 88 16.478 29.463 -11.551 629 2HB GLU 88 2HB GLU 88 17.625 28.967 -10.323 630 1HG GLU 88 1HG GLU 88 18.312 31.173 -10.838 631 2HG GLU 88 2HG GLU 88 19.429 30.185 -11.758 632 HE2 GLU 88 HE GLU 88 18.767 32.687 -13.663 633 H GLN 89 H GLN 89 17.559 26.217 -10.467 634 HA GLN 89 HA GLN 89 20.387 25.955 -9.920 635 1HB GLN 89 1HB GLN 89 17.850 25.339 -8.449 636 2HB GLN 89 2HB GLN 89 19.216 24.293 -8.116 637 1HG GLN 89 1HG GLN 89 20.626 26.303 -7.611 638 2HG GLN 89 2HG GLN 89 19.253 27.344 -7.933 639 1HE2 GLN 89 1HE2 GLN 89 20.531 24.807 -5.866 640 2HE2 GLN 89 2HE2 GLN 89 19.536 25.103 -4.479 641 H GLN 90 H GLN 90 18.925 24.918 -12.411 642 HA GLN 90 HA GLN 90 18.456 22.275 -12.368 643 1HB GLN 90 1HB GLN 90 18.092 23.509 -14.388 644 2HB GLN 90 2HB GLN 90 19.764 24.027 -14.476 645 1HG GLN 90 1HG GLN 90 19.697 21.128 -14.402 646 2HG GLN 90 2HG GLN 90 18.579 21.681 -15.633 647 1HE2 GLN 90 1HE2 GLN 90 19.308 22.982 -17.340 648 2HE2 GLN 90 2HE2 GLN 90 20.970 23.027 -17.827 649 H GLN 91 H GLN 91 21.628 23.944 -12.330 650 HA GLN 91 HA GLN 91 23.264 21.881 -12.956 651 1HB GLN 91 1HB GLN 91 23.868 24.311 -12.453 652 2HB GLN 91 2HB GLN 91 23.815 23.908 -10.749 653 1HG GLN 91 1HG GLN 91 25.411 21.880 -11.947 654 2HG GLN 91 2HG GLN 91 25.926 23.376 -12.701 655 1HE2 GLN 91 1HE2 GLN 91 27.148 24.779 -11.623 656 2HE2 GLN 91 2HE2 GLN 91 27.637 24.643 -9.967 657 H ALA 92 H ALA 92 21.161 22.202 -10.200 658 HA ALA 92 HA ALA 92 22.669 20.270 -8.636 659 1HB ALA 92 3HB ALA 92 21.200 20.849 -6.863 660 2HB ALA 92 2HB ALA 92 19.981 21.512 -7.978 661 3HB ALA 92 1HB ALA 92 21.513 22.380 -7.716 662 H LEU 93 H LEU 93 21.711 19.423 -11.246 663 HA LEU 93 HA LEU 93 19.272 18.011 -10.914 664 1HB LEU 93 1HB LEU 93 19.517 17.400 -13.090 665 2HB LEU 93 2HB LEU 93 20.453 18.882 -13.046 666 HG LEU 93 HG LEU 93 21.904 17.586 -14.214 667 1HD1 LEU 93 3HD1 LEU 93 22.578 17.811 -11.470 668 2HD1 LEU 93 1HD1 LEU 93 23.142 16.217 -12.025 669 3HD1 LEU 93 2HD1 LEU 93 23.665 17.691 -12.874 670 1HD2 LEU 93 3HD2 LEU 93 20.277 15.433 -13.213 671 2HD2 LEU 93 1HD2 LEU 93 21.299 15.502 -14.669 672 3HD2 LEU 93 2HD2 LEU 93 21.999 14.993 -13.114 673 H SER 94 H SER 94 20.421 17.349 -8.628 674 HA SER 94 HA SER 94 21.940 14.934 -9.029 675 1HB SER 94 1HB SER 94 21.344 16.761 -6.727 676 2HB SER 94 2HB SER 94 21.639 15.080 -6.332 677 HG SER 94 HG SER 94 23.647 15.309 -7.703 678 H SER 95 H SER 95 18.832 15.549 -9.477 679 HA SER 95 HA SER 95 17.558 13.862 -7.627 680 1HB SER 95 1HB SER 95 16.398 15.682 -8.863 681 2HB SER 95 2HB SER 95 16.652 14.833 -10.374 682 HG SER 95 HG SER 95 15.040 13.975 -8.130 683 H GLN 96 H GLN 96 18.676 13.503 -11.055 684 HA GLN 96 HA GLN 96 17.781 10.827 -11.195 685 1HB GLN 96 1HB GLN 96 18.007 12.346 -13.177 686 2HB GLN 96 2HB GLN 96 19.749 12.325 -12.981 687 1HG GLN 96 1HG GLN 96 19.509 9.706 -13.101 688 2HG GLN 96 2HG GLN 96 17.918 10.029 -13.762 689 1HE2 GLN 96 1HE2 GLN 96 20.902 9.256 -14.613 690 2HE2 GLN 96 2HE2 GLN 96 21.065 10.018 -16.160 691 H MET 97 H MET 97 21.011 12.439 -10.846 692 HA MET 97 HA MET 97 22.515 10.148 -10.826 693 1HB MET 97 1HB MET 97 22.934 12.890 -10.540 694 2HB MET 97 2HB MET 97 23.354 12.315 -8.939 695 1HG MET 97 1HG MET 97 24.503 11.114 -11.503 696 2HG MET 97 2HG MET 97 25.295 12.390 -10.600 697 1HE MET 97 2HE MET 97 26.613 12.201 -8.720 698 2HE MET 97 3HE MET 97 25.317 11.834 -7.556 699 3HE MET 97 1HE MET 97 26.787 10.830 -7.599 700 H GLY 98 H GLY 98 22.183 8.376 -9.542 701 1HA GLY 98 2HA GLY 98 20.766 7.982 -7.358 702 2HA GLY 98 1HA GLY 98 22.151 8.787 -6.648 703 H PHE 99 H PHE 99 21.507 6.133 -5.952 704 HA PHE 99 HA PHE 99 23.786 4.732 -7.148 705 1HB PHE 99 1HB PHE 99 22.386 4.856 -4.448 706 2HB PHE 99 2HB PHE 99 23.208 3.366 -4.865 707 HD1 PHE 99 1HD PHE 99 24.104 6.955 -5.402 708 HD2 PHE 99 2HD PHE 99 25.173 3.231 -3.672 709 HE1 PHE 99 1HE PHE 99 26.280 7.939 -4.629 710 HE2 PHE 99 2HE PHE 99 27.350 4.214 -2.899 711 HZ PHE 99 HZ PHE 99 27.877 6.556 -3.388 712 H MET 601 H MET 601 9.578 -20.718 -19.132 713 HA MET 601 HA MET 601 7.369 -19.848 -20.652 714 1HB MET 601 1HB MET 601 9.010 -19.908 -22.523 715 2HB MET 601 2HB MET 601 9.758 -19.203 -21.103 716 1HG MET 601 1HG MET 601 10.099 -22.103 -21.057 717 2HG MET 601 2HG MET 601 10.658 -21.466 -22.591 718 1HE MET 601 2HE MET 601 12.759 -21.180 -22.916 719 2HE MET 601 3HE MET 601 14.047 -20.578 -21.845 720 3HE MET 601 1HE MET 601 13.416 -22.229 -21.637 721 H THR 602 H THR 602 6.675 -22.310 -19.421 722 HA THR 602 HA THR 602 7.102 -24.648 -20.673 723 HB THR 602 HB THR 602 4.467 -23.435 -19.688 724 HG1 THR 602 1HG THR 602 6.542 -25.202 -18.593 725 1HG2 THR 602 2HG2 THR 602 5.321 -26.350 -20.098 726 2HG2 THR 602 3HG2 THR 602 3.870 -25.833 -19.206 727 3HG2 THR 602 1HG2 THR 602 3.998 -25.521 -20.954 728 H GLU 603 H GLU 603 5.121 -21.938 -21.938 729 HA GLU 603 HA GLU 603 5.442 -23.074 -24.540 730 1HB GLU 603 1HB GLU 603 2.934 -22.903 -25.015 731 2HB GLU 603 2HB GLU 603 3.432 -24.253 -24.016 732 1HG GLU 603 1HG GLU 603 2.867 -21.848 -22.407 733 2HG GLU 603 2HG GLU 603 1.482 -22.331 -23.367 734 HE2 GLU 603 HE GLU 603 2.309 -25.602 -22.514 735 H GLN 604 H GLN 604 6.200 -21.337 -25.665 736 HA GLN 604 HA GLN 604 5.995 -18.756 -24.788 737 1HB GLN 604 1HB GLN 604 6.595 -18.197 -27.243 738 2HB GLN 604 2HB GLN 604 7.701 -19.228 -26.357 739 1HG GLN 604 1HG GLN 604 7.429 -20.871 -27.892 740 2HG GLN 604 2HG GLN 604 5.715 -20.941 -27.535 741 1HE2 GLN 604 1HE2 GLN 604 4.829 -21.119 -29.478 742 2HE2 GLN 604 2HE2 GLN 604 4.992 -19.994 -30.785 743 H GLN 605 H GLN 605 3.779 -20.701 -26.783 744 HA GLN 605 HA GLN 605 2.334 -18.742 -27.983 745 1HB GLN 605 1HB GLN 605 1.367 -21.382 -26.800 746 2HB GLN 605 2HB GLN 605 0.425 -20.402 -27.906 747 1HG GLN 605 1HG GLN 605 2.955 -20.643 -29.155 748 2HG GLN 605 2HG GLN 605 2.645 -22.231 -28.483 749 1HE2 GLN 605 1HE2 GLN 605 1.494 -19.717 -30.625 750 2HE2 GLN 605 2HE2 GLN 605 0.391 -20.673 -31.558 751 H TRP 606 H TRP 606 2.066 -20.021 -24.621 752 HA TRP 606 HA TRP 606 0.857 -17.556 -23.792 753 1HB TRP 606 1HB TRP 606 -1.192 -18.437 -22.951 754 2HB TRP 606 2HB TRP 606 -1.096 -18.765 -24.670 755 HD1 TRP 606 HD TRP 606 -0.736 -21.406 -25.380 756 HE1 TRP 606 1HE TRP 606 -1.259 -23.701 -24.186 757 HE3 TRP 606 3HE TRP 606 -1.219 -19.465 -20.705 758 HZ2 TRP 606 2HZ TRP 606 -1.804 -24.430 -21.482 759 HZ3 TRP 606 3HZ TRP 606 -1.747 -21.037 -18.844 760 HH2 TRP 606 HH TRP 606 -2.037 -23.441 -19.173 761 H ASN 607 H ASN 607 2.782 -17.443 -22.510 762 HA ASN 607 HA ASN 607 3.853 -19.477 -21.075 763 1HB ASN 607 1HB ASN 607 3.670 -16.506 -20.346 764 2HB ASN 607 2HB ASN 607 4.759 -17.634 -19.563 765 1HD2 ASN 607 1HD2 ASN 607 5.905 -15.549 -20.650 766 2HD2 ASN 607 2HD2 ASN 607 6.730 -15.909 -22.130 767 H PHE 608 H PHE 608 3.078 -20.661 -19.317 768 HA PHE 608 HA PHE 608 0.571 -20.059 -18.190 769 1HB PHE 608 1HB PHE 608 2.146 -22.260 -18.471 770 2HB PHE 608 2HB PHE 608 2.696 -21.797 -16.872 771 HD1 PHE 608 1HD PHE 608 0.665 -21.233 -15.194 772 HD2 PHE 608 2HD PHE 608 0.423 -23.779 -18.580 773 HE1 PHE 608 1HE PHE 608 -1.311 -22.400 -14.176 774 HE2 PHE 608 2HE PHE 608 -1.553 -24.945 -17.562 775 HZ PHE 608 HZ PHE 608 -2.396 -24.242 -15.372 776 H ALA 609 H ALA 609 3.977 -19.724 -17.013 777 HA ALA 609 HA ALA 609 3.307 -18.895 -14.430 778 1HB ALA 609 1HB ALA 609 5.668 -19.066 -16.170 779 2HB ALA 609 2HB ALA 609 5.734 -17.684 -15.050 780 3HB ALA 609 3HB ALA 609 5.522 -19.334 -14.416 781 H GLY 610 H GLY 610 2.852 -17.384 -17.492 782 1HA GLY 610 2HA GLY 610 2.771 -15.129 -18.066 783 2HA GLY 610 1HA GLY 610 2.957 -14.674 -16.384 784 H ILE 611 H ILE 611 0.655 -16.612 -18.437 785 HA ILE 611 HA ILE 611 -1.518 -14.962 -17.977 786 HB ILE 611 HB ILE 611 -1.264 -16.640 -19.778 787 1HG1 ILE 611 1HG1 ILE 611 -3.500 -15.607 -18.790 788 2HG1 ILE 611 2HG1 ILE 611 -3.511 -16.770 -20.102 789 1HG2 ILE 611 3HG2 ILE 611 -1.389 -18.501 -17.465 790 2HG2 ILE 611 1HG2 ILE 611 -2.267 -18.980 -18.938 791 3HG2 ILE 611 2HG2 ILE 611 -0.522 -18.638 -19.014 792 1HD1 ILE 611 2HD1 ILE 611 -3.554 -17.837 -17.283 793 2HD1 ILE 611 3HD1 ILE 611 -5.044 -17.115 -17.939 794 3HD1 ILE 611 1HD1 ILE 611 -4.293 -18.506 -18.758 795 H GLU 612 H GLU 612 0.076 -17.266 -15.895 796 HA GLU 612 HA GLU 612 -2.166 -17.853 -14.307 797 1HB GLU 612 1HB GLU 612 -0.367 -19.399 -14.194 798 2HB GLU 612 2HB GLU 612 0.830 -18.140 -13.962 799 1HG GLU 612 1HG GLU 612 -0.268 -17.618 -11.716 800 2HG GLU 612 2HG GLU 612 -1.285 -19.026 -11.948 801 HE2 GLU 612 HE GLU 612 2.326 -19.270 -10.559 802 H ALA 613 H ALA 613 0.719 -15.695 -13.774 803 HA ALA 613 HA ALA 613 -0.545 -14.485 -11.502 804 1HB ALA 613 1HB ALA 613 1.514 -13.221 -11.351 805 2HB ALA 613 3HB ALA 613 1.961 -13.660 -13.017 806 3HB ALA 613 2HB ALA 613 1.927 -14.906 -11.747 807 H ALA 614 H ALA 614 -0.627 -14.107 -14.946 808 HA ALA 614 HA ALA 614 -0.814 -11.438 -15.369 809 1HB ALA 614 2HB ALA 614 -2.548 -13.662 -16.520 810 2HB ALA 614 3HB ALA 614 -2.338 -12.045 -17.234 811 3HB ALA 614 1HB ALA 614 -0.951 -13.154 -17.119 812 H ALA 615 H ALA 615 -3.441 -13.646 -14.194 813 HA ALA 615 HA ALA 615 -5.422 -11.713 -14.026 814 1HB ALA 615 2HB ALA 615 -6.548 -13.574 -13.472 815 2HB ALA 615 3HB ALA 615 -5.009 -14.457 -13.330 816 3HB ALA 615 1HB ALA 615 -5.698 -13.635 -11.909 817 H SER 616 H SER 616 -3.056 -12.873 -11.528 818 HA SER 616 HA SER 616 -3.927 -11.316 -9.480 819 1HB SER 616 1HB SER 616 -1.770 -13.024 -9.970 820 2HB SER 616 2HB SER 616 -0.983 -11.496 -9.632 821 HG SER 616 HG SER 616 -3.096 -12.164 -7.880 822 H ALA 617 H ALA 617 -2.058 -10.446 -12.372 823 HA ALA 617 HA ALA 617 -1.138 -7.949 -11.364 824 1HB ALA 617 1HB ALA 617 -0.506 -9.590 -13.475 825 2HB ALA 617 3HB ALA 617 0.016 -7.896 -13.319 826 3HB ALA 617 2HB ALA 617 -1.421 -8.299 -14.290 827 H ILE 618 H ILE 618 -3.970 -9.119 -13.246 828 HA ILE 618 HA ILE 618 -4.951 -6.613 -13.964 829 HB ILE 618 HB ILE 618 -6.383 -9.225 -13.464 830 1HG1 ILE 618 1HG1 ILE 618 -4.535 -9.280 -15.147 831 2HG1 ILE 618 2HG1 ILE 618 -6.119 -9.668 -15.790 832 1HG2 ILE 618 3HG2 ILE 618 -7.308 -6.700 -14.857 833 2HG2 ILE 618 1HG2 ILE 618 -8.123 -8.278 -14.977 834 3HG2 ILE 618 2HG2 ILE 618 -8.002 -7.455 -13.403 835 1HD1 ILE 618 1HD1 ILE 618 -5.423 -6.773 -15.886 836 2HD1 ILE 618 2HD1 ILE 618 -4.419 -7.828 -16.909 837 3HD1 ILE 618 3HD1 ILE 618 -6.186 -7.802 -17.122 838 H GLN 619 H GLN 619 -5.452 -8.646 -11.024 839 HA GLN 619 HA GLN 619 -7.397 -7.093 -9.879 840 1HB GLN 619 1HB GLN 619 -5.566 -9.216 -9.062 841 2HB GLN 619 2HB GLN 619 -5.784 -8.065 -7.759 842 1HG GLN 619 1HG GLN 619 -8.096 -9.324 -9.307 843 2HG GLN 619 2HG GLN 619 -7.482 -9.960 -7.794 844 1HE2 GLN 619 1HE2 GLN 619 -10.079 -8.738 -8.640 845 2HE2 GLN 619 2HE2 GLN 619 -10.419 -7.488 -7.490 846 H GLY 620 H GLY 620 -3.806 -6.992 -9.278 847 1HA GLY 620 2HA GLY 620 -2.465 -5.329 -8.587 848 2HA GLY 620 1HA GLY 620 -3.797 -4.788 -7.585 849 H ASN 621 H ASN 621 -3.781 -5.016 -11.185 850 HA ASN 621 HA ASN 621 -3.222 -2.293 -11.543 851 1HB ASN 621 1HB ASN 621 -4.411 -4.463 -13.334 852 2HB ASN 621 2HB ASN 621 -4.200 -2.822 -13.914 853 1HD2 ASN 621 1HD2 ASN 621 -1.931 -1.905 -13.142 854 2HD2 ASN 621 2HD2 ASN 621 -0.572 -2.886 -13.578 855 H VAL 622 H VAL 622 -6.152 -4.309 -11.138 856 HA VAL 622 HA VAL 622 -8.027 -2.439 -12.068 857 HB VAL 622 HB VAL 622 -8.123 -4.831 -10.245 858 1HG1 VAL 622 2HG1 VAL 622 -10.340 -2.899 -10.923 859 2HG1 VAL 622 3HG1 VAL 622 -10.679 -4.612 -10.577 860 3HG1 VAL 622 1HG1 VAL 622 -9.896 -3.594 -9.346 861 1HG2 VAL 622 3HG2 VAL 622 -7.971 -4.621 -12.979 862 2HG2 VAL 622 1HG2 VAL 622 -8.628 -6.016 -12.090 863 3HG2 VAL 622 2HG2 VAL 622 -9.725 -4.762 -12.715 864 H THR 623 H THR 623 -6.879 -3.261 -8.720 865 HA THR 623 HA THR 623 -8.388 -1.256 -7.462 866 HB THR 623 HB THR 623 -6.825 -1.774 -5.561 867 HG1 THR 623 1HG THR 623 -4.974 -3.047 -6.113 868 1HG2 THR 623 1HG2 THR 623 -8.625 -3.526 -6.522 869 2HG2 THR 623 2HG2 THR 623 -7.158 -4.425 -6.979 870 3HG2 THR 623 3HG2 THR 623 -7.458 -4.020 -5.272 871 H SER 624 H SER 624 -5.141 -1.241 -8.976 872 HA SER 624 HA SER 624 -4.195 1.077 -7.957 873 1HB SER 624 1HB SER 624 -3.660 -0.622 -10.229 874 2HB SER 624 2HB SER 624 -3.567 1.044 -10.765 875 HG SER 624 HG SER 624 -1.632 1.085 -9.867 876 H ILE 625 H ILE 625 -6.388 0.611 -10.808 877 HA ILE 625 HA ILE 625 -6.571 3.387 -11.349 878 HB ILE 625 HB ILE 625 -7.825 0.878 -12.319 879 1HG1 ILE 625 1HG1 ILE 625 -7.275 2.577 -14.441 880 2HG1 ILE 625 2HG1 ILE 625 -6.026 2.982 -13.281 881 1HG2 ILE 625 3HG2 ILE 625 -9.102 3.602 -12.586 882 2HG2 ILE 625 1HG2 ILE 625 -9.377 2.291 -13.758 883 3HG2 ILE 625 2HG2 ILE 625 -9.839 2.072 -12.054 884 1HD1 ILE 625 1HD1 ILE 625 -6.619 0.063 -13.741 885 2HD1 ILE 625 2HD1 ILE 625 -5.713 0.951 -14.989 886 3HD1 ILE 625 3HD1 ILE 625 -5.078 0.853 -13.329 887 H HIS 626 H HIS 626 -8.214 1.111 -9.190 888 HA HIS 626 HA HIS 626 -10.544 2.574 -8.790 889 1HB HIS 626 1HB HIS 626 -10.008 0.181 -8.115 890 2HB HIS 626 2HB HIS 626 -9.146 0.843 -6.741 891 HD1 HIS 626 1HD HIS 626 -10.945 -0.439 -5.235 892 HD2 HIS 626 2HD HIS 626 -12.445 2.712 -7.563 893 HE1 HIS 626 1HE HIS 626 -13.251 0.112 -4.291 894 H SER 627 H SER 627 -7.336 2.652 -7.123 895 HA SER 627 HA SER 627 -8.236 4.743 -5.411 896 1HB SER 627 1HB SER 627 -5.686 3.193 -5.807 897 2HB SER 627 2HB SER 627 -5.575 4.741 -4.993 898 HG SER 627 HG SER 627 -6.804 2.330 -4.144 899 H LEU 628 H LEU 628 -5.965 4.370 -8.213 900 HA LEU 628 HA LEU 628 -4.901 6.841 -8.368 901 1HB LEU 628 1HB LEU 628 -5.647 4.744 -10.314 902 2HB LEU 628 2HB LEU 628 -5.358 6.336 -10.987 903 HG LEU 628 HG LEU 628 -3.332 5.201 -9.094 904 1HD1 LEU 628 3HD1 LEU 628 -4.152 3.887 -11.536 905 2HD1 LEU 628 1HD1 LEU 628 -2.468 4.451 -11.653 906 3HD1 LEU 628 2HD1 LEU 628 -2.959 3.385 -10.315 907 1HD2 LEU 628 2HD2 LEU 628 -3.418 7.559 -10.309 908 2HD2 LEU 628 3HD2 LEU 628 -1.888 6.692 -10.036 909 3HD2 LEU 628 1HD2 LEU 628 -2.675 6.628 -11.631 910 H LEU 629 H LEU 629 -8.104 5.850 -9.767 911 HA LEU 629 HA LEU 629 -8.809 8.318 -10.754 912 1HB LEU 629 1HB LEU 629 -10.059 5.781 -10.190 913 2HB LEU 629 2HB LEU 629 -11.153 7.093 -9.800 914 HG LEU 629 HG LEU 629 -11.408 6.210 -12.107 915 1HD1 LEU 629 3HD1 LEU 629 -10.934 9.045 -11.416 916 2HD1 LEU 629 1HD1 LEU 629 -10.955 8.666 -13.155 917 3HD1 LEU 629 2HD1 LEU 629 -12.355 8.252 -12.137 918 1HD2 LEU 629 3HD2 LEU 629 -8.783 5.963 -12.273 919 2HD2 LEU 629 1HD2 LEU 629 -9.784 6.252 -13.717 920 3HD2 LEU 629 2HD2 LEU 629 -8.903 7.601 -12.959 921 H ASP 630 H ASP 630 -9.243 6.949 -7.440 922 HA ASP 630 HA ASP 630 -10.686 9.107 -6.476 923 1HB ASP 630 1HB ASP 630 -9.073 6.858 -5.309 924 2HB ASP 630 2HB ASP 630 -9.407 8.205 -4.239 925 HD2 ASP 630 HD ASP 630 -12.700 8.054 -4.353 926 H GLU 631 H GLU 631 -7.254 8.539 -7.122 927 HA GLU 631 HA GLU 631 -6.313 10.553 -5.371 928 1HB GLU 631 1HB GLU 631 -5.193 8.535 -7.144 929 2HB GLU 631 2HB GLU 631 -4.381 10.066 -7.407 930 1HG GLU 631 1HG GLU 631 -4.682 8.564 -4.771 931 2HG GLU 631 2HG GLU 631 -3.196 8.903 -5.635 932 HE2 GLU 631 HE GLU 631 -2.715 11.948 -4.467 933 H GLY 632 H GLY 632 -6.829 10.278 -8.950 934 1HA GLY 632 2HA GLY 632 -6.922 11.845 -10.565 935 2HA GLY 632 1HA GLY 632 -5.992 12.919 -9.539 936 H LYS 633 H LYS 633 -9.136 11.404 -8.658 937 HA LYS 633 HA LYS 633 -10.793 13.486 -9.424 938 1HB LYS 633 1HB LYS 633 -11.331 11.088 -8.621 939 2HB LYS 633 2HB LYS 633 -11.279 11.753 -7.001 940 1HG LYS 633 1HG LYS 633 -13.580 11.871 -7.732 941 2HG LYS 633 2HG LYS 633 -12.964 13.512 -7.732 942 1HD LYS 633 1HD LYS 633 -12.322 12.674 -10.302 943 2HD LYS 633 2HD LYS 633 -13.823 11.817 -10.017 944 1HE LYS 633 1HE LYS 633 -14.910 13.985 -9.338 945 2HE LYS 633 2HE LYS 633 -13.412 14.828 -9.682 946 H GLN 634 H GLN 634 -8.633 13.098 -6.626 947 HA GLN 634 HA GLN 634 -9.794 15.189 -5.151 948 1HB GLN 634 1HB GLN 634 -7.129 13.738 -5.022 949 2HB GLN 634 2HB GLN 634 -7.484 15.074 -3.945 950 1HG GLN 634 1HG GLN 634 -9.604 12.964 -4.165 951 2HG GLN 634 2HG GLN 634 -8.115 12.477 -3.378 952 1HE2 GLN 634 1HE2 GLN 634 -7.883 12.891 -1.314 953 2HE2 GLN 634 2HE2 GLN 634 -8.785 14.026 -0.367 954 H SER 635 H SER 635 -7.627 15.029 -7.892 955 HA SER 635 HA SER 635 -6.603 17.669 -7.380 956 1HB SER 635 1HB SER 635 -5.768 15.368 -8.909 957 2HB SER 635 2HB SER 635 -5.915 16.725 -10.009 958 HG SER 635 HG SER 635 -4.093 17.497 -9.215 959 H LEU 636 H LEU 636 -9.046 15.961 -9.306 960 HA LEU 636 HA LEU 636 -9.486 17.701 -11.360 961 1HB LEU 636 1HB LEU 636 -10.926 15.610 -9.967 962 2HB LEU 636 2HB LEU 636 -12.018 16.873 -10.502 963 HG LEU 636 HG LEU 636 -11.685 14.937 -12.086 964 1HD1 LEU 636 3HD1 LEU 636 -12.345 17.465 -12.598 965 2HD1 LEU 636 1HD1 LEU 636 -10.847 17.390 -13.556 966 3HD1 LEU 636 2HD1 LEU 636 -12.170 16.245 -13.883 967 1HD2 LEU 636 3HD2 LEU 636 -9.240 14.707 -11.729 968 2HD2 LEU 636 1HD2 LEU 636 -9.699 14.823 -13.445 969 3HD2 LEU 636 2HD2 LEU 636 -8.998 16.232 -12.613 970 H THR 637 H THR 637 -10.854 17.852 -8.004 971 HA THR 637 HA THR 637 -12.209 20.296 -8.487 972 HB THR 637 HB THR 637 -13.087 18.997 -6.720 973 HG1 THR 637 1HG THR 637 -12.416 20.279 -4.806 974 1HG2 THR 637 2HG2 THR 637 -10.178 18.427 -6.132 975 2HG2 THR 637 3HG2 THR 637 -11.320 18.417 -4.767 976 3HG2 THR 637 1HG2 THR 637 -11.564 17.309 -6.138 977 H LYS 638 H LYS 638 -8.876 19.480 -7.853 978 HA LYS 638 HA LYS 638 -8.279 22.108 -6.820 979 1HB LYS 638 1HB LYS 638 -6.585 19.680 -7.455 980 2HB LYS 638 2HB LYS 638 -5.911 21.202 -6.908 981 1HG LYS 638 1HG LYS 638 -7.631 21.026 -4.938 982 2HG LYS 638 2HG LYS 638 -7.804 19.349 -5.416 983 1HD LYS 638 1HD LYS 638 -5.088 20.613 -4.842 984 2HD LYS 638 2HD LYS 638 -6.049 19.844 -3.594 985 1HE LYS 638 1HE LYS 638 -6.130 17.846 -5.419 986 2HE LYS 638 2HE LYS 638 -4.636 18.598 -5.944 987 H LEU 639 H LEU 639 -8.337 20.348 -9.890 988 HA LEU 639 HA LEU 639 -6.859 22.501 -11.181 989 1HB LEU 639 1HB LEU 639 -7.786 19.775 -12.070 990 2HB LEU 639 2HB LEU 639 -7.152 20.964 -13.191 991 HG LEU 639 HG LEU 639 -5.271 19.732 -12.766 992 1HD1 LEU 639 2HD1 LEU 639 -4.940 22.153 -12.143 993 2HD1 LEU 639 3HD1 LEU 639 -5.058 21.652 -10.439 994 3HD1 LEU 639 1HD1 LEU 639 -3.753 21.013 -11.467 995 1HD2 LEU 639 1HD2 LEU 639 -6.516 18.357 -11.000 996 2HD2 LEU 639 2HD2 LEU 639 -4.749 18.502 -10.842 997 3HD2 LEU 639 3HD2 LEU 639 -5.819 19.483 -9.811 998 H ALA 640 H ALA 640 -10.067 21.578 -10.352 999 HA ALA 640 HA ALA 640 -11.589 22.257 -12.496 1000 1HB ALA 640 1HB ALA 640 -12.303 21.425 -10.207 1001 2HB ALA 640 2HB ALA 640 -12.156 23.103 -9.631 1002 3HB ALA 640 3HB ALA 640 -13.335 22.698 -10.902 1003 H ALA 641 H ALA 641 -9.776 24.402 -10.268 1004 HA ALA 641 HA ALA 641 -10.939 26.806 -11.088 1005 1HB ALA 641 2HB ALA 641 -8.983 25.925 -9.276 1006 2HB ALA 641 1HB ALA 641 -9.550 27.597 -9.503 1007 3HB ALA 641 3HB ALA 641 -8.115 27.016 -10.383 1008 H ALA 642 H ALA 642 -8.530 24.658 -12.551 1009 HA ALA 642 HA ALA 642 -7.329 26.507 -14.265 1010 1HB ALA 642 3HB ALA 642 -6.847 23.961 -13.616 1011 2HB ALA 642 2HB ALA 642 -6.290 24.648 -15.160 1012 3HB ALA 642 1HB ALA 642 -7.770 23.660 -15.108 1013 H TRP 643 H TRP 643 -10.331 24.538 -14.504 1014 HA TRP 643 HA TRP 643 -10.828 25.224 -17.207 1015 1HB TRP 643 1HB TRP 643 -12.466 24.019 -14.991 1016 2HB TRP 643 2HB TRP 643 -13.192 24.444 -16.529 1017 HD1 TRP 643 HD TRP 643 -12.690 22.807 -18.591 1018 HE1 TRP 643 1HE TRP 643 -11.511 20.469 -18.921 1019 HE3 TRP 643 3HE TRP 643 -10.454 22.700 -14.025 1020 HZ2 TRP 643 2HZ TRP 643 -9.814 18.873 -17.273 1021 HZ3 TRP 643 3HZ TRP 643 -9.053 20.716 -13.465 1022 HH2 TRP 643 HH TRP 643 -8.716 18.846 -15.002 1023 H GLY 644 H GLY 644 -11.304 26.741 -14.049 1024 1HA GLY 644 2HA GLY 644 -12.768 28.943 -15.380 1025 2HA GLY 644 1HA GLY 644 -11.530 29.172 -14.161 1026 H GLY 645 H GLY 645 -12.002 27.634 -12.066 1027 1HA GLY 645 2HA GLY 645 -14.678 28.447 -11.191 1028 2HA GLY 645 1HA GLY 645 -13.320 27.999 -10.179 1029 H SER 646 H SER 646 -14.570 26.456 -8.977 1030 HA SER 646 HA SER 646 -14.768 23.949 -10.372 1031 1HB SER 646 1HB SER 646 -15.324 23.135 -7.965 1032 2HB SER 646 2HB SER 646 -13.694 23.692 -8.291 1033 HG SER 646 HG SER 646 -15.691 24.819 -6.658 1034 H GLY 647 H GLY 647 -16.766 26.613 -9.440 1035 1HA GLY 647 2HA GLY 647 -19.041 26.666 -8.891 1036 2HA GLY 647 1HA GLY 647 -19.205 24.982 -9.344 1037 H SER 648 H SER 648 -17.402 25.671 -11.834 1038 HA SER 648 HA SER 648 -19.427 27.136 -13.316 1039 1HB SER 648 1HB SER 648 -16.471 26.816 -13.534 1040 2HB SER 648 2HB SER 648 -17.324 26.833 -15.065 1041 HG SER 648 HG SER 648 -18.427 28.846 -14.161 1042 H GLU 649 H GLU 649 -20.452 26.209 -15.147 1043 HA GLU 649 HA GLU 649 -20.856 23.519 -15.116 1044 1HB GLU 649 1HB GLU 649 -21.930 23.832 -17.322 1045 2HB GLU 649 2HB GLU 649 -22.361 25.126 -16.223 1046 1HG GLU 649 1HG GLU 649 -21.701 26.546 -17.877 1047 2HG GLU 649 2HG GLU 649 -20.061 26.140 -17.409 1048 HE2 GLU 649 HE GLU 649 -21.354 26.660 -19.995 1049 H ALA 650 H ALA 650 -18.316 25.423 -16.723 1050 HA ALA 650 HA ALA 650 -17.461 23.663 -18.642 1051 1HB ALA 650 1HB ALA 650 -16.401 25.933 -17.114 1052 2HB ALA 650 3HB ALA 650 -16.177 25.510 -18.828 1053 3HB ALA 650 2HB ALA 650 -15.134 24.776 -17.586 1054 H TYR 651 H TYR 651 -15.780 24.004 -15.442 1055 HA TYR 651 HA TYR 651 -14.403 21.650 -15.562 1056 1HB TYR 651 1HB TYR 651 -13.913 23.200 -13.796 1057 2HB TYR 651 2HB TYR 651 -15.608 23.467 -13.440 1058 HD1 TYR 651 1HD TYR 651 -13.005 20.773 -13.240 1059 HD2 TYR 651 2HD TYR 651 -16.536 22.488 -11.539 1060 HE1 TYR 651 1HE TYR 651 -12.856 19.157 -11.283 1061 HE2 TYR 651 2HE TYR 651 -16.375 20.866 -9.588 1062 HH TYR 651 HH TYR 651 -14.568 19.589 -8.456 1063 H GLN 652 H GLN 652 -17.808 22.212 -14.600 1064 HA GLN 652 HA GLN 652 -18.251 19.818 -13.342 1065 1HB GLN 652 1HB GLN 652 -20.049 21.670 -14.939 1066 2HB GLN 652 2HB GLN 652 -20.685 20.212 -14.205 1067 1HG GLN 652 1HG GLN 652 -19.049 21.599 -12.250 1068 2HG GLN 652 2HG GLN 652 -20.178 22.743 -12.949 1069 1HE2 GLN 652 1HE2 GLN 652 -20.894 22.643 -10.646 1070 2HE2 GLN 652 2HE2 GLN 652 -22.124 21.501 -10.218 1071 H GLY 653 H GLY 653 -18.753 20.687 -16.837 1072 1HA GLY 653 2HA GLY 653 -18.803 19.416 -18.688 1073 2HA GLY 653 1HA GLY 653 -19.632 18.209 -17.726 1074 H VAL 654 H VAL 654 -16.418 19.280 -16.707 1075 HA VAL 654 HA VAL 654 -15.060 17.190 -18.136 1076 HB VAL 654 HB VAL 654 -14.263 19.273 -16.107 1077 1HG1 VAL 654 3HG1 VAL 654 -12.953 17.173 -15.748 1078 2HG1 VAL 654 1HG1 VAL 654 -12.399 17.279 -17.436 1079 3HG1 VAL 654 2HG1 VAL 654 -11.965 18.557 -16.276 1080 1HG2 VAL 654 3HG2 VAL 654 -14.653 19.436 -18.831 1081 2HG2 VAL 654 1HG2 VAL 654 -13.639 20.532 -17.861 1082 3HG2 VAL 654 2HG2 VAL 654 -12.900 19.152 -18.709 1083 H GLN 655 H GLN 655 -16.052 17.905 -14.731 1084 HA GLN 655 HA GLN 655 -14.883 15.796 -13.512 1085 1HB GLN 655 1HB GLN 655 -17.132 17.600 -12.982 1086 2HB GLN 655 2HB GLN 655 -17.412 16.019 -12.280 1087 1HG GLN 655 1HG GLN 655 -14.640 16.960 -11.870 1088 2HG GLN 655 2HG GLN 655 -15.825 18.050 -11.179 1089 1HE2 GLN 655 1HE2 GLN 655 -14.515 17.167 -9.283 1090 2HE2 GLN 655 2HE2 GLN 655 -15.177 15.807 -8.439 1091 H GLN 656 H GLN 656 -17.944 15.875 -15.403 1092 HA GLN 656 HA GLN 656 -18.654 13.240 -14.745 1093 1HB GLN 656 1HB GLN 656 -19.621 15.391 -16.539 1094 2HB GLN 656 2HB GLN 656 -19.922 13.779 -17.159 1095 1HG GLN 656 1HG GLN 656 -21.768 13.814 -15.814 1096 2HG GLN 656 2HG GLN 656 -20.648 13.456 -14.514 1097 1HE2 GLN 656 1HE2 GLN 656 -21.221 16.388 -16.450 1098 2HE2 GLN 656 2HE2 GLN 656 -21.577 17.456 -15.134 1099 H LYS 657 H LYS 657 -16.678 14.763 -17.305 1100 HA LYS 657 HA LYS 657 -16.543 12.456 -18.939 1101 1HB LYS 657 1HB LYS 657 -14.845 14.961 -18.778 1102 2HB LYS 657 2HB LYS 657 -14.628 13.714 -19.990 1103 1HG LYS 657 1HG LYS 657 -16.792 14.099 -20.947 1104 2HG LYS 657 2HG LYS 657 -17.356 14.980 -19.541 1105 1HD LYS 657 1HD LYS 657 -15.544 16.737 -20.061 1106 2HD LYS 657 2HD LYS 657 -15.287 15.906 -21.582 1107 1HE LYS 657 1HE LYS 657 -17.916 16.154 -21.858 1108 2HE LYS 657 2HE LYS 657 -17.749 17.404 -20.642 1109 H TRP 658 H TRP 658 -14.807 13.637 -16.074 1110 HA TRP 658 HA TRP 658 -12.603 11.866 -16.376 1111 1HB TRP 658 1HB TRP 658 -12.243 13.831 -15.132 1112 2HB TRP 658 2HB TRP 658 -13.657 13.570 -14.130 1113 HD1 TRP 658 HD TRP 658 -13.367 11.872 -12.035 1114 HE1 TRP 658 1HE TRP 658 -11.316 10.799 -10.769 1115 HE3 TRP 658 3HE TRP 658 -9.925 12.931 -15.624 1116 HZ2 TRP 658 2HZ TRP 658 -8.546 10.519 -11.396 1117 HZ3 TRP 658 3HZ TRP 658 -7.569 12.223 -15.219 1118 HH2 TRP 658 HH TRP 658 -6.859 11.056 -13.192 1119 H ASP 659 H ASP 659 -15.569 11.944 -14.267 1120 HA ASP 659 HA ASP 659 -15.085 9.419 -13.200 1121 1HB ASP 659 1HB ASP 659 -16.828 11.480 -12.682 1122 2HB ASP 659 2HB ASP 659 -17.918 10.351 -13.463 1123 HD2 ASP 659 HD ASP 659 -16.229 9.030 -10.068 1124 H ALA 660 H ALA 660 -16.593 10.641 -16.170 1125 HA ALA 660 HA ALA 660 -18.290 8.574 -16.828 1126 1HB ALA 660 1HB ALA 660 -18.429 10.440 -18.206 1127 2HB ALA 660 2HB ALA 660 -16.662 10.601 -18.347 1128 3HB ALA 660 3HB ALA 660 -17.514 9.323 -19.246 1129 H THR 661 H THR 661 -15.273 8.910 -18.736 1130 HA THR 661 HA THR 661 -15.057 6.244 -19.349 1131 HB THR 661 HB THR 661 -12.791 6.870 -20.074 1132 HG1 THR 661 1HG THR 661 -12.113 9.082 -19.199 1133 1HG2 THR 661 3HG2 THR 661 -14.927 8.174 -21.048 1134 2HG2 THR 661 1HG2 THR 661 -14.194 9.550 -20.189 1135 3HG2 THR 661 2HG2 THR 661 -13.280 8.708 -21.463 1136 H ALA 662 H ALA 662 -14.106 7.924 -16.374 1137 HA ALA 662 HA ALA 662 -12.307 6.098 -15.367 1138 1HB ALA 662 3HB ALA 662 -12.526 8.088 -14.168 1139 2HB ALA 662 2HB ALA 662 -13.383 6.935 -13.116 1140 3HB ALA 662 1HB ALA 662 -14.305 8.022 -14.182 1141 H THR 663 H THR 663 -15.595 6.265 -13.917 1142 HA THR 663 HA THR 663 -15.674 3.726 -12.968 1143 HB THR 663 HB THR 663 -17.351 5.377 -12.371 1144 HG1 THR 663 1HG THR 663 -19.263 4.032 -12.962 1145 1HG2 THR 663 3HG2 THR 663 -17.416 5.913 -15.196 1146 2HG2 THR 663 1HG2 THR 663 -19.029 5.317 -14.738 1147 3HG2 THR 663 2HG2 THR 663 -18.339 6.737 -13.916 1148 H GLU 664 H GLU 664 -16.177 4.777 -16.331 1149 HA GLU 664 HA GLU 664 -17.401 2.502 -17.254 1150 1HB GLU 664 1HB GLU 664 -17.210 4.535 -18.600 1151 2HB GLU 664 2HB GLU 664 -15.463 4.405 -18.636 1152 1HG GLU 664 1HG GLU 664 -16.818 3.546 -20.705 1153 2HG GLU 664 2HG GLU 664 -15.485 2.570 -20.119 1154 HE2 GLU 664 HE GLU 664 -16.555 0.135 -19.338 1155 H LEU 665 H LEU 665 -13.876 3.301 -16.981 1156 HA LEU 665 HA LEU 665 -13.133 0.703 -17.941 1157 1HB LEU 665 1HB LEU 665 -11.869 2.818 -18.356 1158 2HB LEU 665 2HB LEU 665 -11.438 2.847 -16.658 1159 HG LEU 665 HG LEU 665 -10.602 0.346 -17.311 1160 1HD1 LEU 665 2HD1 LEU 665 -10.742 1.904 -19.838 1161 2HD1 LEU 665 3HD1 LEU 665 -9.253 0.975 -19.540 1162 3HD1 LEU 665 1HD1 LEU 665 -10.830 0.148 -19.556 1163 1HD2 LEU 665 2HD2 LEU 665 -9.344 2.995 -17.018 1164 2HD2 LEU 665 3HD2 LEU 665 -8.971 1.444 -16.229 1165 3HD2 LEU 665 1HD2 LEU 665 -8.353 1.783 -17.864 1166 H ASN 666 H ASN 666 -13.783 2.291 -14.844 1167 HA ASN 666 HA ASN 666 -12.374 0.565 -13.222 1168 1HB ASN 666 1HB ASN 666 -13.911 2.792 -12.811 1169 2HB ASN 666 2HB ASN 666 -15.050 1.572 -12.274 1170 1HD2 ASN 666 1HD2 ASN 666 -12.695 3.607 -11.302 1171 2HD2 ASN 666 2HD2 ASN 666 -12.131 2.829 -9.861 1172 H ASN 667 H ASN 667 -15.678 0.461 -14.667 1173 HA ASN 667 HA ASN 667 -16.443 -1.843 -13.229 1174 1HB ASN 667 1HB ASN 667 -18.474 -1.718 -14.500 1175 2HB ASN 667 2HB ASN 667 -17.968 -0.048 -14.336 1176 1HD2 ASN 667 1HD2 ASN 667 -18.101 1.100 -16.093 1177 2HD2 ASN 667 2HD2 ASN 667 -17.916 0.558 -17.727 1178 H ALA 668 H ALA 668 -14.995 -1.059 -16.422 1179 HA ALA 668 HA ALA 668 -15.324 -3.617 -17.564 1180 1HB ALA 668 1HB ALA 668 -14.720 -1.205 -18.542 1181 2HB ALA 668 2HB ALA 668 -13.057 -1.807 -18.333 1182 3HB ALA 668 3HB ALA 668 -14.203 -2.699 -19.362 1183 H LEU 669 H LEU 669 -12.682 -2.003 -15.701 1184 HA LEU 669 HA LEU 669 -10.847 -4.097 -15.963 1185 1HB LEU 669 1HB LEU 669 -11.134 -1.613 -14.461 1186 2HB LEU 669 2HB LEU 669 -10.296 -2.854 -13.550 1187 HG LEU 669 HG LEU 669 -9.439 -2.317 -16.372 1188 1HD1 LEU 669 1HD1 LEU 669 -9.708 -0.098 -15.200 1189 2HD1 LEU 669 2HD1 LEU 669 -8.456 -0.640 -14.056 1190 3HD1 LEU 669 3HD1 LEU 669 -8.069 -0.471 -15.785 1191 1HD2 LEU 669 2HD2 LEU 669 -8.564 -4.183 -14.817 1192 2HD2 LEU 669 3HD2 LEU 669 -7.387 -3.191 -15.711 1193 3HD2 LEU 669 1HD2 LEU 669 -7.691 -2.874 -13.986 1194 H GLN 670 H GLN 670 -13.373 -3.363 -13.486 1195 HA GLN 670 HA GLN 670 -12.702 -5.453 -11.806 1196 1HB GLN 670 1HB GLN 670 -15.093 -3.700 -12.235 1197 2HB GLN 670 2HB GLN 670 -15.363 -5.172 -11.323 1198 1HG GLN 670 1HG GLN 670 -12.932 -4.075 -10.310 1199 2HG GLN 670 2HG GLN 670 -14.026 -2.717 -10.486 1200 1HE2 GLN 670 1HE2 GLN 670 -12.941 -4.287 -8.157 1201 2HE2 GLN 670 2HE2 GLN 670 -14.316 -4.708 -7.192 1202 H ASN 671 H ASN 671 -15.239 -5.244 -14.402 1203 HA ASN 671 HA ASN 671 -16.148 -7.816 -14.113 1204 1HB ASN 671 1HB ASN 671 -16.746 -5.656 -15.745 1205 2HB ASN 671 2HB ASN 671 -16.032 -6.755 -16.909 1206 1HD2 ASN 671 1HD2 ASN 671 -17.561 -7.741 -17.978 1207 2HD2 ASN 671 2HD2 ASN 671 -18.990 -8.477 -17.331 1208 H LEU 672 H LEU 672 -13.281 -6.436 -15.709 1209 HA LEU 672 HA LEU 672 -12.719 -8.722 -17.310 1210 1HB LEU 672 1HB LEU 672 -11.892 -6.740 -18.155 1211 2HB LEU 672 2HB LEU 672 -11.325 -6.175 -16.597 1212 HG LEU 672 HG LEU 672 -9.889 -8.566 -17.255 1213 1HD1 LEU 672 3HD1 LEU 672 -10.640 -7.867 -19.602 1214 2HD1 LEU 672 1HD1 LEU 672 -9.545 -6.477 -19.403 1215 3HD1 LEU 672 2HD1 LEU 672 -8.901 -8.135 -19.334 1216 1HD2 LEU 672 1HD2 LEU 672 -9.332 -6.441 -15.837 1217 2HD2 LEU 672 2HD2 LEU 672 -8.037 -7.317 -16.688 1218 3HD2 LEU 672 3HD2 LEU 672 -8.699 -5.815 -17.378 1219 H ALA 673 H ALA 673 -11.692 -7.481 -14.089 1220 HA ALA 673 HA ALA 673 -9.848 -9.636 -13.714 1221 1HB ALA 673 1HB ALA 673 -10.270 -7.106 -12.625 1222 2HB ALA 673 2HB ALA 673 -10.758 -8.210 -11.316 1223 3HB ALA 673 3HB ALA 673 -9.128 -8.330 -12.020 1224 H ARG 674 H ARG 674 -13.277 -9.206 -13.495 1225 HA ARG 674 HA ARG 674 -13.701 -10.986 -11.366 1226 1HB ARG 674 1HB ARG 674 -15.421 -9.737 -13.526 1227 2HB ARG 674 2HB ARG 674 -16.090 -11.052 -12.581 1228 1HG ARG 674 1HG ARG 674 -14.893 -9.384 -10.650 1229 2HG ARG 674 2HG ARG 674 -15.590 -8.257 -11.797 1230 1HD ARG 674 1HD ARG 674 -17.786 -9.512 -11.630 1231 2HD ARG 674 2HD ARG 674 -17.073 -10.539 -10.403 1232 HE ARG 674 HE ARG 674 -16.650 -7.837 -9.607 1233 2HH1 ARG 674 1HH ARG 674 -19.507 -7.412 -7.678 1234 1HH2 ARG 674 2HH2 ARG 674 -19.345 -10.095 -10.041 1235 2HH2 ARG 674 1HH2 ARG 674 -20.340 -9.331 -8.847 1236 H THR 675 H THR 675 -13.251 -11.268 -14.883 1237 HA THR 675 HA THR 675 -13.879 -14.138 -14.721 1238 HB THR 675 HB THR 675 -13.700 -12.214 -17.101 1239 HG1 THR 675 1HG THR 675 -15.857 -13.611 -15.678 1240 1HG2 THR 675 1HG2 THR 675 -13.284 -14.796 -17.464 1241 2HG2 THR 675 2HG2 THR 675 -15.004 -14.963 -17.040 1242 3HG2 THR 675 3HG2 THR 675 -14.527 -13.994 -18.455 1243 H ILE 676 H ILE 676 -11.304 -11.945 -14.588 1244 HA ILE 676 HA ILE 676 -9.493 -13.813 -15.916 1245 HB ILE 676 HB ILE 676 -9.329 -10.929 -15.110 1246 1HG1 ILE 676 1HG1 ILE 676 -8.944 -12.448 -17.702 1247 2HG1 ILE 676 2HG1 ILE 676 -10.259 -11.365 -17.291 1248 1HG2 ILE 676 3HG2 ILE 676 -7.115 -12.876 -15.226 1249 2HG2 ILE 676 1HG2 ILE 676 -6.868 -11.387 -16.168 1250 3HG2 ILE 676 2HG2 ILE 676 -7.219 -11.290 -14.426 1251 1HD1 ILE 676 1HD1 ILE 676 -8.245 -9.636 -16.868 1252 2HD1 ILE 676 2HD1 ILE 676 -7.412 -10.716 -18.011 1253 3HD1 ILE 676 3HD1 ILE 676 -8.919 -9.900 -18.494 1254 H SER 677 H SER 677 -9.867 -11.972 -12.807 1255 HA SER 677 HA SER 677 -7.819 -12.998 -11.439 1256 1HB SER 677 1HB SER 677 -9.385 -11.317 -10.542 1257 2HB SER 677 2HB SER 677 -10.656 -12.518 -10.426 1258 HG SER 677 HG SER 677 -9.908 -12.785 -8.432 1259 H GLU 678 H GLU 678 -10.785 -14.657 -12.456 1260 HA GLU 678 HA GLU 678 -10.705 -16.759 -10.662 1261 1HB GLU 678 1HB GLU 678 -12.103 -17.951 -12.370 1262 2HB GLU 678 2HB GLU 678 -12.675 -16.332 -12.020 1263 1HG GLU 678 1HG GLU 678 -11.179 -15.603 -14.061 1264 2HG GLU 678 2HG GLU 678 -11.177 -17.305 -14.477 1265 HE2 GLU 678 HE GLU 678 -14.357 -16.920 -13.279 1266 H ALA 679 H ALA 679 -8.759 -16.003 -13.502 1267 HA ALA 679 HA ALA 679 -7.919 -18.378 -14.437 1268 1HB ALA 679 3HB ALA 679 -6.054 -16.079 -13.739 1269 2HB ALA 679 1HB ALA 679 -5.888 -17.250 -15.070 1270 3HB ALA 679 2HB ALA 679 -7.195 -16.041 -15.105 1271 H GLY 680 H GLY 680 -7.363 -17.018 -11.216 1272 1HA GLY 680 2HA GLY 680 -6.665 -18.087 -9.341 1273 2HA GLY 680 1HA GLY 680 -5.169 -18.213 -10.245 1274 H GLN 681 H GLN 681 -8.232 -19.885 -9.413 1275 HA GLN 681 HA GLN 681 -6.929 -22.363 -10.235 1276 1HB GLN 681 1HB GLN 681 -7.711 -21.573 -7.626 1277 2HB GLN 681 2HB GLN 681 -8.917 -22.740 -8.129 1278 1HG GLN 681 1HG GLN 681 -7.147 -24.378 -8.696 1279 2HG GLN 681 2HG GLN 681 -5.903 -23.205 -8.311 1280 1HE2 GLN 681 1HE2 GLN 681 -5.618 -25.421 -7.030 1281 2HE2 GLN 681 2HE2 GLN 681 -6.127 -25.359 -5.375 1282 H ALA 682 H ALA 682 -9.943 -20.459 -9.905 1283 HA ALA 682 HA ALA 682 -11.900 -22.136 -10.560 1284 1HB ALA 682 2HB ALA 682 -11.252 -19.306 -11.189 1285 2HB ALA 682 3HB ALA 682 -12.513 -20.043 -12.206 1286 3HB ALA 682 1HB ALA 682 -12.705 -20.008 -10.437 1287 H MET 683 H MET 683 -10.272 -20.314 -13.243 1288 HA MET 683 HA MET 683 -11.137 -21.682 -15.309 1289 1HB MET 683 1HB MET 683 -9.115 -19.869 -14.868 1290 2HB MET 683 2HB MET 683 -8.150 -21.274 -15.277 1291 1HG MET 683 1HG MET 683 -10.389 -20.095 -16.995 1292 2HG MET 683 2HG MET 683 -8.672 -19.930 -17.304 1293 1HE MET 683 3HE MET 683 -7.127 -21.559 -17.792 1294 2HE MET 683 1HE MET 683 -7.411 -23.069 -16.893 1295 3HE MET 683 2HE MET 683 -7.442 -23.073 -18.673 1296 H ALA 684 H ALA 684 -8.785 -22.885 -12.919 1297 HA ALA 684 HA ALA 684 -8.094 -25.179 -14.505 1298 1HB ALA 684 2HB ALA 684 -6.620 -25.692 -12.725 1299 2HB ALA 684 3HB ALA 684 -6.638 -23.913 -12.784 1300 3HB ALA 684 1HB ALA 684 -7.585 -24.772 -11.545 1301 H SER 685 H SER 685 -10.044 -24.481 -11.528 1302 HA SER 685 HA SER 685 -10.794 -26.879 -10.764 1303 1HB SER 685 1HB SER 685 -12.424 -24.347 -11.090 1304 2HB SER 685 2HB SER 685 -13.178 -25.789 -10.440 1305 HG SER 685 HG SER 685 -10.767 -24.574 -9.384 1306 H THR 686 H THR 686 -13.372 -25.263 -12.664 1307 HA THR 686 HA THR 686 -13.295 -27.215 -14.770 1308 HB THR 686 HB THR 686 -15.124 -27.468 -12.387 1309 HG1 THR 686 1HG THR 686 -13.291 -28.909 -13.145 1310 1HG2 THR 686 1HG2 THR 686 -16.649 -26.963 -14.391 1311 2HG2 THR 686 2HG2 THR 686 -15.918 -28.369 -15.202 1312 3HG2 THR 686 3HG2 THR 686 -16.847 -28.591 -13.700 1313 H GLU 687 H GLU 687 -13.995 -26.299 -16.603 1314 HA GLU 687 HA GLU 687 -14.522 -23.720 -16.859 1315 1HB GLU 687 1HB GLU 687 -15.533 -24.224 -19.031 1316 2HB GLU 687 2HB GLU 687 -14.204 -25.328 -18.735 1317 1HG GLU 687 1HG GLU 687 -16.342 -26.707 -17.612 1318 2HG GLU 687 2HG GLU 687 -17.112 -25.891 -18.959 1319 HE2 GLU 687 HE GLU 687 -17.195 -28.211 -19.518 1320 H GLY 688 H GLY 688 -15.985 -22.373 -15.913 1321 1HA GLY 688 2HA GLY 688 -18.800 -23.166 -15.896 1322 2HA GLY 688 1HA GLY 688 -18.141 -21.562 -15.643 1323 H ASN 689 H ASN 689 -16.017 -22.645 -13.734 1324 HA ASN 689 HA ASN 689 -17.113 -24.011 -11.661 1325 1HB ASN 689 1HB ASN 689 -14.677 -23.296 -11.959 1326 2HB ASN 689 2HB ASN 689 -15.128 -21.689 -11.425 1327 1HD2 ASN 689 1HD2 ASN 689 -14.422 -21.379 -9.461 1328 2HD2 ASN 689 2HD2 ASN 689 -14.552 -22.461 -8.114 1329 H VAL 690 H VAL 690 -17.004 -20.440 -12.312 1330 HA VAL 690 HA VAL 690 -18.759 -19.990 -10.025 1331 HB VAL 690 HB VAL 690 -17.734 -17.776 -11.724 1332 1HG1 VAL 690 2HG1 VAL 690 -19.138 -17.501 -9.638 1333 2HG1 VAL 690 3HG1 VAL 690 -17.745 -18.108 -8.710 1334 3HG1 VAL 690 1HG1 VAL 690 -17.602 -16.603 -9.649 1335 1HG2 VAL 690 3HG2 VAL 690 -15.973 -19.611 -10.100 1336 2HG2 VAL 690 1HG2 VAL 690 -15.714 -18.957 -11.735 1337 3HG2 VAL 690 2HG2 VAL 690 -15.564 -17.892 -10.317 1338 H THR 691 H THR 691 -20.689 -18.589 -10.320 1339 HA THR 691 HA THR 691 -21.830 -18.968 -13.011 1340 HB THR 691 HB THR 691 -22.773 -20.392 -11.097 1341 HG1 THR 691 1HG THR 691 -24.859 -19.914 -11.957 1342 1HG2 THR 691 2HG2 THR 691 -23.590 -17.597 -10.160 1343 2HG2 THR 691 3HG2 THR 691 -24.470 -19.069 -9.682 1344 3HG2 THR 691 1HG2 THR 691 -22.767 -18.856 -9.209 1345 H GLY 692 H GLY 692 -20.748 -16.727 -10.646 1346 1HA GLY 692 2HA GLY 692 -21.455 -14.542 -10.233 1347 2HA GLY 692 1HA GLY 692 -22.548 -14.618 -11.600 1348 H MET 693 H MET 693 -19.018 -15.428 -11.320 1349 HA MET 693 HA MET 693 -18.271 -13.095 -12.722 1350 1HB MET 693 1HB MET 693 -16.886 -15.657 -11.814 1351 2HB MET 693 2HB MET 693 -16.024 -14.519 -12.829 1352 1HG MET 693 1HG MET 693 -16.096 -12.794 -11.185 1353 2HG MET 693 2HG MET 693 -17.431 -13.535 -10.326 1354 1HE MET 693 1HE MET 693 -16.636 -13.266 -8.318 1355 2HE MET 693 2HE MET 693 -15.660 -14.479 -7.457 1356 3HE MET 693 3HE MET 693 -14.887 -13.015 -8.108 1357 H PHE 694 H PHE 694 -18.176 -16.637 -13.562 1358 HA PHE 694 HA PHE 694 -17.382 -16.255 -16.197 1359 1HB PHE 694 1HB PHE 694 -18.819 -18.353 -14.526 1360 2HB PHE 694 2HB PHE 694 -18.776 -18.598 -16.260 1361 HD1 PHE 694 1HD PHE 694 -16.958 -19.680 -17.212 1362 HD2 PHE 694 2HD PHE 694 -16.509 -17.904 -13.384 1363 HE1 PHE 694 1HE PHE 694 -14.667 -20.686 -17.014 1364 HE2 PHE 694 2HE PHE 694 -14.218 -18.910 -13.186 1365 HZ PHE 694 HZ PHE 694 -13.325 -20.289 -15.003 1366 H ALA 695 H ALA 695 -18.533 -14.691 -17.362 1367 HA ALA 695 HA ALA 695 -21.413 -15.209 -17.639 1368 1HB ALA 695 2HB ALA 695 -21.501 -13.024 -17.056 1369 2HB ALA 695 3HB ALA 695 -19.762 -12.784 -17.353 1370 3HB ALA 695 1HB ALA 695 -20.916 -12.702 -18.706 No H/Q in entry = 1370 Start of MODEL 14 1 H ALA 1 H ALA 1 -9.370 31.627 -2.757 2 HA ALA 1 HA ALA 1 -10.610 33.381 -4.737 3 1HB ALA 1 3HB ALA 1 -10.985 34.877 -2.929 4 2HB ALA 1 1HB ALA 1 -11.318 33.260 -2.265 5 3HB ALA 1 2HB ALA 1 -9.775 34.070 -1.903 6 H GLU 2 H GLU 2 -7.624 32.950 -2.740 7 HA GLU 2 HA GLU 2 -6.390 35.074 -4.254 8 1HB GLU 2 1HB GLU 2 -6.103 34.026 -1.603 9 2HB GLU 2 2HB GLU 2 -4.574 33.765 -2.418 10 1HG GLU 2 1HG GLU 2 -4.400 36.133 -3.008 11 2HG GLU 2 2HG GLU 2 -6.030 36.447 -2.446 12 HE2 GLU 2 HE GLU 2 -5.914 37.453 -0.638 13 H MET 3 H MET 3 -5.706 31.611 -3.366 14 HA MET 3 HA MET 3 -4.341 31.419 -5.938 15 1HB MET 3 1HB MET 3 -2.832 29.712 -4.750 16 2HB MET 3 2HB MET 3 -2.628 31.364 -4.201 17 1HG MET 3 1HG MET 3 -3.336 30.856 -2.092 18 2HG MET 3 2HG MET 3 -4.750 30.008 -2.686 19 1HE MET 3 3HE MET 3 -4.301 28.701 -0.523 20 2HE MET 3 1HE MET 3 -3.132 27.368 -0.371 21 3HE MET 3 2HE MET 3 -2.602 29.049 -0.124 22 H LYS 4 H LYS 4 -6.865 30.840 -6.228 23 HA LYS 4 HA LYS 4 -7.371 28.086 -5.460 24 1HB LYS 4 1HB LYS 4 -9.624 28.488 -6.102 25 2HB LYS 4 2HB LYS 4 -9.094 29.889 -5.194 26 1HG LYS 4 1HG LYS 4 -8.471 30.919 -7.520 27 2HG LYS 4 2HG LYS 4 -9.451 29.638 -8.203 28 1HD LYS 4 1HD LYS 4 -11.402 30.385 -6.837 29 2HD LYS 4 2HD LYS 4 -10.424 31.650 -6.119 30 1HE LYS 4 1HE LYS 4 -10.094 32.702 -8.343 31 2HE LYS 4 2HE LYS 4 -10.980 31.402 -9.114 32 H THR 5 H THR 5 -6.882 30.139 -8.385 33 HA THR 5 HA THR 5 -6.476 27.637 -9.889 34 HB THR 5 HB THR 5 -8.433 28.545 -10.850 35 HG1 THR 5 1HG THR 5 -7.515 29.772 -12.752 36 1HG2 THR 5 2HG2 THR 5 -8.369 30.702 -9.466 37 2HG2 THR 5 3HG2 THR 5 -7.208 31.342 -10.653 38 3HG2 THR 5 1HG2 THR 5 -8.863 30.930 -11.161 39 H ASP 6 H ASP 6 -4.980 30.287 -8.468 40 HA ASP 6 HA ASP 6 -3.347 31.418 -10.181 41 1HB ASP 6 1HB ASP 6 -3.115 30.494 -7.388 42 2HB ASP 6 2HB ASP 6 -1.550 30.603 -8.170 43 HD2 ASP 6 HD ASP 6 -1.795 32.202 -6.245 44 H ALA 7 H ALA 7 -1.695 30.793 -11.620 45 HA ALA 7 HA ALA 7 -1.378 28.228 -12.450 46 1HB ALA 7 1HB ALA 7 0.122 30.781 -12.671 47 2HB ALA 7 2HB ALA 7 1.064 29.314 -13.025 48 3HB ALA 7 3HB ALA 7 -0.422 29.659 -13.941 49 H ALA 8 H ALA 8 -0.018 29.805 -9.597 50 HA ALA 8 HA ALA 8 2.107 27.994 -9.189 51 1HB ALA 8 2HB ALA 8 2.404 29.919 -7.971 52 2HB ALA 8 1HB ALA 8 1.606 28.938 -6.718 53 3HB ALA 8 3HB ALA 8 0.664 30.120 -7.657 54 H THR 9 H THR 9 -1.302 28.186 -7.979 55 HA THR 9 HA THR 9 -1.061 25.803 -6.440 56 HB THR 9 HB THR 9 -2.731 27.936 -6.409 57 HG1 THR 9 1HG THR 9 -3.471 25.138 -5.913 58 1HG2 THR 9 2HG2 THR 9 -4.216 25.727 -7.929 59 2HG2 THR 9 3HG2 THR 9 -4.996 27.118 -7.139 60 3HG2 THR 9 1HG2 THR 9 -3.910 27.376 -8.526 61 H LEU 10 H LEU 10 -2.502 26.568 -9.669 62 HA LEU 10 HA LEU 10 -3.426 24.001 -10.173 63 1HB LEU 10 1HB LEU 10 -2.547 26.248 -11.980 64 2HB LEU 10 2HB LEU 10 -3.217 24.749 -12.593 65 HG LEU 10 HG LEU 10 -4.627 26.678 -10.727 66 1HD1 LEU 10 3HD1 LEU 10 -4.293 27.536 -13.030 67 2HD1 LEU 10 1HD1 LEU 10 -5.159 26.112 -13.656 68 3HD1 LEU 10 2HD1 LEU 10 -6.005 27.280 -12.612 69 1HD2 LEU 10 2HD2 LEU 10 -5.280 23.936 -11.664 70 2HD2 LEU 10 3HD2 LEU 10 -5.715 24.776 -10.157 71 3HD2 LEU 10 1HD2 LEU 10 -6.604 25.125 -11.659 72 H ALA 11 H ALA 11 -0.197 25.509 -10.646 73 HA ALA 11 HA ALA 11 0.877 23.301 -12.048 74 1HB ALA 11 3HB ALA 11 2.165 25.567 -10.474 75 2HB ALA 11 1HB ALA 11 3.040 24.443 -11.541 76 3HB ALA 11 2HB ALA 11 1.820 25.547 -12.220 77 H GLN 12 H GLN 12 0.389 24.133 -8.627 78 HA GLN 12 HA GLN 12 2.210 22.183 -7.693 79 1HB GLN 12 1HB GLN 12 1.055 24.367 -6.565 80 2HB GLN 12 2HB GLN 12 -0.025 23.137 -5.939 81 1HG GLN 12 1HG GLN 12 3.019 23.034 -5.700 82 2HG GLN 12 2HG GLN 12 1.950 23.607 -4.436 83 1HE2 GLN 12 1HE2 GLN 12 3.818 21.335 -4.554 84 2HE2 GLN 12 2HE2 GLN 12 2.912 19.915 -4.150 85 H GLU 13 H GLU 13 -1.204 22.264 -8.639 86 HA GLU 13 HA GLU 13 -1.635 19.674 -7.439 87 1HB GLU 13 1HB GLU 13 -3.559 21.430 -9.027 88 2HB GLU 13 2HB GLU 13 -3.989 19.997 -8.114 89 1HG GLU 13 1HG GLU 13 -2.647 22.420 -6.836 90 2HG GLU 13 2HG GLU 13 -4.388 22.247 -6.936 91 HE2 GLU 13 HE GLU 13 -4.633 22.089 -4.927 92 H ALA 14 H ALA 14 -1.610 21.294 -10.675 93 HA ALA 14 HA ALA 14 -2.304 19.122 -12.217 94 1HB ALA 14 2HB ALA 14 -1.995 21.566 -12.876 95 2HB ALA 14 3HB ALA 14 -0.248 21.233 -12.959 96 3HB ALA 14 1HB ALA 14 -1.371 20.369 -14.037 97 H GLY 15 H GLY 15 0.967 20.181 -11.064 98 1HA GLY 15 2HA GLY 15 2.875 19.026 -10.790 99 2HA GLY 15 1HA GLY 15 2.503 18.260 -12.322 100 H ASN 16 H ASN 16 0.396 18.014 -9.434 101 HA ASN 16 HA ASN 16 1.497 15.490 -8.716 102 1HB ASN 16 1HB ASN 16 0.645 16.657 -6.842 103 2HB ASN 16 2HB ASN 16 -0.738 17.274 -7.724 104 1HD2 ASN 16 1HD2 ASN 16 -2.549 16.507 -6.977 105 2HD2 ASN 16 2HD2 ASN 16 -2.874 14.889 -6.451 106 H PHE 17 H PHE 17 -1.115 16.823 -10.704 107 HA PHE 17 HA PHE 17 -2.724 14.488 -10.748 108 1HB PHE 17 1HB PHE 17 -3.513 16.817 -11.258 109 2HB PHE 17 2HB PHE 17 -2.374 16.933 -12.584 110 HD1 PHE 17 1HD PHE 17 -5.406 15.140 -11.436 111 HD2 PHE 17 2HD PHE 17 -2.949 16.172 -14.738 112 HE1 PHE 17 1HE PHE 17 -7.150 14.255 -13.010 113 HE2 PHE 17 2HE PHE 17 -4.692 15.287 -16.312 114 HZ PHE 17 HZ PHE 17 -6.771 14.339 -15.429 115 H GLU 18 H GLU 18 -0.463 16.005 -13.164 116 HA GLU 18 HA GLU 18 -0.649 14.305 -15.172 117 1HB GLU 18 1HB GLU 18 1.695 15.741 -13.953 118 2HB GLU 18 2HB GLU 18 2.031 14.589 -15.230 119 1HG GLU 18 1HG GLU 18 -0.246 16.168 -16.045 120 2HG GLU 18 2HG GLU 18 0.991 17.269 -15.472 121 HE2 GLU 18 HE GLU 18 0.359 15.293 -18.348 122 H ARG 19 H ARG 19 0.862 13.627 -12.007 123 HA ARG 19 HA ARG 19 2.122 11.274 -12.804 124 1HB ARG 19 1HB ARG 19 2.109 12.829 -10.524 125 2HB ARG 19 2HB ARG 19 1.156 11.464 -9.976 126 1HG ARG 19 1HG ARG 19 2.928 9.958 -10.165 127 2HG ARG 19 2HG ARG 19 3.678 10.832 -11.486 128 1HD ARG 19 1HD ARG 19 5.102 11.790 -10.001 129 2HD ARG 19 2HD ARG 19 3.744 12.621 -9.269 130 HE ARG 19 HE ARG 19 3.863 9.893 -8.324 131 2HH1 ARG 19 1HH ARG 19 5.464 10.588 -5.321 132 1HH2 ARG 19 2HH2 ARG 19 5.448 13.038 -7.931 133 2HH2 ARG 19 1HH2 ARG 19 5.988 12.703 -6.319 134 H ILE 20 H ILE 20 -1.113 12.043 -11.404 135 HA ILE 20 HA ILE 20 -1.889 9.367 -11.006 136 HB ILE 20 HB ILE 20 -3.528 11.877 -11.378 137 1HG1 ILE 20 1HG1 ILE 20 -2.875 10.559 -8.750 138 2HG1 ILE 20 2HG1 ILE 20 -1.752 11.688 -9.480 139 1HG2 ILE 20 1HG2 ILE 20 -4.735 9.683 -11.749 140 2HG2 ILE 20 2HG2 ILE 20 -4.394 9.307 -10.043 141 3HG2 ILE 20 3HG2 ILE 20 -5.382 10.728 -10.461 142 1HD1 ILE 20 2HD1 ILE 20 -4.190 13.021 -9.739 143 2HD1 ILE 20 3HD1 ILE 20 -4.339 12.207 -8.163 144 3HD1 ILE 20 1HD1 ILE 20 -2.979 13.315 -8.468 145 H SER 21 H SER 21 -2.343 11.713 -13.719 146 HA SER 21 HA SER 21 -3.951 10.076 -15.240 147 1HB SER 21 1HB SER 21 -3.104 11.494 -17.175 148 2HB SER 21 2HB SER 21 -3.752 12.396 -15.820 149 HG SER 21 HG SER 21 -1.607 13.109 -16.770 150 H GLY 22 H GLY 22 -0.347 10.534 -15.261 151 1HA GLY 22 2HA GLY 22 1.319 9.244 -16.041 152 2HA GLY 22 1HA GLY 22 0.234 8.734 -17.319 153 H ASP 23 H ASP 23 0.412 8.251 -13.711 154 HA ASP 23 HA ASP 23 1.120 5.642 -13.768 155 1HB ASP 23 1HB ASP 23 -0.488 7.341 -11.859 156 2HB ASP 23 2HB ASP 23 -0.405 5.618 -11.551 157 HD2 ASP 23 HD ASP 23 0.584 6.728 -9.654 158 H LEU 24 H LEU 24 -2.208 7.114 -13.668 159 HA LEU 24 HA LEU 24 -3.683 4.800 -13.570 160 1HB LEU 24 1HB LEU 24 -4.481 7.140 -13.302 161 2HB LEU 24 2HB LEU 24 -4.372 7.348 -15.038 162 HG LEU 24 HG LEU 24 -5.970 5.270 -15.127 163 1HD1 LEU 24 3HD1 LEU 24 -5.683 5.023 -12.557 164 2HD1 LEU 24 1HD1 LEU 24 -6.894 6.325 -12.469 165 3HD1 LEU 24 2HD1 LEU 24 -7.291 4.794 -13.285 166 1HD2 LEU 24 1HD2 LEU 24 -6.598 8.143 -14.587 167 2HD2 LEU 24 2HD2 LEU 24 -6.853 7.167 -16.053 168 3HD2 LEU 24 3HD2 LEU 24 -7.933 6.967 -14.652 169 H LYS 25 H LYS 25 -2.084 6.403 -16.351 170 HA LYS 25 HA LYS 25 -3.284 4.665 -18.261 171 1HB LYS 25 1HB LYS 25 -2.697 6.615 -19.276 172 2HB LYS 25 2HB LYS 25 -1.303 6.877 -18.249 173 1HG LYS 25 1HG LYS 25 0.114 5.693 -19.628 174 2HG LYS 25 2HG LYS 25 -1.095 4.484 -20.012 175 1HD LYS 25 1HD LYS 25 -0.674 5.708 -22.050 176 2HD LYS 25 2HD LYS 25 -2.256 6.208 -21.484 177 1HE LYS 25 1HE LYS 25 -1.464 8.339 -21.703 178 2HE LYS 25 2HE LYS 25 -0.628 8.038 -20.192 179 H THR 26 H THR 26 -0.326 4.688 -16.263 180 HA THR 26 HA THR 26 1.052 2.674 -17.641 181 HB THR 26 HB THR 26 1.062 3.859 -14.843 182 HG1 THR 26 1HG THR 26 2.047 4.893 -16.762 183 1HG2 THR 26 2HG2 THR 26 2.128 1.231 -15.602 184 2HG2 THR 26 3HG2 THR 26 3.446 2.365 -15.222 185 3HG2 THR 26 1HG2 THR 26 2.177 2.039 -14.017 186 H GLN 27 H GLN 27 -1.387 2.521 -14.993 187 HA GLN 27 HA GLN 27 -1.127 -0.255 -14.714 188 1HB GLN 27 1HB GLN 27 -3.317 1.703 -13.912 189 2HB GLN 27 2HB GLN 27 -3.374 0.000 -13.499 190 1HG GLN 27 1HG GLN 27 -2.164 1.942 -11.955 191 2HG GLN 27 2HG GLN 27 -1.814 0.229 -11.847 192 1HE2 GLN 27 1HE2 GLN 27 -0.031 -0.646 -12.965 193 2HE2 GLN 27 2HE2 GLN 27 1.330 0.322 -13.422 194 H ILE 28 H ILE 28 -3.504 1.868 -16.445 195 HA ILE 28 HA ILE 28 -5.180 -0.102 -17.370 196 HB ILE 28 HB ILE 28 -4.389 2.616 -18.333 197 1HG1 ILE 28 1HG1 ILE 28 -7.075 1.509 -17.477 198 2HG1 ILE 28 2HG1 ILE 28 -5.919 2.208 -16.360 199 1HG2 ILE 28 2HG2 ILE 28 -5.619 0.518 -19.973 200 2HG2 ILE 28 3HG2 ILE 28 -6.574 2.017 -19.883 201 3HG2 ILE 28 1HG2 ILE 28 -4.886 2.070 -20.443 202 1HD1 ILE 28 2HD1 ILE 28 -7.029 3.654 -18.810 203 2HD1 ILE 28 3HD1 ILE 28 -7.629 3.865 -17.147 204 3HD1 ILE 28 1HD1 ILE 28 -5.968 4.352 -17.562 205 H ASP 29 H ASP 29 -2.145 1.195 -18.865 206 HA ASP 29 HA ASP 29 -2.269 -0.342 -21.133 207 1HB ASP 29 1HB ASP 29 -0.537 1.527 -20.078 208 2HB ASP 29 2HB ASP 29 0.435 0.076 -19.933 209 HD2 ASP 29 HD ASP 29 -0.785 1.351 -23.509 210 H GLN 30 H GLN 30 -0.897 -0.958 -17.846 211 HA GLN 30 HA GLN 30 0.444 -3.281 -18.401 212 1HB GLN 30 1HB GLN 30 -0.741 -2.008 -15.967 213 2HB GLN 30 2HB GLN 30 -0.366 -3.715 -15.833 214 1HG GLN 30 1HG GLN 30 1.958 -3.364 -16.329 215 2HG GLN 30 2HG GLN 30 1.668 -1.754 -16.959 216 1HE2 GLN 30 1HE2 GLN 30 3.211 -0.898 -15.567 217 2HE2 GLN 30 2HE2 GLN 30 2.915 -0.635 -13.881 218 H VAL 31 H VAL 31 -3.023 -2.716 -17.598 219 HA VAL 31 HA VAL 31 -3.677 -5.456 -17.412 220 HB VAL 31 HB VAL 31 -5.232 -2.905 -17.788 221 1HG1 VAL 31 1HG1 VAL 31 -6.365 -4.846 -18.950 222 2HG1 VAL 31 2HG1 VAL 31 -6.481 -5.633 -17.357 223 3HG1 VAL 31 3HG1 VAL 31 -7.304 -4.081 -17.645 224 1HG2 VAL 31 3HG2 VAL 31 -4.063 -3.973 -15.564 225 2HG2 VAL 31 1HG2 VAL 31 -5.485 -2.903 -15.544 226 3HG2 VAL 31 2HG2 VAL 31 -5.699 -4.668 -15.461 227 H GLU 32 H GLU 32 -4.171 -2.979 -20.027 228 HA GLU 32 HA GLU 32 -5.333 -4.555 -21.861 229 1HB GLU 32 1HB GLU 32 -3.692 -2.108 -21.893 230 2HB GLU 32 2HB GLU 32 -3.563 -3.010 -23.390 231 1HG GLU 32 1HG GLU 32 -6.259 -3.165 -23.036 232 2HG GLU 32 2HG GLU 32 -5.959 -1.666 -22.179 233 HE2 GLU 32 HE GLU 32 -7.146 -0.807 -24.632 234 H SER 33 H SER 33 -1.874 -4.452 -20.936 235 HA SER 33 HA SER 33 -1.133 -6.173 -23.079 236 1HB SER 33 1HB SER 33 0.612 -4.739 -22.451 237 2HB SER 33 2HB SER 33 0.263 -4.884 -20.740 238 HG SER 33 HG SER 33 1.541 -6.610 -20.589 239 H THR 34 H THR 34 -1.306 -6.424 -19.452 240 HA THR 34 HA THR 34 -0.639 -9.100 -19.244 241 HB THR 34 HB THR 34 -2.135 -7.043 -17.625 242 HG1 THR 34 1HG THR 34 -0.341 -7.830 -16.204 243 1HG2 THR 34 2HG2 THR 34 -3.381 -9.283 -17.317 244 2HG2 THR 34 3HG2 THR 34 -1.838 -9.953 -16.735 245 3HG2 THR 34 1HG2 THR 34 -2.623 -8.624 -15.848 246 H ALA 35 H ALA 35 -3.837 -7.585 -19.903 247 HA ALA 35 HA ALA 35 -5.401 -9.827 -19.661 248 1HB ALA 35 1HB ALA 35 -5.936 -7.962 -21.935 249 2HB ALA 35 3HB ALA 35 -5.815 -7.243 -20.312 250 3HB ALA 35 2HB ALA 35 -7.016 -8.517 -20.633 251 H GLY 36 H GLY 36 -2.967 -9.006 -22.079 252 1HA GLY 36 2HA GLY 36 -2.096 -10.211 -23.766 253 2HA GLY 36 1HA GLY 36 -3.755 -10.468 -24.270 254 H SER 37 H SER 37 -1.762 -11.614 -21.444 255 HA SER 37 HA SER 37 -1.552 -14.206 -22.358 256 1HB SER 37 1HB SER 37 -1.583 -13.268 -19.456 257 2HB SER 37 2HB SER 37 -0.869 -14.753 -20.052 258 HG SER 37 HG SER 37 0.022 -12.050 -20.400 259 H LEU 38 H LEU 38 -4.176 -12.469 -20.759 260 HA LEU 38 HA LEU 38 -5.519 -14.803 -19.821 261 1HB LEU 38 1HB LEU 38 -6.100 -11.879 -19.999 262 2HB LEU 38 2HB LEU 38 -7.437 -12.987 -19.760 263 HG LEU 38 HG LEU 38 -6.986 -12.594 -17.585 264 1HD1 LEU 38 1HD1 LEU 38 -6.406 -15.014 -18.083 265 2HD1 LEU 38 2HD1 LEU 38 -4.698 -14.533 -17.951 266 3HD1 LEU 38 3HD1 LEU 38 -5.785 -14.346 -16.554 267 1HD2 LEU 38 3HD2 LEU 38 -4.095 -12.068 -18.322 268 2HD2 LEU 38 1HD2 LEU 38 -5.354 -10.860 -17.969 269 3HD2 LEU 38 2HD2 LEU 38 -4.770 -11.941 -16.680 270 H GLN 39 H GLN 39 -6.489 -12.368 -22.341 271 HA GLN 39 HA GLN 39 -8.409 -13.943 -23.463 272 1HB GLN 39 1HB GLN 39 -7.865 -12.492 -25.584 273 2HB GLN 39 2HB GLN 39 -8.457 -11.702 -24.136 274 1HG GLN 39 1HG GLN 39 -5.575 -11.931 -23.940 275 2HG GLN 39 2HG GLN 39 -5.970 -11.254 -25.507 276 1HE2 GLN 39 1HE2 GLN 39 -7.772 -11.006 -22.468 277 2HE2 GLN 39 2HE2 GLN 39 -7.660 -9.288 -22.276 278 H GLY 40 H GLY 40 -4.979 -14.361 -23.510 279 1HA GLY 40 2HA GLY 40 -3.577 -15.532 -24.889 280 2HA GLY 40 1HA GLY 40 -4.880 -15.782 -26.034 281 H GLN 41 H GLN 41 -6.276 -16.525 -23.107 282 HA GLN 41 HA GLN 41 -6.066 -19.305 -23.655 283 1HB GLN 41 1HB GLN 41 -4.090 -19.298 -22.349 284 2HB GLN 41 2HB GLN 41 -4.712 -18.102 -21.229 285 1HG GLN 41 1HG GLN 41 -6.477 -19.844 -20.530 286 2HG GLN 41 2HG GLN 41 -5.578 -21.017 -21.472 287 1HE2 GLN 41 1HE2 GLN 41 -5.884 -19.408 -18.525 288 2HE2 GLN 41 2HE2 GLN 41 -4.430 -19.933 -17.743 289 H TRP 42 H TRP 42 -8.158 -19.969 -23.476 290 HA TRP 42 HA TRP 42 -9.634 -19.455 -21.100 291 1HB TRP 42 1HB TRP 42 -10.422 -17.986 -23.617 292 2HB TRP 42 2HB TRP 42 -11.530 -18.301 -22.296 293 HD1 TRP 42 HD TRP 42 -9.524 -15.549 -23.443 294 HE1 TRP 42 1HE TRP 42 -8.815 -13.819 -21.581 295 HE3 TRP 42 3HE TRP 42 -10.554 -18.582 -19.494 296 HZ2 TRP 42 2HZ TRP 42 -8.766 -13.911 -18.729 297 HZ3 TRP 42 3HZ TRP 42 -10.148 -17.685 -17.204 298 HH2 TRP 42 HH TRP 42 -9.285 -15.436 -16.788 299 H ARG 43 H ARG 43 -11.993 -20.408 -21.507 300 HA ARG 43 HA ARG 43 -11.839 -22.434 -23.568 301 1HB ARG 43 1HB ARG 43 -12.177 -22.884 -20.585 302 2HB ARG 43 2HB ARG 43 -12.935 -23.996 -21.708 303 1HG ARG 43 1HG ARG 43 -10.037 -23.303 -22.169 304 2HG ARG 43 2HG ARG 43 -10.415 -24.362 -20.824 305 1HD ARG 43 1HD ARG 43 -11.856 -25.710 -22.560 306 2HD ARG 43 2HD ARG 43 -10.971 -24.816 -23.780 307 HE ARG 43 HE ARG 43 -9.084 -26.116 -23.321 308 2HH1 ARG 43 1HH ARG 43 -8.347 -28.355 -20.770 309 1HH2 ARG 43 2HH2 ARG 43 -11.313 -26.361 -20.578 310 2HH2 ARG 43 1HH2 ARG 43 -10.378 -27.574 -19.767 311 H GLY 44 H GLY 44 -13.617 -21.897 -24.816 312 1HA GLY 44 2HA GLY 44 -16.050 -22.293 -24.814 313 2HA GLY 44 1HA GLY 44 -15.638 -20.599 -24.997 314 H ALA 45 H ALA 45 -15.645 -19.188 -23.037 315 HA ALA 45 HA ALA 45 -17.894 -19.114 -21.665 316 1HB ALA 45 3HB ALA 45 -16.108 -21.219 -20.476 317 2HB ALA 45 2HB ALA 45 -17.882 -21.180 -20.619 318 3HB ALA 45 1HB ALA 45 -17.067 -20.197 -19.379 319 H ALA 46 H ALA 46 -14.953 -19.471 -19.661 320 HA ALA 46 HA ALA 46 -15.055 -16.908 -18.668 321 1HB ALA 46 2HB ALA 46 -12.386 -18.222 -18.970 322 2HB ALA 46 1HB ALA 46 -13.648 -19.139 -18.113 323 3HB ALA 46 3HB ALA 46 -13.163 -17.531 -17.526 324 H GLY 47 H GLY 47 -13.881 -18.108 -21.764 325 1HA GLY 47 2HA GLY 47 -12.954 -17.082 -23.535 326 2HA GLY 47 1HA GLY 47 -12.078 -16.057 -22.416 327 H THR 48 H THR 48 -15.434 -16.513 -23.740 328 HA THR 48 HA THR 48 -15.651 -13.980 -24.812 329 HB THR 48 HB THR 48 -18.051 -14.546 -24.928 330 HG1 THR 48 1HG THR 48 -17.247 -16.666 -23.068 331 1HG2 THR 48 2HG2 THR 48 -15.996 -16.364 -25.740 332 2HG2 THR 48 3HG2 THR 48 -17.265 -17.353 -24.980 333 3HG2 THR 48 1HG2 THR 48 -17.666 -16.291 -26.351 334 H ALA 49 H ALA 49 -15.960 -15.036 -21.452 335 HA ALA 49 HA ALA 49 -17.357 -12.724 -20.587 336 1HB ALA 49 1HB ALA 49 -15.856 -15.005 -19.306 337 2HB ALA 49 3HB ALA 49 -17.575 -14.564 -19.169 338 3HB ALA 49 2HB ALA 49 -16.339 -13.602 -18.323 339 H ALA 50 H ALA 50 -13.882 -13.764 -20.548 340 HA ALA 50 HA ALA 50 -13.056 -11.233 -19.493 341 1HB ALA 50 3HB ALA 50 -11.415 -12.643 -18.863 342 2HB ALA 50 1HB ALA 50 -11.932 -13.877 -20.037 343 3HB ALA 50 2HB ALA 50 -10.829 -12.574 -20.542 344 H GLN 51 H GLN 51 -12.491 -12.981 -22.637 345 HA GLN 51 HA GLN 51 -11.224 -11.090 -23.991 346 1HB GLN 51 1HB GLN 51 -11.652 -12.418 -25.787 347 2HB GLN 51 2HB GLN 51 -12.485 -13.450 -24.641 348 1HG GLN 51 1HG GLN 51 -14.067 -13.095 -26.394 349 2HG GLN 51 2HG GLN 51 -14.599 -12.043 -25.097 350 1HE2 GLN 51 1HE2 GLN 51 -15.467 -10.346 -26.038 351 2HE2 GLN 51 2HE2 GLN 51 -14.735 -9.339 -27.243 352 H ALA 52 H ALA 52 -14.715 -11.125 -23.184 353 HA ALA 52 HA ALA 52 -15.302 -8.851 -24.814 354 1HB ALA 52 2HB ALA 52 -16.953 -10.624 -24.272 355 2HB ALA 52 1HB ALA 52 -17.509 -9.017 -23.746 356 3HB ALA 52 3HB ALA 52 -16.862 -10.170 -22.554 357 H ALA 53 H ALA 53 -14.706 -9.501 -21.307 358 HA ALA 53 HA ALA 53 -15.238 -6.968 -20.357 359 1HB ALA 53 1HB ALA 53 -13.013 -8.768 -19.348 360 2HB ALA 53 3HB ALA 53 -14.734 -9.157 -19.109 361 3HB ALA 53 2HB ALA 53 -14.053 -7.666 -18.414 362 H VAL 54 H VAL 54 -12.003 -8.352 -21.294 363 HA VAL 54 HA VAL 54 -10.618 -5.967 -21.041 364 HB VAL 54 HB VAL 54 -9.185 -7.688 -21.189 365 1HG1 VAL 54 3HG1 VAL 54 -11.261 -8.957 -22.948 366 2HG1 VAL 54 1HG1 VAL 54 -9.600 -9.597 -22.955 367 3HG1 VAL 54 2HG1 VAL 54 -10.529 -9.549 -21.438 368 1HG2 VAL 54 3HG2 VAL 54 -8.836 -6.059 -23.208 369 2HG2 VAL 54 1HG2 VAL 54 -7.900 -7.570 -23.117 370 3HG2 VAL 54 2HG2 VAL 54 -9.319 -7.466 -24.186 371 H VAL 55 H VAL 55 -12.504 -7.347 -23.770 372 HA VAL 55 HA VAL 55 -11.694 -5.566 -25.729 373 HB VAL 55 HB VAL 55 -13.983 -7.371 -25.218 374 1HG1 VAL 55 2HG1 VAL 55 -14.149 -5.011 -27.094 375 2HG1 VAL 55 3HG1 VAL 55 -15.030 -6.522 -27.424 376 3HG1 VAL 55 1HG1 VAL 55 -15.356 -5.610 -25.930 377 1HG2 VAL 55 3HG2 VAL 55 -11.634 -7.501 -26.648 378 2HG2 VAL 55 1HG2 VAL 55 -13.034 -8.580 -26.859 379 3HG2 VAL 55 2HG2 VAL 55 -12.835 -7.164 -27.918 380 H ARG 56 H ARG 56 -14.489 -5.371 -23.420 381 HA ARG 56 HA ARG 56 -15.301 -2.883 -24.333 382 1HB ARG 56 1HB ARG 56 -15.844 -4.630 -21.962 383 2HB ARG 56 2HB ARG 56 -16.196 -2.929 -21.725 384 1HG ARG 56 1HG ARG 56 -18.208 -4.011 -22.575 385 2HG ARG 56 2HG ARG 56 -17.590 -2.950 -23.824 386 1HD ARG 56 1HD ARG 56 -16.289 -5.463 -24.226 387 2HD ARG 56 2HD ARG 56 -17.971 -5.840 -23.908 388 HE ARG 56 HE ARG 56 -16.910 -4.448 -26.250 389 2HH1 ARG 56 1HH ARG 56 -20.027 -3.862 -27.666 390 1HH2 ARG 56 2HH2 ARG 56 -19.800 -4.918 -24.254 391 2HH2 ARG 56 1HH2 ARG 56 -20.897 -4.477 -25.520 392 H PHE 57 H PHE 57 -13.299 -3.898 -21.475 393 HA PHE 57 HA PHE 57 -12.883 -1.403 -20.395 394 1HB PHE 57 1HB PHE 57 -12.056 -3.176 -19.084 395 2HB PHE 57 2HB PHE 57 -11.584 -4.112 -20.488 396 HD1 PHE 57 1HD PHE 57 -10.497 -1.755 -17.968 397 HD2 PHE 57 2HD PHE 57 -9.414 -3.647 -21.609 398 HE1 PHE 57 1HE PHE 57 -8.098 -1.128 -17.580 399 HE2 PHE 57 2HE PHE 57 -7.014 -3.020 -21.220 400 HZ PHE 57 HZ PHE 57 -6.385 -1.768 -19.211 401 H GLN 58 H GLN 58 -11.272 -3.030 -23.154 402 HA GLN 58 HA GLN 58 -9.095 -1.340 -23.314 403 1HB GLN 58 1HB GLN 58 -10.572 -3.047 -25.340 404 2HB GLN 58 2HB GLN 58 -9.207 -2.065 -25.832 405 1HG GLN 58 1HG GLN 58 -8.534 -3.500 -23.388 406 2HG GLN 58 2HG GLN 58 -9.145 -4.632 -24.578 407 1HE2 GLN 58 1HE2 GLN 58 -6.816 -5.291 -24.238 408 2HE2 GLN 58 2HE2 GLN 58 -5.635 -4.645 -25.327 409 H GLU 59 H GLU 59 -12.225 -1.253 -25.173 410 HA GLU 59 HA GLU 59 -11.692 1.070 -26.517 411 1HB GLU 59 1HB GLU 59 -14.318 -0.160 -25.590 412 2HB GLU 59 2HB GLU 59 -14.260 1.250 -26.629 413 1HG GLU 59 1HG GLU 59 -12.582 -1.107 -27.449 414 2HG GLU 59 2HG GLU 59 -14.319 -1.283 -27.600 415 HE2 GLU 59 HE GLU 59 -12.341 1.227 -29.994 416 H ALA 60 H ALA 60 -12.576 0.533 -23.148 417 HA ALA 60 HA ALA 60 -13.419 3.259 -22.740 418 1HB ALA 60 1HB ALA 60 -12.924 0.905 -20.875 419 2HB ALA 60 2HB ALA 60 -13.552 2.486 -20.353 420 3HB ALA 60 3HB ALA 60 -14.495 1.482 -21.481 421 H ALA 61 H ALA 61 -10.480 1.293 -22.580 422 HA ALA 61 HA ALA 61 -8.986 2.805 -20.810 423 1HB ALA 61 3HB ALA 61 -8.470 0.547 -21.896 424 2HB ALA 61 2HB ALA 61 -7.105 1.682 -21.761 425 3HB ALA 61 1HB ALA 61 -7.931 1.465 -23.323 426 H ASN 62 H ASN 62 -9.050 3.026 -24.444 427 HA ASN 62 HA ASN 62 -7.452 5.182 -24.686 428 1HB ASN 62 1HB ASN 62 -9.438 5.622 -26.633 429 2HB ASN 62 2HB ASN 62 -8.016 4.617 -26.833 430 1HD2 ASN 62 1HD2 ASN 62 -8.186 2.370 -25.942 431 2HD2 ASN 62 2HD2 ASN 62 -9.662 1.501 -26.202 432 H LYS 63 H LYS 63 -11.031 5.031 -24.112 433 HA LYS 63 HA LYS 63 -11.634 7.699 -24.318 434 1HB LYS 63 1HB LYS 63 -12.808 5.574 -22.501 435 2HB LYS 63 2HB LYS 63 -13.530 7.146 -22.774 436 1HG LYS 63 1HG LYS 63 -12.788 5.681 -25.262 437 2HG LYS 63 2HG LYS 63 -14.035 4.904 -24.307 438 1HD LYS 63 1HD LYS 63 -14.089 7.794 -25.296 439 2HD LYS 63 2HD LYS 63 -15.026 6.470 -25.958 440 1HE LYS 63 1HE LYS 63 -15.855 6.217 -23.418 441 2HE LYS 63 2HE LYS 63 -15.359 7.895 -23.314 442 H GLN 64 H GLN 64 -10.144 5.880 -21.606 443 HA GLN 64 HA GLN 64 -10.285 8.093 -19.857 444 1HB GLN 64 1HB GLN 64 -9.019 5.365 -19.825 445 2HB GLN 64 2HB GLN 64 -8.410 6.552 -18.688 446 1HG GLN 64 1HG GLN 64 -11.283 6.720 -18.637 447 2HG GLN 64 2HG GLN 64 -10.861 5.021 -18.551 448 1HE2 GLN 64 1HE2 GLN 64 -9.528 4.256 -16.883 449 2HE2 GLN 64 2HE2 GLN 64 -9.339 5.105 -15.385 450 H LYS 65 H LYS 65 -7.826 6.701 -22.082 451 HA LYS 65 HA LYS 65 -5.654 8.206 -21.251 452 1HB LYS 65 1HB LYS 65 -6.426 6.632 -23.629 453 2HB LYS 65 2HB LYS 65 -5.229 7.874 -23.935 454 1HG LYS 65 1HG LYS 65 -3.828 6.144 -23.260 455 2HG LYS 65 2HG LYS 65 -4.104 6.916 -21.711 456 1HD LYS 65 1HD LYS 65 -6.283 5.162 -21.944 457 2HD LYS 65 2HD LYS 65 -4.965 4.254 -22.658 458 1HE LYS 65 1HE LYS 65 -4.354 5.682 -20.088 459 2HE LYS 65 2HE LYS 65 -5.445 4.316 -19.975 460 H GLN 66 H GLN 66 -8.319 8.963 -23.556 461 HA GLN 66 HA GLN 66 -7.204 11.383 -24.381 462 1HB GLN 66 1HB GLN 66 -9.242 9.866 -25.277 463 2HB GLN 66 2HB GLN 66 -10.189 11.007 -24.342 464 1HG GLN 66 1HG GLN 66 -8.239 11.670 -26.595 465 2HG GLN 66 2HG GLN 66 -9.983 11.836 -26.638 466 1HE2 GLN 66 1HE2 GLN 66 -10.980 13.552 -25.712 467 2HE2 GLN 66 2HE2 GLN 66 -10.163 14.922 -25.037 468 H GLU 67 H GLU 67 -9.838 10.623 -21.989 469 HA GLU 67 HA GLU 67 -10.271 13.216 -21.210 470 1HB GLU 67 1HB GLU 67 -10.995 10.546 -20.317 471 2HB GLU 67 2HB GLU 67 -10.659 11.555 -18.924 472 1HG GLU 67 1HG GLU 67 -12.436 12.536 -21.191 473 2HG GLU 67 2HG GLU 67 -13.084 11.569 -19.881 474 HE2 GLU 67 HE GLU 67 -11.717 12.822 -17.651 475 H LEU 68 H LEU 68 -7.663 10.963 -20.409 476 HA LEU 68 HA LEU 68 -6.811 12.325 -18.070 477 1HB LEU 68 1HB LEU 68 -6.081 9.998 -19.620 478 2HB LEU 68 2HB LEU 68 -4.653 10.916 -19.183 479 HG LEU 68 HG LEU 68 -5.056 10.676 -16.865 480 1HD1 LEU 68 2HD1 LEU 68 -7.845 9.850 -17.658 481 2HD1 LEU 68 3HD1 LEU 68 -7.168 9.467 -16.057 482 3HD1 LEU 68 1HD1 LEU 68 -7.326 11.163 -16.574 483 1HD2 LEU 68 2HD2 LEU 68 -5.722 8.076 -18.270 484 2HD2 LEU 68 3HD2 LEU 68 -4.107 8.693 -17.846 485 3HD2 LEU 68 1HD2 LEU 68 -5.244 8.218 -16.562 486 H ASP 69 H ASP 69 -5.543 12.195 -21.476 487 HA ASP 69 HA ASP 69 -3.622 14.131 -21.044 488 1HB ASP 69 1HB ASP 69 -4.312 12.471 -23.112 489 2HB ASP 69 2HB ASP 69 -4.921 13.989 -23.741 490 HD2 ASP 69 HD ASP 69 -2.774 14.991 -25.084 491 H GLU 70 H GLU 70 -6.938 14.287 -22.551 492 HA GLU 70 HA GLU 70 -7.011 16.898 -23.198 493 1HB GLU 70 1HB GLU 70 -9.280 16.583 -23.489 494 2HB GLU 70 2HB GLU 70 -8.795 14.906 -23.331 495 1HG GLU 70 1HG GLU 70 -9.363 14.930 -20.921 496 2HG GLU 70 2HG GLU 70 -9.747 16.638 -21.001 497 HE2 GLU 70 HE GLU 70 -12.763 15.722 -21.020 498 H ILE 71 H ILE 71 -7.766 15.420 -19.979 499 HA ILE 71 HA ILE 71 -8.387 17.913 -18.783 500 HB ILE 71 HB ILE 71 -7.827 15.145 -17.751 501 1HG1 ILE 71 1HG1 ILE 71 -10.345 16.835 -17.753 502 2HG1 ILE 71 2HG1 ILE 71 -9.966 15.603 -18.941 503 1HG2 ILE 71 3HG2 ILE 71 -7.010 16.976 -16.169 504 2HG2 ILE 71 1HG2 ILE 71 -8.722 17.432 -15.998 505 3HG2 ILE 71 2HG2 ILE 71 -8.184 15.803 -15.525 506 1HD1 ILE 71 3HD1 ILE 71 -9.978 14.977 -15.964 507 2HD1 ILE 71 1HD1 ILE 71 -11.458 14.895 -16.950 508 3HD1 ILE 71 2HD1 ILE 71 -10.076 13.839 -17.330 509 H SER 72 H SER 72 -5.453 15.824 -18.970 510 HA SER 72 HA SER 72 -3.936 17.309 -17.208 511 1HB SER 72 1HB SER 72 -2.816 15.370 -17.658 512 2HB SER 72 2HB SER 72 -3.481 15.243 -19.274 513 HG SER 72 HG SER 72 -1.663 16.043 -20.056 514 H THR 73 H THR 73 -4.911 17.873 -20.554 515 HA THR 73 HA THR 73 -2.899 19.958 -20.899 516 HB THR 73 HB THR 73 -4.857 18.438 -22.649 517 HG1 THR 73 1HG THR 73 -2.767 18.172 -23.734 518 1HG2 THR 73 1HG2 THR 73 -4.050 21.255 -22.998 519 2HG2 THR 73 2HG2 THR 73 -3.438 20.219 -24.310 520 3HG2 THR 73 3HG2 THR 73 -5.184 20.285 -23.968 521 H ASN 74 H ASN 74 -6.347 19.508 -20.190 522 HA ASN 74 HA ASN 74 -7.325 21.917 -20.897 523 1HB ASN 74 1HB ASN 74 -7.958 19.852 -18.862 524 2HB ASN 74 2HB ASN 74 -8.514 21.446 -18.391 525 1HD2 ASN 74 1HD2 ASN 74 -8.997 18.731 -20.380 526 2HD2 ASN 74 2HD2 ASN 74 -10.359 19.283 -21.296 527 H ILE 75 H ILE 75 -5.240 20.996 -18.133 528 HA ILE 75 HA ILE 75 -5.576 23.330 -16.617 529 HB ILE 75 HB ILE 75 -3.142 21.553 -16.723 530 1HG1 ILE 75 1HG1 ILE 75 -5.187 20.178 -16.590 531 2HG1 ILE 75 2HG1 ILE 75 -4.211 20.082 -15.138 532 1HG2 ILE 75 3HG2 ILE 75 -4.251 23.540 -14.773 533 2HG2 ILE 75 1HG2 ILE 75 -3.320 22.146 -14.175 534 3HG2 ILE 75 2HG2 ILE 75 -2.577 23.286 -15.322 535 1HD1 ILE 75 1HD1 ILE 75 -6.210 22.267 -15.053 536 2HD1 ILE 75 2HD1 ILE 75 -6.923 20.642 -15.193 537 3HD1 ILE 75 3HD1 ILE 75 -5.834 21.022 -13.838 538 H ARG 76 H ARG 76 -3.070 22.365 -19.058 539 HA ARG 76 HA ARG 76 -1.570 24.613 -18.909 540 1HB ARG 76 1HB ARG 76 -2.235 23.164 -21.516 541 2HB ARG 76 2HB ARG 76 -0.760 24.035 -21.149 542 1HG ARG 76 1HG ARG 76 -0.694 22.285 -19.084 543 2HG ARG 76 2HG ARG 76 -1.658 21.326 -20.191 544 1HD ARG 76 1HD ARG 76 0.631 22.553 -21.570 545 2HD ARG 76 2HD ARG 76 1.158 21.592 -20.203 546 HE ARG 76 HE ARG 76 -0.707 19.958 -21.448 547 2HH1 ARG 76 1HH ARG 76 1.120 18.569 -24.055 548 1HH2 ARG 76 2HH2 ARG 76 2.217 21.626 -22.552 549 2HH2 ARG 76 1HH2 ARG 76 2.575 20.452 -23.774 550 H GLN 77 H GLN 77 -4.791 24.151 -20.267 551 HA GLN 77 HA GLN 77 -4.662 26.513 -21.863 552 1HB GLN 77 1HB GLN 77 -6.800 24.477 -21.200 553 2HB GLN 77 2HB GLN 77 -7.251 25.987 -21.966 554 1HG GLN 77 1HG GLN 77 -4.921 24.897 -23.320 555 2HG GLN 77 2HG GLN 77 -6.149 23.652 -23.205 556 1HE2 GLN 77 1HE2 GLN 77 -5.013 26.114 -25.034 557 2HE2 GLN 77 2HE2 GLN 77 -6.418 26.538 -25.954 558 H ALA 78 H ALA 78 -5.436 25.635 -18.560 559 HA ALA 78 HA ALA 78 -7.210 27.747 -17.987 560 1HB ALA 78 1HB ALA 78 -5.317 26.385 -16.045 561 2HB ALA 78 2HB ALA 78 -6.931 27.063 -15.724 562 3HB ALA 78 3HB ALA 78 -6.766 25.577 -16.689 563 H GLY 79 H GLY 79 -3.778 27.577 -18.587 564 1HA GLY 79 2HA GLY 79 -3.510 30.359 -17.616 565 2HA GLY 79 1HA GLY 79 -2.725 29.708 -19.041 566 H VAL 80 H VAL 80 -2.527 27.066 -17.194 567 HA VAL 80 HA VAL 80 -0.207 28.004 -15.662 568 HB VAL 80 HB VAL 80 -1.606 27.048 -14.126 569 1HG1 VAL 80 3HG1 VAL 80 -2.410 24.967 -16.187 570 2HG1 VAL 80 1HG1 VAL 80 -3.017 25.056 -14.516 571 3HG1 VAL 80 2HG1 VAL 80 -3.374 26.369 -15.663 572 1HG2 VAL 80 2HG2 VAL 80 0.083 24.770 -15.201 573 2HG2 VAL 80 3HG2 VAL 80 0.491 25.913 -13.899 574 3HG2 VAL 80 1HG2 VAL 80 -0.796 24.708 -13.654 575 H GLN 81 H GLN 81 1.419 27.969 -17.224 576 HA GLN 81 HA GLN 81 2.104 25.296 -18.085 577 1HB GLN 81 1HB GLN 81 1.310 27.536 -19.876 578 2HB GLN 81 2HB GLN 81 2.795 26.728 -20.337 579 1HG GLN 81 1HG GLN 81 1.206 24.554 -19.750 580 2HG GLN 81 2HG GLN 81 -0.004 25.688 -20.315 581 1HE2 GLN 81 1HE2 GLN 81 3.179 24.337 -21.105 582 2HE2 GLN 81 2HE2 GLN 81 3.004 24.334 -22.828 583 H TYR 82 H TYR 82 2.928 27.800 -16.271 584 HA TYR 82 HA TYR 82 5.771 27.494 -16.879 585 1HB TYR 82 1HB TYR 82 6.005 29.964 -16.658 586 2HB TYR 82 2HB TYR 82 4.808 29.635 -17.895 587 HD1 TYR 82 1HD TYR 82 2.305 29.622 -17.123 588 HD2 TYR 82 2HD TYR 82 5.487 31.406 -14.887 589 HE1 TYR 82 1HE TYR 82 0.627 31.068 -15.874 590 HE2 TYR 82 2HE TYR 82 3.798 32.846 -13.646 591 HH TYR 82 HH TYR 82 1.423 33.747 -14.240 592 H SER 83 H SER 83 6.288 26.308 -15.057 593 HA SER 83 HA SER 83 5.751 27.691 -12.555 594 1HB SER 83 1HB SER 83 5.444 25.419 -11.472 595 2HB SER 83 2HB SER 83 4.153 25.891 -12.558 596 HG SER 83 HG SER 83 4.874 24.455 -14.121 597 H ARG 84 H ARG 84 7.585 25.032 -14.219 598 HA ARG 84 HA ARG 84 9.700 25.332 -12.314 599 1HB ARG 84 1HB ARG 84 9.106 23.459 -14.620 600 2HB ARG 84 2HB ARG 84 10.753 23.563 -14.032 601 1HG ARG 84 1HG ARG 84 9.828 23.140 -11.673 602 2HG ARG 84 2HG ARG 84 8.278 22.802 -12.418 603 1HD ARG 84 1HD ARG 84 9.671 21.121 -13.931 604 2HD ARG 84 2HD ARG 84 10.868 21.242 -12.657 605 HE ARG 84 HE ARG 84 8.140 20.703 -11.694 606 2HH1 ARG 84 1HH ARG 84 8.877 17.446 -10.738 607 1HH2 ARG 84 2HH2 ARG 84 11.197 19.267 -12.766 608 2HH2 ARG 84 1HH2 ARG 84 10.906 17.753 -11.976 609 H ALA 85 H ALA 85 8.820 27.406 -14.513 610 HA ALA 85 HA ALA 85 10.614 27.628 -16.536 611 1HB ALA 85 1HB ALA 85 10.020 29.934 -16.586 612 2HB ALA 85 2HB ALA 85 8.606 29.097 -15.903 613 3HB ALA 85 3HB ALA 85 9.723 29.976 -14.832 614 H ASP 86 H ASP 86 11.112 28.169 -13.048 615 HA ASP 86 HA ASP 86 13.756 29.192 -13.607 616 1HB ASP 86 1HB ASP 86 12.540 28.692 -10.864 617 2HB ASP 86 2HB ASP 86 13.838 29.796 -11.274 618 HD2 ASP 86 HD ASP 86 10.208 30.424 -12.608 619 H GLU 87 H GLU 87 13.296 26.470 -14.375 620 HA GLU 87 HA GLU 87 13.656 24.539 -12.538 621 1HB GLU 87 1HB GLU 87 13.401 24.426 -15.134 622 2HB GLU 87 2HB GLU 87 15.152 24.493 -15.180 623 1HG GLU 87 1HG GLU 87 14.759 22.549 -13.257 624 2HG GLU 87 2HG GLU 87 13.362 22.284 -14.282 625 HE2 GLU 87 HE GLU 87 16.775 22.654 -14.400 626 H GLU 88 H GLU 88 15.924 27.033 -13.506 627 HA GLU 88 HA GLU 88 18.318 25.846 -13.038 628 1HB GLU 88 1HB GLU 88 17.600 28.318 -13.731 629 2HB GLU 88 2HB GLU 88 17.832 28.648 -12.025 630 1HG GLU 88 1HG GLU 88 20.011 27.067 -13.329 631 2HG GLU 88 2HG GLU 88 19.848 28.720 -13.888 632 HE2 GLU 88 HE GLU 88 21.642 29.364 -12.888 633 H GLN 89 H GLN 89 15.764 26.652 -10.761 634 HA GLN 89 HA GLN 89 17.514 26.573 -8.506 635 1HB GLN 89 1HB GLN 89 15.449 26.866 -7.188 636 2HB GLN 89 2HB GLN 89 15.516 28.024 -8.502 637 1HG GLN 89 1HG GLN 89 13.467 27.291 -9.144 638 2HG GLN 89 2HG GLN 89 14.230 25.795 -9.647 639 1HE2 GLN 89 1HE2 GLN 89 13.731 23.969 -8.665 640 2HE2 GLN 89 2HE2 GLN 89 12.807 23.798 -7.210 641 H GLN 90 H GLN 90 15.591 24.341 -10.430 642 HA GLN 90 HA GLN 90 15.463 22.379 -8.367 643 1HB GLN 90 1HB GLN 90 14.217 22.837 -10.906 644 2HB GLN 90 2HB GLN 90 15.007 21.276 -11.005 645 1HG GLN 90 1HG GLN 90 13.479 21.842 -8.482 646 2HG GLN 90 2HG GLN 90 12.526 21.618 -9.936 647 1HE2 GLN 90 1HE2 GLN 90 13.180 19.719 -11.318 648 2HE2 GLN 90 2HE2 GLN 90 13.532 18.224 -10.516 649 H GLN 91 H GLN 91 17.385 22.988 -11.360 650 HA GLN 91 HA GLN 91 18.797 20.569 -11.163 651 1HB GLN 91 1HB GLN 91 18.526 21.846 -13.282 652 2HB GLN 91 2HB GLN 91 19.500 23.149 -12.632 653 1HG GLN 91 1HG GLN 91 20.914 20.616 -12.323 654 2HG GLN 91 2HG GLN 91 20.412 20.813 -13.991 655 1HE2 GLN 91 1HE2 GLN 91 23.034 20.992 -12.507 656 2HE2 GLN 91 2HE2 GLN 91 23.755 22.484 -13.011 657 H ALA 92 H ALA 92 18.829 23.351 -9.234 658 HA ALA 92 HA ALA 92 21.681 23.160 -8.649 659 1HB ALA 92 3HB ALA 92 21.304 25.224 -7.382 660 2HB ALA 92 2HB ALA 92 19.549 25.089 -7.644 661 3HB ALA 92 1HB ALA 92 20.634 25.386 -9.023 662 H LEU 93 H LEU 93 19.887 20.908 -8.054 663 HA LEU 93 HA LEU 93 19.280 21.050 -5.265 664 1HB LEU 93 1HB LEU 93 18.746 19.319 -7.504 665 2HB LEU 93 2HB LEU 93 19.318 18.373 -6.144 666 HG LEU 93 HG LEU 93 16.840 18.598 -6.285 667 1HD1 LEU 93 1HD1 LEU 93 18.538 18.967 -3.983 668 2HD1 LEU 93 2HD1 LEU 93 16.977 19.790 -3.743 669 3HD1 LEU 93 3HD1 LEU 93 17.017 18.055 -4.141 670 1HD2 LEU 93 1HD2 LEU 93 17.519 21.422 -6.417 671 2HD2 LEU 93 2HD2 LEU 93 15.996 20.588 -6.808 672 3HD2 LEU 93 3HD2 LEU 93 16.338 21.078 -5.131 673 H SER 94 H SER 94 21.644 21.903 -4.930 674 HA SER 94 HA SER 94 23.418 19.612 -4.689 675 1HB SER 94 1HB SER 94 24.997 21.761 -4.085 676 2HB SER 94 2HB SER 94 24.797 21.120 -5.704 677 HG SER 94 HG SER 94 23.897 23.534 -4.613 678 H SER 95 H SER 95 21.092 21.120 -2.918 679 HA SER 95 HA SER 95 22.641 21.311 -0.488 680 1HB SER 95 1HB SER 95 21.171 23.120 -0.569 681 2HB SER 95 2HB SER 95 19.914 22.209 -1.382 682 HG SER 95 HG SER 95 19.194 21.380 0.526 683 H GLN 96 H GLN 96 19.630 19.681 -1.727 684 HA GLN 96 HA GLN 96 19.422 18.020 0.514 685 1HB GLN 96 1HB GLN 96 17.734 18.710 -1.490 686 2HB GLN 96 2HB GLN 96 18.253 17.155 -2.111 687 1HG GLN 96 1HG GLN 96 17.235 17.540 0.740 688 2HG GLN 96 2HG GLN 96 16.182 17.116 -0.596 689 1HE2 GLN 96 1HE2 GLN 96 17.152 15.728 1.909 690 2HE2 GLN 96 2HE2 GLN 96 17.693 14.165 1.393 691 H MET 97 H MET 97 20.497 17.373 -2.902 692 HA MET 97 HA MET 97 21.117 14.778 -2.685 693 1HB MET 97 1HB MET 97 21.337 16.217 -4.742 694 2HB MET 97 2HB MET 97 22.763 16.975 -4.062 695 1HG MET 97 1HG MET 97 23.097 14.087 -3.975 696 2HG MET 97 2HG MET 97 22.627 14.557 -5.596 697 1HE MET 97 1HE MET 97 25.197 13.327 -5.730 698 2HE MET 97 2HE MET 97 26.664 14.183 -5.198 699 3HE MET 97 3HE MET 97 25.533 13.521 -3.993 700 H GLY 98 H GLY 98 22.549 13.515 -1.558 701 1HA GLY 98 2HA GLY 98 24.254 14.720 0.389 702 2HA GLY 98 1HA GLY 98 25.172 14.094 -0.967 703 H PHE 99 H PHE 99 24.440 13.273 2.053 704 HA PHE 99 HA PHE 99 24.521 10.449 1.437 705 1HB PHE 99 1HB PHE 99 25.405 12.326 3.485 706 2HB PHE 99 2HB PHE 99 24.384 11.136 4.268 707 HD1 PHE 99 1HD PHE 99 27.601 11.825 3.987 708 HD2 PHE 99 2HD PHE 99 24.992 8.660 2.898 709 HE1 PHE 99 1HE PHE 99 29.526 10.216 4.053 710 HE2 PHE 99 2HE PHE 99 26.917 7.051 2.964 711 HZ PHE 99 HZ PHE 99 29.161 7.848 3.540 712 H MET 601 H MET 601 3.788 -30.186 -15.861 713 HA MET 601 HA MET 601 3.366 -28.834 -18.024 714 1HB MET 601 1HB MET 601 5.393 -30.882 -17.245 715 2HB MET 601 2HB MET 601 5.353 -30.569 -18.969 716 1HG MET 601 1HG MET 601 5.917 -28.274 -18.703 717 2HG MET 601 2HG MET 601 5.390 -28.234 -17.032 718 1HE MET 601 3HE MET 601 7.799 -27.624 -18.990 719 2HE MET 601 1HE MET 601 9.203 -27.639 -17.896 720 3HE MET 601 2HE MET 601 9.006 -28.927 -19.109 721 H THR 602 H THR 602 1.207 -30.891 -17.828 722 HA THR 602 HA THR 602 1.361 -32.816 -19.808 723 HB THR 602 HB THR 602 -0.422 -32.723 -18.112 724 HG1 THR 602 1HG THR 602 -0.810 -33.538 -20.375 725 1HG2 THR 602 3HG2 THR 602 -0.671 -30.203 -18.014 726 2HG2 THR 602 1HG2 THR 602 -1.411 -30.253 -19.632 727 3HG2 THR 602 2HG2 THR 602 -2.223 -31.039 -18.257 728 H GLU 603 H GLU 603 0.581 -29.320 -20.061 729 HA GLU 603 HA GLU 603 1.179 -29.534 -22.859 730 1HB GLU 603 1HB GLU 603 -1.570 -29.206 -21.834 731 2HB GLU 603 2HB GLU 603 -1.109 -27.934 -22.948 732 1HG GLU 603 1HG GLU 603 -0.382 -30.738 -23.743 733 2HG GLU 603 2HG GLU 603 -2.087 -30.335 -23.770 734 HE2 GLU 603 HE GLU 603 0.768 -28.346 -25.440 735 H GLN 604 H GLN 604 2.715 -27.972 -23.108 736 HA GLN 604 HA GLN 604 2.695 -25.747 -21.310 737 1HB GLN 604 1HB GLN 604 4.868 -25.195 -22.333 738 2HB GLN 604 2HB GLN 604 4.815 -26.886 -21.876 739 1HG GLN 604 1HG GLN 604 4.635 -27.632 -24.111 740 2HG GLN 604 2HG GLN 604 3.975 -26.110 -24.677 741 1HE2 GLN 604 1HE2 GLN 604 5.540 -26.184 -26.345 742 2HE2 GLN 604 2HE2 GLN 604 7.176 -25.681 -26.080 743 H GLN 605 H GLN 605 0.834 -26.383 -23.889 744 HA GLN 605 HA GLN 605 1.119 -24.627 -25.830 745 1HB GLN 605 1HB GLN 605 -1.297 -24.607 -26.083 746 2HB GLN 605 2HB GLN 605 -0.818 -26.190 -25.503 747 1HG GLN 605 1HG GLN 605 -1.352 -25.438 -23.143 748 2HG GLN 605 2HG GLN 605 -1.931 -23.917 -23.792 749 1HE2 GLN 605 1HE2 GLN 605 -3.657 -25.270 -22.351 750 2HE2 GLN 605 2HE2 GLN 605 -4.887 -26.039 -23.299 751 H TRP 606 H TRP 606 0.426 -23.850 -22.441 752 HA TRP 606 HA TRP 606 1.098 -21.127 -22.878 753 1HB TRP 606 1HB TRP 606 -1.631 -21.776 -23.243 754 2HB TRP 606 2HB TRP 606 -1.511 -20.980 -21.687 755 HD1 TRP 606 HD TRP 606 -1.501 -20.205 -25.372 756 HE1 TRP 606 1HE TRP 606 -1.148 -17.637 -25.866 757 HE3 TRP 606 3HE TRP 606 -0.131 -18.946 -20.640 758 HZ2 TRP 606 2HZ TRP 606 -0.354 -15.417 -24.258 759 HZ3 TRP 606 3HZ TRP 606 0.417 -16.556 -20.186 760 HH2 TRP 606 HH TRP 606 0.323 -14.819 -21.903 761 H ASN 607 H ASN 607 2.691 -21.819 -21.307 762 HA ASN 607 HA ASN 607 2.342 -23.192 -19.071 763 1HB ASN 607 1HB ASN 607 3.974 -20.656 -19.548 764 2HB ASN 607 2HB ASN 607 4.092 -21.535 -18.037 765 1HD2 ASN 607 1HD2 ASN 607 5.082 -23.500 -17.936 766 2HD2 ASN 607 2HD2 ASN 607 6.004 -24.196 -19.226 767 H PHE 608 H PHE 608 0.395 -22.947 -17.870 768 HA PHE 608 HA PHE 608 -0.934 -20.593 -17.402 769 1HB PHE 608 1HB PHE 608 -2.064 -21.941 -15.678 770 2HB PHE 608 2HB PHE 608 -1.637 -23.030 -16.984 771 HD1 PHE 608 1HD PHE 608 -0.517 -21.848 -13.648 772 HD2 PHE 608 2HD PHE 608 -0.294 -24.909 -16.579 773 HE1 PHE 608 1HE PHE 608 0.715 -23.314 -12.024 774 HE2 PHE 608 2HE PHE 608 0.938 -26.374 -14.955 775 HZ PHE 608 HZ PHE 608 1.427 -25.559 -12.697 776 H ALA 609 H ALA 609 2.075 -21.736 -16.035 777 HA ALA 609 HA ALA 609 1.938 -20.426 -13.553 778 1HB ALA 609 1HB ALA 609 4.307 -21.212 -15.298 779 2HB ALA 609 3HB ALA 609 3.528 -22.226 -14.060 780 3HB ALA 609 2HB ALA 609 4.401 -20.750 -13.582 781 H GLY 610 H GLY 610 1.983 -19.220 -16.752 782 1HA GLY 610 2HA GLY 610 2.961 -17.263 -17.607 783 2HA GLY 610 1HA GLY 610 3.357 -16.738 -15.983 784 H ILE 611 H ILE 611 0.416 -17.673 -17.916 785 HA ILE 611 HA ILE 611 -0.801 -15.199 -17.710 786 HB ILE 611 HB ILE 611 -1.454 -16.760 -19.372 787 1HG1 ILE 611 1HG1 ILE 611 -3.582 -16.040 -17.368 788 2HG1 ILE 611 2HG1 ILE 611 -3.229 -15.305 -18.919 789 1HG2 ILE 611 1HG2 ILE 611 -1.211 -18.688 -17.381 790 2HG2 ILE 611 2HG2 ILE 611 -2.948 -18.672 -17.770 791 3HG2 ILE 611 3HG2 ILE 611 -1.749 -18.942 -19.058 792 1HD1 ILE 611 1HD1 ILE 611 -3.787 -18.038 -19.486 793 2HD1 ILE 611 2HD1 ILE 611 -5.020 -17.510 -18.316 794 3HD1 ILE 611 3HD1 ILE 611 -4.811 -16.628 -19.848 795 H GLU 612 H GLU 612 -0.497 -17.831 -15.388 796 HA GLU 612 HA GLU 612 -2.700 -17.307 -13.833 797 1HB GLU 612 1HB GLU 612 -1.486 -19.301 -13.392 798 2HB GLU 612 2HB GLU 612 0.043 -18.456 -13.249 799 1HG GLU 612 1HG GLU 612 -0.734 -17.369 -11.147 800 2HG GLU 612 2HG GLU 612 -2.291 -18.158 -11.299 801 HE2 GLU 612 HE GLU 612 -2.034 -20.391 -9.840 802 H ALA 613 H ALA 613 0.440 -15.644 -14.098 803 HA ALA 613 HA ALA 613 -0.051 -14.065 -11.732 804 1HB ALA 613 3HB ALA 613 2.224 -14.806 -12.336 805 2HB ALA 613 2HB ALA 613 2.108 -13.030 -12.342 806 3HB ALA 613 1HB ALA 613 2.105 -13.927 -13.879 807 H ALA 614 H ALA 614 -0.692 -13.982 -15.188 808 HA ALA 614 HA ALA 614 -0.785 -11.269 -15.655 809 1HB ALA 614 3HB ALA 614 -2.746 -13.311 -16.754 810 2HB ALA 614 1HB ALA 614 -2.126 -11.844 -17.548 811 3HB ALA 614 2HB ALA 614 -1.045 -13.231 -17.272 812 H ALA 615 H ALA 615 -3.387 -13.475 -14.412 813 HA ALA 615 HA ALA 615 -5.339 -11.520 -14.155 814 1HB ALA 615 1HB ALA 615 -6.553 -13.228 -13.252 815 2HB ALA 615 2HB ALA 615 -5.189 -14.219 -13.825 816 3HB ALA 615 3HB ALA 615 -5.256 -13.693 -12.125 817 H SER 616 H SER 616 -2.885 -12.735 -11.777 818 HA SER 616 HA SER 616 -3.683 -11.230 -9.657 819 1HB SER 616 1HB SER 616 -1.516 -12.904 -10.299 820 2HB SER 616 2HB SER 616 -0.754 -11.384 -9.877 821 HG SER 616 HG SER 616 -2.640 -11.740 -8.023 822 H ALA 617 H ALA 617 -1.942 -10.290 -12.602 823 HA ALA 617 HA ALA 617 -0.982 -7.815 -11.566 824 1HB ALA 617 2HB ALA 617 -0.584 -9.436 -13.842 825 2HB ALA 617 1HB ALA 617 0.209 -7.885 -13.472 826 3HB ALA 617 3HB ALA 617 -1.273 -7.914 -14.457 827 H ILE 618 H ILE 618 -3.861 -8.951 -13.400 828 HA ILE 618 HA ILE 618 -4.868 -6.428 -14.022 829 HB ILE 618 HB ILE 618 -6.291 -9.052 -13.561 830 1HG1 ILE 618 1HG1 ILE 618 -4.448 -9.046 -15.274 831 2HG1 ILE 618 2HG1 ILE 618 -6.035 -9.480 -15.878 832 1HG2 ILE 618 1HG2 ILE 618 -7.225 -6.513 -14.925 833 2HG2 ILE 618 2HG2 ILE 618 -8.058 -8.084 -15.006 834 3HG2 ILE 618 3HG2 ILE 618 -7.886 -7.247 -13.445 835 1HD1 ILE 618 3HD1 ILE 618 -5.412 -6.565 -15.982 836 2HD1 ILE 618 1HD1 ILE 618 -4.428 -7.598 -17.046 837 3HD1 ILE 618 2HD1 ILE 618 -6.202 -7.604 -17.192 838 H GLN 619 H GLN 619 -5.273 -8.545 -11.130 839 HA GLN 619 HA GLN 619 -7.212 -7.077 -9.887 840 1HB GLN 619 1HB GLN 619 -5.272 -9.141 -9.167 841 2HB GLN 619 2HB GLN 619 -5.497 -8.022 -7.838 842 1HG GLN 619 1HG GLN 619 -7.834 -9.284 -9.339 843 2HG GLN 619 2HG GLN 619 -7.116 -10.019 -7.920 844 1HE2 GLN 619 1HE2 GLN 619 -9.711 -8.490 -8.761 845 2HE2 GLN 619 2HE2 GLN 619 -10.038 -7.456 -7.411 846 H GLY 620 H GLY 620 -3.610 -6.855 -9.393 847 1HA GLY 620 2HA GLY 620 -2.309 -5.159 -8.704 848 2HA GLY 620 1HA GLY 620 -3.638 -4.668 -7.672 849 H ASN 621 H ASN 621 -3.586 -4.857 -11.283 850 HA ASN 621 HA ASN 621 -3.136 -2.134 -11.641 851 1HB ASN 621 1HB ASN 621 -4.279 -4.359 -13.376 852 2HB ASN 621 2HB ASN 621 -4.271 -2.711 -13.972 853 1HD2 ASN 621 1HD2 ASN 621 -2.134 -1.531 -13.641 854 2HD2 ASN 621 2HD2 ASN 621 -0.689 -2.387 -14.063 855 H VAL 622 H VAL 622 -6.043 -4.201 -11.229 856 HA VAL 622 HA VAL 622 -7.966 -2.364 -12.070 857 HB VAL 622 HB VAL 622 -7.969 -4.721 -10.197 858 1HG1 VAL 622 2HG1 VAL 622 -10.215 -2.816 -10.833 859 2HG1 VAL 622 3HG1 VAL 622 -10.548 -4.535 -10.510 860 3HG1 VAL 622 1HG1 VAL 622 -9.748 -3.535 -9.273 861 1HG2 VAL 622 3HG2 VAL 622 -7.826 -4.645 -12.900 862 2HG2 VAL 622 1HG2 VAL 622 -8.601 -5.961 -11.987 863 3HG2 VAL 622 2HG2 VAL 622 -9.592 -4.656 -12.681 864 H THR 623 H THR 623 -6.699 -3.117 -8.748 865 HA THR 623 HA THR 623 -8.191 -1.112 -7.473 866 HB THR 623 HB THR 623 -6.599 -1.594 -5.607 867 HG1 THR 623 1HG THR 623 -4.586 -2.184 -6.304 868 1HG2 THR 623 2HG2 THR 623 -8.239 -3.511 -6.828 869 2HG2 THR 623 3HG2 THR 623 -6.652 -4.315 -6.777 870 3HG2 THR 623 1HG2 THR 623 -7.398 -3.723 -5.273 871 H SER 624 H SER 624 -5.008 -1.076 -9.109 872 HA SER 624 HA SER 624 -4.066 1.277 -8.151 873 1HB SER 624 1HB SER 624 -3.358 -0.518 -10.154 874 2HB SER 624 2HB SER 624 -3.676 0.943 -11.068 875 HG SER 624 HG SER 624 -1.448 0.376 -9.777 876 H ILE 625 H ILE 625 -6.315 0.709 -10.938 877 HA ILE 625 HA ILE 625 -6.561 3.476 -11.523 878 HB ILE 625 HB ILE 625 -7.808 0.930 -12.430 879 1HG1 ILE 625 1HG1 ILE 625 -7.237 2.474 -14.621 880 2HG1 ILE 625 2HG1 ILE 625 -6.033 3.042 -13.482 881 1HG2 ILE 625 3HG2 ILE 625 -9.061 3.656 -12.730 882 2HG2 ILE 625 1HG2 ILE 625 -9.312 2.367 -13.932 883 3HG2 ILE 625 2HG2 ILE 625 -9.814 2.119 -12.243 884 1HD1 ILE 625 3HD1 ILE 625 -6.533 0.079 -13.992 885 2HD1 ILE 625 1HD1 ILE 625 -5.338 1.033 -14.901 886 3HD1 ILE 625 2HD1 ILE 625 -5.153 0.817 -13.144 887 H HIS 626 H HIS 626 -8.128 1.187 -9.319 888 HA HIS 626 HA HIS 626 -10.485 2.603 -8.909 889 1HB HIS 626 1HB HIS 626 -9.842 0.224 -8.208 890 2HB HIS 626 2HB HIS 626 -9.050 0.952 -6.824 891 HD1 HIS 626 1HD HIS 626 -10.922 -0.541 -5.500 892 HD2 HIS 626 2HD HIS 626 -12.315 2.804 -7.614 893 HE1 HIS 626 1HE HIS 626 -13.251 -0.038 -4.588 894 H SER 627 H SER 627 -7.262 2.766 -7.274 895 HA SER 627 HA SER 627 -8.187 4.853 -5.573 896 1HB SER 627 1HB SER 627 -5.575 3.404 -6.010 897 2HB SER 627 2HB SER 627 -5.551 4.928 -5.145 898 HG SER 627 HG SER 627 -6.622 2.424 -4.374 899 H LEU 628 H LEU 628 -5.936 4.511 -8.395 900 HA LEU 628 HA LEU 628 -4.937 7.003 -8.590 901 1HB LEU 628 1HB LEU 628 -5.679 4.884 -10.520 902 2HB LEU 628 2HB LEU 628 -5.402 6.477 -11.195 903 HG LEU 628 HG LEU 628 -3.355 5.379 -9.310 904 1HD1 LEU 628 2HD1 LEU 628 -4.193 3.998 -11.708 905 2HD1 LEU 628 3HD1 LEU 628 -2.513 4.569 -11.859 906 3HD1 LEU 628 1HD1 LEU 628 -2.982 3.535 -10.488 907 1HD2 LEU 628 3HD2 LEU 628 -3.276 7.693 -10.308 908 2HD2 LEU 628 1HD2 LEU 628 -1.833 6.687 -10.579 909 3HD2 LEU 628 2HD2 LEU 628 -3.015 6.920 -11.890 910 H LEU 629 H LEU 629 -8.128 5.931 -9.959 911 HA LEU 629 HA LEU 629 -8.903 8.375 -10.945 912 1HB LEU 629 1HB LEU 629 -10.078 5.811 -10.376 913 2HB LEU 629 2HB LEU 629 -11.201 7.083 -9.938 914 HG LEU 629 HG LEU 629 -11.482 6.218 -12.253 915 1HD1 LEU 629 1HD1 LEU 629 -11.045 9.079 -11.575 916 2HD1 LEU 629 2HD1 LEU 629 -11.219 8.670 -13.298 917 3HD1 LEU 629 3HD1 LEU 629 -12.505 8.237 -12.147 918 1HD2 LEU 629 3HD2 LEU 629 -8.911 5.996 -12.543 919 2HD2 LEU 629 1HD2 LEU 629 -9.912 6.460 -13.940 920 3HD2 LEU 629 2HD2 LEU 629 -8.991 7.699 -13.053 921 H ASP 630 H ASP 630 -9.283 7.015 -7.619 922 HA ASP 630 HA ASP 630 -10.750 9.162 -6.659 923 1HB ASP 630 1HB ASP 630 -9.160 6.900 -5.513 924 2HB ASP 630 2HB ASP 630 -9.412 8.258 -4.434 925 HD2 ASP 630 HD ASP 630 -10.736 5.428 -5.353 926 H GLU 631 H GLU 631 -7.314 8.615 -7.305 927 HA GLU 631 HA GLU 631 -6.380 10.633 -5.559 928 1HB GLU 631 1HB GLU 631 -5.256 8.634 -7.352 929 2HB GLU 631 2HB GLU 631 -4.456 10.172 -7.607 930 1HG GLU 631 1HG GLU 631 -4.736 8.652 -4.979 931 2HG GLU 631 2HG GLU 631 -3.255 9.001 -5.849 932 HE2 GLU 631 HE GLU 631 -5.141 9.987 -3.442 933 H GLY 632 H GLY 632 -7.029 10.375 -9.109 934 1HA GLY 632 2HA GLY 632 -7.093 11.949 -10.727 935 2HA GLY 632 1HA GLY 632 -6.188 13.036 -9.693 936 H LYS 633 H LYS 633 -9.305 11.442 -8.847 937 HA LYS 633 HA LYS 633 -10.995 13.509 -9.588 938 1HB LYS 633 1HB LYS 633 -11.527 11.101 -8.878 939 2HB LYS 633 2HB LYS 633 -11.443 11.679 -7.226 940 1HG LYS 633 1HG LYS 633 -13.755 11.845 -7.861 941 2HG LYS 633 2HG LYS 633 -13.140 13.486 -7.864 942 1HD LYS 633 1HD LYS 633 -12.592 12.805 -10.453 943 2HD LYS 633 2HD LYS 633 -13.974 11.764 -10.172 944 1HE LYS 633 1HE LYS 633 -14.920 14.094 -9.077 945 2HE LYS 633 2HE LYS 633 -13.839 14.754 -10.288 946 H GLN 634 H GLN 634 -8.861 13.092 -6.772 947 HA GLN 634 HA GLN 634 -10.074 15.144 -5.278 948 1HB GLN 634 1HB GLN 634 -7.406 13.703 -5.111 949 2HB GLN 634 2HB GLN 634 -7.799 15.012 -4.015 950 1HG GLN 634 1HG GLN 634 -9.930 12.941 -4.314 951 2HG GLN 634 2HG GLN 634 -8.448 12.374 -3.570 952 1HE2 GLN 634 1HE2 GLN 634 -7.651 13.404 -1.689 953 2HE2 GLN 634 2HE2 GLN 634 -8.698 14.258 -0.605 954 H SER 635 H SER 635 -7.942 15.071 -8.019 955 HA SER 635 HA SER 635 -6.907 17.698 -7.417 956 1HB SER 635 1HB SER 635 -5.914 15.451 -8.821 957 2HB SER 635 2HB SER 635 -6.231 16.645 -10.065 958 HG SER 635 HG SER 635 -4.060 16.590 -8.731 959 H LEU 636 H LEU 636 -9.363 16.034 -9.324 960 HA LEU 636 HA LEU 636 -9.749 17.812 -11.389 961 1HB LEU 636 1HB LEU 636 -11.224 15.683 -10.055 962 2HB LEU 636 2HB LEU 636 -12.283 16.930 -10.682 963 HG LEU 636 HG LEU 636 -11.838 14.978 -12.213 964 1HD1 LEU 636 2HD1 LEU 636 -11.878 17.811 -12.809 965 2HD1 LEU 636 3HD1 LEU 636 -10.999 16.903 -14.063 966 3HD1 LEU 636 1HD1 LEU 636 -12.670 16.454 -13.648 967 1HD2 LEU 636 2HD2 LEU 636 -9.369 14.885 -11.615 968 2HD2 LEU 636 3HD2 LEU 636 -9.782 14.719 -13.338 969 3HD2 LEU 636 1HD2 LEU 636 -9.152 16.264 -12.718 970 H THR 637 H THR 637 -10.708 17.999 -7.948 971 HA THR 637 HA THR 637 -12.365 20.298 -8.344 972 HB THR 637 HB THR 637 -13.025 19.208 -6.412 973 HG1 THR 637 1HG THR 637 -10.592 20.460 -5.378 974 1HG2 THR 637 2HG2 THR 637 -10.107 18.341 -6.225 975 2HG2 THR 637 3HG2 THR 637 -11.213 18.159 -4.841 976 3HG2 THR 637 1HG2 THR 637 -11.553 17.313 -6.369 977 H LYS 638 H LYS 638 -9.213 19.894 -6.585 978 HA LYS 638 HA LYS 638 -8.734 22.606 -6.362 979 1HB LYS 638 1HB LYS 638 -6.339 21.876 -6.042 980 2HB LYS 638 2HB LYS 638 -7.517 21.111 -4.995 981 1HG LYS 638 1HG LYS 638 -7.599 19.276 -6.937 982 2HG LYS 638 2HG LYS 638 -6.030 19.937 -7.353 983 1HD LYS 638 1HD LYS 638 -5.740 19.669 -4.630 984 2HD LYS 638 2HD LYS 638 -6.848 18.351 -4.955 985 1HE LYS 638 1HE LYS 638 -5.325 17.255 -6.420 986 2HE LYS 638 2HE LYS 638 -4.393 18.712 -6.702 987 H LEU 639 H LEU 639 -8.721 20.562 -9.161 988 HA LEU 639 HA LEU 639 -7.043 22.467 -10.612 989 1HB LEU 639 1HB LEU 639 -8.027 19.697 -11.301 990 2HB LEU 639 2HB LEU 639 -7.136 20.727 -12.404 991 HG LEU 639 HG LEU 639 -6.068 19.826 -9.717 992 1HD1 LEU 639 2HD1 LEU 639 -6.582 17.994 -11.473 993 2HD1 LEU 639 3HD1 LEU 639 -5.188 18.669 -12.351 994 3HD1 LEU 639 1HD1 LEU 639 -4.978 18.029 -10.703 995 1HD2 LEU 639 1HD2 LEU 639 -4.788 21.206 -12.087 996 2HD2 LEU 639 2HD2 LEU 639 -4.974 21.822 -10.428 997 3HD2 LEU 639 3HD2 LEU 639 -3.872 20.463 -10.754 998 H ALA 640 H ALA 640 -10.338 21.535 -9.980 999 HA ALA 640 HA ALA 640 -11.640 22.072 -12.302 1000 1HB ALA 640 2HB ALA 640 -12.707 21.288 -10.232 1001 2HB ALA 640 1HB ALA 640 -13.532 22.743 -10.842 1002 3HB ALA 640 3HB ALA 640 -12.411 22.867 -9.465 1003 H ALA 641 H ALA 641 -10.241 24.393 -9.932 1004 HA ALA 641 HA ALA 641 -11.322 26.718 -10.942 1005 1HB ALA 641 3HB ALA 641 -9.814 27.754 -9.544 1006 2HB ALA 641 1HB ALA 641 -9.705 26.101 -8.894 1007 3HB ALA 641 2HB ALA 641 -8.469 26.695 -10.029 1008 H ALA 642 H ALA 642 -8.750 24.610 -12.198 1009 HA ALA 642 HA ALA 642 -7.575 26.453 -13.945 1010 1HB ALA 642 2HB ALA 642 -7.027 23.932 -13.134 1011 2HB ALA 642 1HB ALA 642 -6.332 24.646 -14.609 1012 3HB ALA 642 3HB ALA 642 -7.750 23.575 -14.721 1013 H TRP 643 H TRP 643 -10.686 24.884 -13.928 1014 HA TRP 643 HA TRP 643 -11.013 25.251 -16.799 1015 1HB TRP 643 1HB TRP 643 -12.577 23.856 -14.649 1016 2HB TRP 643 2HB TRP 643 -13.341 24.282 -16.167 1017 HD1 TRP 643 HD TRP 643 -12.714 22.777 -18.296 1018 HE1 TRP 643 1HE TRP 643 -11.352 20.557 -18.721 1019 HE3 TRP 643 3HE TRP 643 -10.464 22.664 -13.738 1020 HZ2 TRP 643 2HZ TRP 643 -9.528 19.037 -17.138 1021 HZ3 TRP 643 3HZ TRP 643 -8.906 20.778 -13.258 1022 HH2 TRP 643 HH TRP 643 -8.425 19.005 -14.870 1023 H GLY 644 H GLY 644 -10.834 27.280 -14.288 1024 1HA GLY 644 2HA GLY 644 -12.768 29.124 -15.429 1025 2HA GLY 644 1HA GLY 644 -11.522 29.470 -14.246 1026 H GLY 645 H GLY 645 -11.943 27.789 -12.141 1027 1HA GLY 645 2HA GLY 645 -14.629 28.590 -11.236 1028 2HA GLY 645 1HA GLY 645 -13.236 28.272 -10.222 1029 H SER 646 H SER 646 -14.798 26.832 -9.032 1030 HA SER 646 HA SER 646 -14.735 24.210 -10.283 1031 1HB SER 646 1HB SER 646 -15.335 23.592 -7.750 1032 2HB SER 646 2HB SER 646 -13.683 23.897 -8.250 1033 HG SER 646 HG SER 646 -14.846 25.109 -6.288 1034 H GLY 647 H GLY 647 -16.801 26.834 -9.705 1035 1HA GLY 647 2HA GLY 647 -19.080 26.828 -9.018 1036 2HA GLY 647 1HA GLY 647 -19.186 25.123 -9.407 1037 H SER 648 H SER 648 -17.342 25.997 -11.901 1038 HA SER 648 HA SER 648 -19.436 27.273 -13.433 1039 1HB SER 648 1HB SER 648 -16.494 27.106 -13.573 1040 2HB SER 648 2HB SER 648 -17.250 26.856 -15.134 1041 HG SER 648 HG SER 648 -18.399 28.973 -13.723 1042 H GLU 649 H GLU 649 -20.344 26.308 -15.342 1043 HA GLU 649 HA GLU 649 -20.760 23.605 -15.198 1044 1HB GLU 649 1HB GLU 649 -21.826 23.834 -17.402 1045 2HB GLU 649 2HB GLU 649 -22.238 25.202 -16.388 1046 1HG GLU 649 1HG GLU 649 -20.571 26.615 -17.503 1047 2HG GLU 649 2HG GLU 649 -19.945 25.247 -18.403 1048 HE2 GLU 649 HE GLU 649 -21.165 27.511 -19.817 1049 H ALA 650 H ALA 650 -18.195 25.475 -16.795 1050 HA ALA 650 HA ALA 650 -17.286 23.697 -18.662 1051 1HB ALA 650 2HB ALA 650 -16.235 25.949 -17.085 1052 2HB ALA 650 1HB ALA 650 -16.004 25.554 -18.805 1053 3HB ALA 650 3HB ALA 650 -14.979 24.786 -17.569 1054 H TYR 651 H TYR 651 -15.819 24.020 -15.349 1055 HA TYR 651 HA TYR 651 -14.394 21.683 -15.414 1056 1HB TYR 651 1HB TYR 651 -14.034 23.206 -13.597 1057 2HB TYR 651 2HB TYR 651 -15.750 23.469 -13.361 1058 HD1 TYR 651 1HD TYR 651 -16.567 22.721 -11.333 1059 HD2 TYR 651 2HD TYR 651 -13.410 20.526 -13.208 1060 HE1 TYR 651 1HE TYR 651 -16.546 21.080 -9.391 1061 HE2 TYR 651 2HE TYR 651 -13.400 18.892 -11.261 1062 HH TYR 651 HH TYR 651 -14.204 19.259 -8.600 1063 H GLN 652 H GLN 652 -17.854 22.206 -14.598 1064 HA GLN 652 HA GLN 652 -18.329 19.761 -13.448 1065 1HB GLN 652 1HB GLN 652 -20.085 21.661 -15.039 1066 2HB GLN 652 2HB GLN 652 -20.734 20.181 -14.361 1067 1HG GLN 652 1HG GLN 652 -19.149 21.546 -12.337 1068 2HG GLN 652 2HG GLN 652 -20.300 22.674 -13.025 1069 1HE2 GLN 652 1HE2 GLN 652 -21.498 22.759 -11.148 1070 2HE2 GLN 652 2HE2 GLN 652 -22.544 21.482 -10.623 1071 H GLY 653 H GLY 653 -18.694 20.772 -16.921 1072 1HA GLY 653 2HA GLY 653 -18.649 19.577 -18.823 1073 2HA GLY 653 1HA GLY 653 -19.555 18.354 -17.957 1074 H VAL 654 H VAL 654 -16.358 19.335 -16.773 1075 HA VAL 654 HA VAL 654 -14.991 17.245 -18.187 1076 HB VAL 654 HB VAL 654 -14.236 19.269 -16.087 1077 1HG1 VAL 654 2HG1 VAL 654 -12.997 17.118 -15.720 1078 2HG1 VAL 654 3HG1 VAL 654 -12.345 17.272 -17.369 1079 3HG1 VAL 654 1HG1 VAL 654 -11.958 18.500 -16.141 1080 1HG2 VAL 654 2HG2 VAL 654 -14.474 19.443 -18.846 1081 2HG2 VAL 654 3HG2 VAL 654 -13.555 20.549 -17.796 1082 3HG2 VAL 654 1HG2 VAL 654 -12.730 19.189 -18.595 1083 H GLN 655 H GLN 655 -16.111 17.905 -14.812 1084 HA GLN 655 HA GLN 655 -15.036 15.746 -13.593 1085 1HB GLN 655 1HB GLN 655 -17.314 17.556 -13.130 1086 2HB GLN 655 2HB GLN 655 -17.574 15.974 -12.424 1087 1HG GLN 655 1HG GLN 655 -14.848 16.706 -11.872 1088 2HG GLN 655 2HG GLN 655 -15.840 18.100 -11.495 1089 1HE2 GLN 655 1HE2 GLN 655 -14.480 16.741 -9.552 1090 2HE2 GLN 655 2HE2 GLN 655 -15.573 15.920 -8.489 1091 H GLN 656 H GLN 656 -18.113 15.939 -15.483 1092 HA GLN 656 HA GLN 656 -18.881 13.318 -14.951 1093 1HB GLN 656 1HB GLN 656 -19.651 15.465 -16.887 1094 2HB GLN 656 2HB GLN 656 -20.097 13.832 -17.337 1095 1HG GLN 656 1HG GLN 656 -21.929 14.177 -16.015 1096 2HG GLN 656 2HG GLN 656 -20.842 13.845 -14.681 1097 1HE2 GLN 656 1HE2 GLN 656 -21.197 16.607 -16.902 1098 2HE2 GLN 656 2HE2 GLN 656 -21.428 17.830 -15.698 1099 H LYS 657 H LYS 657 -16.835 14.818 -17.492 1100 HA LYS 657 HA LYS 657 -16.663 12.502 -19.093 1101 1HB LYS 657 1HB LYS 657 -15.046 15.046 -18.889 1102 2HB LYS 657 2HB LYS 657 -14.612 13.762 -19.999 1103 1HG LYS 657 1HG LYS 657 -16.998 13.859 -20.913 1104 2HG LYS 657 2HG LYS 657 -17.261 15.276 -19.917 1105 1HD LYS 657 1HD LYS 657 -15.049 15.040 -22.011 1106 2HD LYS 657 2HD LYS 657 -16.596 15.813 -22.297 1107 1HE LYS 657 1HE LYS 657 -16.096 17.369 -20.335 1108 2HE LYS 657 2HE LYS 657 -14.493 16.666 -20.252 1109 H TRP 658 H TRP 658 -14.995 13.662 -16.179 1110 HA TRP 658 HA TRP 658 -12.822 11.834 -16.419 1111 1HB TRP 658 1HB TRP 658 -12.418 13.808 -15.209 1112 2HB TRP 658 2HB TRP 658 -13.861 13.620 -14.232 1113 HD1 TRP 658 HD TRP 658 -13.699 11.846 -12.152 1114 HE1 TRP 658 1HE TRP 658 -11.704 10.777 -10.795 1115 HE3 TRP 658 3HE TRP 658 -10.089 12.979 -15.549 1116 HZ2 TRP 658 2HZ TRP 658 -8.903 10.530 -11.284 1117 HZ3 TRP 658 3HZ TRP 658 -7.750 12.289 -15.033 1118 HH2 TRP 658 HH TRP 658 -7.132 11.104 -12.986 1119 H ASP 659 H ASP 659 -15.810 12.047 -14.349 1120 HA ASP 659 HA ASP 659 -15.431 9.555 -13.197 1121 1HB ASP 659 1HB ASP 659 -17.031 11.540 -12.570 1122 2HB ASP 659 2HB ASP 659 -18.154 10.812 -13.702 1123 HD2 ASP 659 HD ASP 659 -19.653 9.560 -11.453 1124 H ALA 660 H ALA 660 -16.821 10.683 -16.266 1125 HA ALA 660 HA ALA 660 -18.486 8.569 -16.900 1126 1HB ALA 660 1HB ALA 660 -18.624 10.435 -18.297 1127 2HB ALA 660 2HB ALA 660 -16.857 10.574 -18.458 1128 3HB ALA 660 3HB ALA 660 -17.730 9.283 -19.317 1129 H THR 661 H THR 661 -15.442 8.941 -18.759 1130 HA THR 661 HA THR 661 -15.154 6.265 -19.310 1131 HB THR 661 HB THR 661 -12.889 6.933 -20.013 1132 HG1 THR 661 1HG THR 661 -13.558 9.263 -18.354 1133 1HG2 THR 661 3HG2 THR 661 -15.068 8.155 -21.036 1134 2HG2 THR 661 1HG2 THR 661 -14.336 9.573 -20.248 1135 3HG2 THR 661 2HG2 THR 661 -13.426 8.676 -21.487 1136 H ALA 662 H ALA 662 -14.434 7.991 -16.327 1137 HA ALA 662 HA ALA 662 -12.536 6.308 -15.241 1138 1HB ALA 662 3HB ALA 662 -12.954 8.279 -14.061 1139 2HB ALA 662 2HB ALA 662 -13.763 7.066 -13.041 1140 3HB ALA 662 1HB ALA 662 -14.720 8.079 -14.148 1141 H THR 663 H THR 663 -15.883 6.234 -13.924 1142 HA THR 663 HA THR 663 -15.802 3.681 -12.992 1143 HB THR 663 HB THR 663 -17.619 5.096 -12.353 1144 HG1 THR 663 1HG THR 663 -19.447 3.792 -13.235 1145 1HG2 THR 663 3HG2 THR 663 -17.562 5.905 -15.145 1146 2HG2 THR 663 1HG2 THR 663 -19.198 5.333 -14.740 1147 3HG2 THR 663 2HG2 THR 663 -18.457 6.651 -13.800 1148 H GLU 664 H GLU 664 -16.076 4.725 -16.346 1149 HA GLU 664 HA GLU 664 -17.195 2.371 -17.322 1150 1HB GLU 664 1HB GLU 664 -17.143 4.468 -18.614 1151 2HB GLU 664 2HB GLU 664 -15.392 4.429 -18.669 1152 1HG GLU 664 1HG GLU 664 -16.284 3.576 -20.789 1153 2HG GLU 664 2HG GLU 664 -15.478 2.273 -19.938 1154 HE2 GLU 664 HE GLU 664 -18.552 3.603 -20.637 1155 H LEU 665 H LEU 665 -13.763 3.484 -16.975 1156 HA LEU 665 HA LEU 665 -12.773 0.975 -17.955 1157 1HB LEU 665 1HB LEU 665 -11.721 3.240 -18.300 1158 2HB LEU 665 2HB LEU 665 -11.264 3.214 -16.608 1159 HG LEU 665 HG LEU 665 -9.379 2.558 -17.937 1160 1HD1 LEU 665 3HD1 LEU 665 -10.191 1.218 -15.765 1161 2HD1 LEU 665 1HD1 LEU 665 -10.159 -0.128 -16.930 1162 3HD1 LEU 665 2HD1 LEU 665 -8.689 0.833 -16.639 1163 1HD2 LEU 665 2HD2 LEU 665 -10.564 1.841 -19.951 1164 2HD2 LEU 665 3HD2 LEU 665 -9.387 0.615 -19.423 1165 3HD2 LEU 665 1HD2 LEU 665 -11.123 0.374 -19.111 1166 H ASN 666 H ASN 666 -13.697 2.414 -14.875 1167 HA ASN 666 HA ASN 666 -12.130 0.756 -13.268 1168 1HB ASN 666 1HB ASN 666 -13.891 2.905 -12.880 1169 2HB ASN 666 2HB ASN 666 -14.756 1.572 -12.140 1170 1HD2 ASN 666 1HD2 ASN 666 -12.498 3.946 -11.684 1171 2HD2 ASN 666 2HD2 ASN 666 -11.697 3.370 -10.260 1172 H ASN 667 H ASN 667 -15.592 0.682 -14.383 1173 HA ASN 667 HA ASN 667 -16.239 -1.668 -13.058 1174 1HB ASN 667 1HB ASN 667 -18.297 -1.528 -14.225 1175 2HB ASN 667 2HB ASN 667 -17.756 0.139 -14.246 1176 1HD2 ASN 667 1HD2 ASN 667 -17.889 1.122 -16.101 1177 2HD2 ASN 667 2HD2 ASN 667 -17.797 0.417 -17.680 1178 H ALA 668 H ALA 668 -14.968 -0.892 -16.347 1179 HA ALA 668 HA ALA 668 -15.232 -3.450 -17.448 1180 1HB ALA 668 1HB ALA 668 -14.735 -1.135 -18.532 1181 2HB ALA 668 3HB ALA 668 -13.955 -2.579 -19.223 1182 3HB ALA 668 2HB ALA 668 -13.033 -1.495 -18.153 1183 H LEU 669 H LEU 669 -12.768 -1.920 -15.353 1184 HA LEU 669 HA LEU 669 -10.853 -3.977 -15.703 1185 1HB LEU 669 1HB LEU 669 -11.162 -1.505 -14.194 1186 2HB LEU 669 2HB LEU 669 -10.362 -2.753 -13.259 1187 HG LEU 669 HG LEU 669 -9.458 -2.030 -16.049 1188 1HD1 LEU 669 2HD1 LEU 669 -9.528 -0.044 -14.421 1189 2HD1 LEU 669 3HD1 LEU 669 -8.212 -0.876 -13.559 1190 3HD1 LEU 669 1HD1 LEU 669 -7.995 -0.389 -15.258 1191 1HD2 LEU 669 2HD2 LEU 669 -8.779 -4.161 -14.542 1192 2HD2 LEU 669 3HD2 LEU 669 -7.680 -3.377 -15.702 1193 3HD2 LEU 669 1HD2 LEU 669 -7.574 -2.982 -13.969 1194 H GLN 670 H GLN 670 -13.553 -3.355 -13.417 1195 HA GLN 670 HA GLN 670 -12.869 -5.442 -11.692 1196 1HB GLN 670 1HB GLN 670 -15.238 -3.670 -12.145 1197 2HB GLN 670 2HB GLN 670 -15.550 -5.166 -11.288 1198 1HG GLN 670 1HG GLN 670 -13.178 -4.201 -10.110 1199 2HG GLN 670 2HG GLN 670 -14.132 -2.754 -10.372 1200 1HE2 GLN 670 1HE2 GLN 670 -13.427 -3.938 -7.878 1201 2HE2 GLN 670 2HE2 GLN 670 -14.879 -4.383 -7.045 1202 H ASN 671 H ASN 671 -15.288 -5.183 -14.390 1203 HA ASN 671 HA ASN 671 -16.217 -7.764 -14.161 1204 1HB ASN 671 1HB ASN 671 -17.059 -5.724 -15.608 1205 2HB ASN 671 2HB ASN 671 -15.950 -6.314 -16.830 1206 1HD2 ASN 671 1HD2 ASN 671 -17.830 -6.619 -18.132 1207 2HD2 ASN 671 2HD2 ASN 671 -18.804 -8.043 -17.980 1208 H LEU 672 H LEU 672 -13.282 -6.362 -15.572 1209 HA LEU 672 HA LEU 672 -12.677 -8.605 -17.234 1210 1HB LEU 672 1HB LEU 672 -11.855 -6.565 -17.985 1211 2HB LEU 672 2HB LEU 672 -11.271 -6.092 -16.402 1212 HG LEU 672 HG LEU 672 -9.760 -8.333 -16.897 1213 1HD1 LEU 672 2HD1 LEU 672 -10.401 -7.012 -19.526 1214 2HD1 LEU 672 3HD1 LEU 672 -8.841 -7.822 -19.249 1215 3HD1 LEU 672 1HD1 LEU 672 -10.358 -8.742 -19.112 1216 1HD2 LEU 672 3HD2 LEU 672 -9.287 -5.782 -16.235 1217 2HD2 LEU 672 1HD2 LEU 672 -8.003 -6.911 -16.730 1218 3HD2 LEU 672 2HD2 LEU 672 -8.675 -5.757 -17.907 1219 H ALA 673 H ALA 673 -11.486 -7.326 -14.056 1220 HA ALA 673 HA ALA 673 -9.752 -9.527 -13.648 1221 1HB ALA 673 1HB ALA 673 -10.350 -7.008 -12.452 1222 2HB ALA 673 2HB ALA 673 -10.548 -8.249 -11.191 1223 3HB ALA 673 3HB ALA 673 -9.007 -8.113 -12.072 1224 H ARG 674 H ARG 674 -13.186 -9.067 -13.418 1225 HA ARG 674 HA ARG 674 -13.640 -10.862 -11.321 1226 1HB ARG 674 1HB ARG 674 -15.311 -9.584 -13.493 1227 2HB ARG 674 2HB ARG 674 -16.002 -10.939 -12.622 1228 1HG ARG 674 1HG ARG 674 -14.773 -9.160 -10.697 1229 2HG ARG 674 2HG ARG 674 -15.781 -8.201 -11.763 1230 1HD ARG 674 1HD ARG 674 -17.703 -9.755 -11.342 1231 2HD ARG 674 2HD ARG 674 -16.695 -10.711 -10.273 1232 HE ARG 674 HE ARG 674 -16.660 -7.937 -9.461 1233 2HH1 ARG 674 1HH ARG 674 -19.013 -8.247 -6.925 1234 1HH2 ARG 674 2HH2 ARG 674 -18.705 -10.830 -9.384 1235 2HH2 ARG 674 1HH2 ARG 674 -19.565 -10.335 -7.964 1236 H THR 675 H THR 675 -13.162 -11.147 -14.840 1237 HA THR 675 HA THR 675 -13.739 -14.027 -14.662 1238 HB THR 675 HB THR 675 -13.716 -12.046 -16.998 1239 HG1 THR 675 1HG THR 675 -15.915 -12.189 -16.604 1240 1HG2 THR 675 2HG2 THR 675 -12.995 -14.516 -17.517 1241 2HG2 THR 675 3HG2 THR 675 -14.661 -14.943 -17.059 1242 3HG2 THR 675 1HG2 THR 675 -14.368 -13.849 -18.433 1243 H ILE 676 H ILE 676 -11.215 -11.767 -14.594 1244 HA ILE 676 HA ILE 676 -9.382 -13.597 -15.942 1245 HB ILE 676 HB ILE 676 -9.291 -10.707 -15.158 1246 1HG1 ILE 676 1HG1 ILE 676 -8.934 -12.274 -17.719 1247 2HG1 ILE 676 2HG1 ILE 676 -10.181 -11.106 -17.327 1248 1HG2 ILE 676 3HG2 ILE 676 -7.047 -12.564 -15.093 1249 2HG2 ILE 676 1HG2 ILE 676 -6.801 -11.240 -16.257 1250 3HG2 ILE 676 2HG2 ILE 676 -7.155 -10.872 -14.552 1251 1HD1 ILE 676 3HD1 ILE 676 -8.097 -9.467 -16.980 1252 2HD1 ILE 676 1HD1 ILE 676 -7.296 -10.636 -18.057 1253 3HD1 ILE 676 2HD1 ILE 676 -8.756 -9.777 -18.604 1254 H SER 677 H SER 677 -9.703 -11.736 -12.837 1255 HA SER 677 HA SER 677 -7.628 -12.709 -11.498 1256 1HB SER 677 1HB SER 677 -9.318 -11.088 -10.622 1257 2HB SER 677 2HB SER 677 -10.450 -12.403 -10.379 1258 HG SER 677 HG SER 677 -8.688 -11.535 -8.623 1259 H GLU 678 H GLU 678 -10.564 -14.465 -12.452 1260 HA GLU 678 HA GLU 678 -10.304 -16.583 -10.668 1261 1HB GLU 678 1HB GLU 678 -11.818 -17.783 -12.257 1262 2HB GLU 678 2HB GLU 678 -12.389 -16.174 -11.864 1263 1HG GLU 678 1HG GLU 678 -11.094 -15.411 -14.015 1264 2HG GLU 678 2HG GLU 678 -11.053 -17.114 -14.428 1265 HE2 GLU 678 HE GLU 678 -12.370 -15.878 -16.118 1266 H ALA 679 H ALA 679 -8.798 -15.830 -13.813 1267 HA ALA 679 HA ALA 679 -7.922 -18.205 -14.707 1268 1HB ALA 679 3HB ALA 679 -5.965 -15.923 -14.493 1269 2HB ALA 679 1HB ALA 679 -6.313 -16.990 -15.874 1270 3HB ALA 679 2HB ALA 679 -7.464 -15.708 -15.428 1271 H GLY 680 H GLY 680 -7.006 -16.580 -11.700 1272 1HA GLY 680 2HA GLY 680 -5.980 -17.486 -9.886 1273 2HA GLY 680 1HA GLY 680 -4.613 -17.516 -10.983 1274 H GLN 681 H GLN 681 -7.350 -19.429 -9.669 1275 HA GLN 681 HA GLN 681 -5.914 -21.811 -10.553 1276 1HB GLN 681 1HB GLN 681 -7.069 -21.072 -7.877 1277 2HB GLN 681 2HB GLN 681 -7.175 -22.752 -8.362 1278 1HG GLN 681 1HG GLN 681 -4.539 -22.062 -9.036 1279 2HG GLN 681 2HG GLN 681 -4.810 -21.185 -7.543 1280 1HE2 GLN 681 1HE2 GLN 681 -2.975 -23.167 -7.633 1281 2HE2 GLN 681 2HE2 GLN 681 -3.483 -24.548 -6.718 1282 H ALA 682 H ALA 682 -8.750 -19.940 -10.749 1283 HA ALA 682 HA ALA 682 -10.725 -21.929 -10.803 1284 1HB ALA 682 1HB ALA 682 -11.091 -19.590 -12.576 1285 2HB ALA 682 3HB ALA 682 -10.625 -19.180 -10.907 1286 3HB ALA 682 2HB ALA 682 -12.082 -20.157 -11.210 1287 H MET 683 H MET 683 -9.443 -20.083 -13.657 1288 HA MET 683 HA MET 683 -10.376 -21.618 -15.598 1289 1HB MET 683 1HB MET 683 -8.896 -19.540 -15.777 1290 2HB MET 683 2HB MET 683 -7.500 -20.553 -15.470 1291 1HG MET 683 1HG MET 683 -7.732 -20.233 -17.891 1292 2HG MET 683 2HG MET 683 -8.049 -21.913 -17.510 1293 1HE MET 683 3HE MET 683 -9.486 -23.054 -18.439 1294 2HE MET 683 1HE MET 683 -11.182 -22.722 -18.863 1295 3HE MET 683 2HE MET 683 -9.877 -22.248 -19.977 1296 H ALA 684 H ALA 684 -7.859 -22.524 -13.296 1297 HA ALA 684 HA ALA 684 -7.036 -24.796 -14.898 1298 1HB ALA 684 2HB ALA 684 -5.482 -25.167 -12.980 1299 2HB ALA 684 3HB ALA 684 -5.341 -23.534 -13.673 1300 3HB ALA 684 1HB ALA 684 -6.221 -23.779 -12.146 1301 H SER 685 H SER 685 -8.889 -24.006 -11.911 1302 HA SER 685 HA SER 685 -9.324 -26.742 -11.327 1303 1HB SER 685 1HB SER 685 -10.489 -24.142 -10.265 1304 2HB SER 685 2HB SER 685 -11.066 -25.699 -9.705 1305 HG SER 685 HG SER 685 -8.377 -25.812 -9.598 1306 H THR 686 H THR 686 -11.932 -24.261 -11.629 1307 HA THR 686 HA THR 686 -13.125 -25.722 -13.840 1308 HB THR 686 HB THR 686 -13.850 -26.816 -11.626 1309 HG1 THR 686 1HG THR 686 -15.337 -27.086 -13.288 1310 1HG2 THR 686 2HG2 THR 686 -15.080 -24.037 -11.332 1311 2HG2 THR 686 3HG2 THR 686 -15.815 -25.472 -10.579 1312 3HG2 THR 686 1HG2 THR 686 -14.174 -24.965 -10.113 1313 H GLU 687 H GLU 687 -15.628 -24.498 -13.834 1314 HA GLU 687 HA GLU 687 -15.340 -21.728 -13.409 1315 1HB GLU 687 1HB GLU 687 -15.575 -21.125 -15.891 1316 2HB GLU 687 2HB GLU 687 -13.987 -21.652 -15.369 1317 1HG GLU 687 1HG GLU 687 -16.041 -23.558 -16.576 1318 2HG GLU 687 2HG GLU 687 -14.860 -22.702 -17.546 1319 HE2 GLU 687 HE GLU 687 -13.889 -26.056 -16.083 1320 H GLY 688 H GLY 688 -17.353 -20.531 -14.106 1321 1HA GLY 688 2HA GLY 688 -19.591 -22.149 -14.984 1322 2HA GLY 688 1HA GLY 688 -19.569 -20.426 -14.664 1323 H ASN 689 H ASN 689 -18.043 -22.203 -12.131 1324 HA ASN 689 HA ASN 689 -20.554 -22.438 -10.698 1325 1HB ASN 689 1HB ASN 689 -18.176 -24.041 -10.829 1326 2HB ASN 689 2HB ASN 689 -18.219 -23.373 -9.210 1327 1HD2 ASN 689 1HD2 ASN 689 -18.432 -25.864 -9.052 1328 2HD2 ASN 689 2HD2 ASN 689 -20.041 -26.479 -8.870 1329 H VAL 690 H VAL 690 -17.200 -21.084 -10.576 1330 HA VAL 690 HA VAL 690 -17.699 -19.736 -8.086 1331 HB VAL 690 HB VAL 690 -15.432 -18.876 -8.415 1332 1HG1 VAL 690 1HG1 VAL 690 -15.988 -21.819 -8.690 1333 2HG1 VAL 690 2HG1 VAL 690 -14.309 -21.229 -8.671 1334 3HG1 VAL 690 3HG1 VAL 690 -15.383 -20.903 -7.289 1335 1HG2 VAL 690 2HG2 VAL 690 -15.935 -19.709 -11.181 1336 2HG2 VAL 690 3HG2 VAL 690 -14.757 -18.544 -10.529 1337 3HG2 VAL 690 1HG2 VAL 690 -14.372 -20.282 -10.551 1338 H THR 691 H THR 691 -19.077 -18.029 -8.066 1339 HA THR 691 HA THR 691 -18.638 -15.969 -10.105 1340 HB THR 691 HB THR 691 -21.349 -17.107 -9.239 1341 HG1 THR 691 1HG THR 691 -21.234 -17.858 -11.495 1342 1HG2 THR 691 1HG2 THR 691 -20.493 -14.902 -11.172 1343 2HG2 THR 691 2HG2 THR 691 -22.049 -15.750 -11.337 1344 3HG2 THR 691 3HG2 THR 691 -21.703 -14.800 -9.871 1345 H GLY 692 H GLY 692 -20.356 -16.805 -7.024 1346 1HA GLY 692 2HA GLY 692 -20.901 -15.442 -5.286 1347 2HA GLY 692 1HA GLY 692 -20.326 -14.049 -6.181 1348 H MET 693 H MET 693 -18.593 -17.121 -5.340 1349 HA MET 693 HA MET 693 -17.198 -16.076 -3.201 1350 1HB MET 693 1HB MET 693 -17.387 -18.508 -3.735 1351 2HB MET 693 2HB MET 693 -16.468 -18.279 -5.210 1352 1HG MET 693 1HG MET 693 -14.435 -17.862 -4.034 1353 2HG MET 693 2HG MET 693 -15.265 -17.475 -2.540 1354 1HE MET 693 3HE MET 693 -13.066 -19.474 -3.983 1355 2HE MET 693 1HE MET 693 -13.187 -21.114 -3.301 1356 3HE MET 693 2HE MET 693 -14.042 -20.712 -4.809 1357 H PHE 694 H PHE 694 -16.065 -16.604 -6.623 1358 HA PHE 694 HA PHE 694 -13.677 -15.131 -6.144 1359 1HB PHE 694 1HB PHE 694 -15.153 -16.527 -8.385 1360 2HB PHE 694 2HB PHE 694 -13.985 -15.320 -8.884 1361 HD1 PHE 694 1HD PHE 694 -14.187 -18.189 -6.493 1362 HD2 PHE 694 2HD PHE 694 -11.852 -16.059 -9.324 1363 HE1 PHE 694 1HE PHE 694 -12.341 -19.869 -6.234 1364 HE2 PHE 694 2HE PHE 694 -10.005 -17.739 -9.065 1365 HZ PHE 694 HZ PHE 694 -10.272 -19.624 -7.523 1366 H ALA 695 H ALA 695 -14.743 -13.125 -5.279 1367 HA ALA 695 HA ALA 695 -16.468 -11.550 -6.731 1368 1HB ALA 695 2HB ALA 695 -15.096 -11.417 -4.325 1369 2HB ALA 695 1HB ALA 695 -16.158 -10.149 -4.984 1370 3HB ALA 695 3HB ALA 695 -14.400 -10.067 -5.252 No H/Q in entry = 1370 Start of MODEL 15 1 H ALA 1 H ALA 1 -2.349 28.014 -3.542 2 HA ALA 1 HA ALA 1 -3.233 27.597 -1.062 3 1HB ALA 1 1HB ALA 1 -0.380 28.622 -0.965 4 2HB ALA 1 3HB ALA 1 -1.095 27.247 -0.089 5 3HB ALA 1 2HB ALA 1 -1.534 28.913 0.358 6 H GLU 2 H GLU 2 -1.174 30.215 -2.533 7 HA GLU 2 HA GLU 2 -2.519 32.352 -1.717 8 1HB GLU 2 1HB GLU 2 -0.678 31.749 -3.798 9 2HB GLU 2 2HB GLU 2 -1.958 32.672 -4.559 10 1HG GLU 2 1HG GLU 2 -0.585 33.546 -1.976 11 2HG GLU 2 2HG GLU 2 -0.047 34.055 -3.564 12 HE2 GLU 2 HE GLU 2 -1.906 36.654 -3.532 13 H MET 3 H MET 3 -3.176 31.088 -5.061 14 HA MET 3 HA MET 3 -5.968 31.788 -4.574 15 1HB MET 3 1HB MET 3 -4.076 32.205 -6.862 16 2HB MET 3 2HB MET 3 -5.680 31.683 -7.337 17 1HG MET 3 1HG MET 3 -6.041 33.704 -5.331 18 2HG MET 3 2HG MET 3 -4.821 34.309 -6.434 19 1HE MET 3 3HE MET 3 -5.092 35.383 -8.128 20 2HE MET 3 1HE MET 3 -5.741 34.517 -9.541 21 3HE MET 3 2HE MET 3 -6.620 35.912 -8.871 22 H LYS 4 H LYS 4 -7.411 30.543 -6.398 23 HA LYS 4 HA LYS 4 -6.711 27.726 -6.024 24 1HB LYS 4 1HB LYS 4 -9.067 27.265 -6.261 25 2HB LYS 4 2HB LYS 4 -8.839 28.509 -5.048 26 1HG LYS 4 1HG LYS 4 -9.102 30.051 -7.324 27 2HG LYS 4 2HG LYS 4 -10.130 28.691 -7.729 28 1HD LYS 4 1HD LYS 4 -11.633 29.116 -5.985 29 2HD LYS 4 2HD LYS 4 -10.417 29.865 -4.970 30 1HE LYS 4 1HE LYS 4 -10.369 31.747 -6.823 31 2HE LYS 4 2HE LYS 4 -11.905 31.071 -7.326 32 H THR 5 H THR 5 -7.042 30.296 -8.379 33 HA THR 5 HA THR 5 -6.968 28.315 -10.551 34 HB THR 5 HB THR 5 -7.856 30.111 -11.934 35 HG1 THR 5 1HG THR 5 -6.820 31.978 -11.246 36 1HG2 THR 5 3HG2 THR 5 -9.132 29.554 -9.325 37 2HG2 THR 5 1HG2 THR 5 -9.537 31.172 -9.946 38 3HG2 THR 5 2HG2 THR 5 -9.884 29.729 -10.929 39 H ASP 6 H ASP 6 -5.019 30.440 -8.671 40 HA ASP 6 HA ASP 6 -3.282 31.566 -10.292 41 1HB ASP 6 1HB ASP 6 -3.214 30.438 -7.626 42 2HB ASP 6 2HB ASP 6 -1.681 30.090 -8.402 43 HD2 ASP 6 HD ASP 6 -0.998 31.813 -6.582 44 H ALA 7 H ALA 7 -1.332 30.917 -11.475 45 HA ALA 7 HA ALA 7 -1.529 28.388 -12.715 46 1HB ALA 7 2HB ALA 7 0.312 30.760 -12.789 47 2HB ALA 7 3HB ALA 7 0.871 29.230 -13.508 48 3HB ALA 7 1HB ALA 7 -0.619 30.000 -14.102 49 H ALA 8 H ALA 8 0.440 29.762 -10.048 50 HA ALA 8 HA ALA 8 2.238 27.608 -9.875 51 1HB ALA 8 1HB ALA 8 2.184 28.654 -7.361 52 2HB ALA 8 3HB ALA 8 1.444 29.988 -8.277 53 3HB ALA 8 2HB ALA 8 3.062 29.395 -8.721 54 H THR 9 H THR 9 -0.879 28.378 -8.198 55 HA THR 9 HA THR 9 -0.841 26.051 -6.594 56 HB THR 9 HB THR 9 -2.145 28.287 -6.316 57 HG1 THR 9 1HG THR 9 -3.498 25.679 -6.274 58 1HG2 THR 9 1HG2 THR 9 -3.818 26.814 -8.395 59 2HG2 THR 9 2HG2 THR 9 -4.584 27.881 -7.193 60 3HG2 THR 9 3HG2 THR 9 -3.396 28.542 -8.343 61 H LEU 10 H LEU 10 -2.018 26.755 -9.892 62 HA LEU 10 HA LEU 10 -3.520 24.389 -10.138 63 1HB LEU 10 1HB LEU 10 -2.384 26.422 -12.019 64 2HB LEU 10 2HB LEU 10 -3.046 24.931 -12.656 65 HG LEU 10 HG LEU 10 -4.553 26.903 -10.917 66 1HD1 LEU 10 2HD1 LEU 10 -4.632 26.439 -13.909 67 2HD1 LEU 10 3HD1 LEU 10 -5.810 27.416 -12.999 68 3HD1 LEU 10 1HD1 LEU 10 -4.100 27.908 -13.056 69 1HD2 LEU 10 1HD2 LEU 10 -5.425 24.352 -12.292 70 2HD2 LEU 10 2HD2 LEU 10 -5.448 24.724 -10.551 71 3HD2 LEU 10 3HD2 LEU 10 -6.551 25.576 -11.659 72 H ALA 11 H ALA 11 -0.185 25.274 -11.278 73 HA ALA 11 HA ALA 11 0.434 22.763 -12.285 74 1HB ALA 11 2HB ALA 11 2.033 25.107 -11.237 75 2HB ALA 11 3HB ALA 11 2.843 23.623 -11.791 76 3HB ALA 11 1HB ALA 11 1.825 24.553 -12.916 77 H GLN 12 H GLN 12 0.530 24.106 -8.969 78 HA GLN 12 HA GLN 12 2.076 22.085 -7.866 79 1HB GLN 12 1HB GLN 12 0.569 24.380 -6.961 80 2HB GLN 12 2HB GLN 12 0.197 23.026 -5.913 81 1HG GLN 12 1HG GLN 12 2.252 23.099 -4.942 82 2HG GLN 12 2HG GLN 12 3.062 23.094 -6.496 83 1HE2 GLN 12 1HE2 GLN 12 4.500 24.661 -6.379 84 2HE2 GLN 12 2HE2 GLN 12 4.195 26.319 -5.981 85 H GLU 13 H GLU 13 -1.450 22.397 -8.478 86 HA GLU 13 HA GLU 13 -1.929 19.897 -7.151 87 1HB GLU 13 1HB GLU 13 -3.826 21.723 -8.693 88 2HB GLU 13 2HB GLU 13 -4.311 20.338 -7.735 89 1HG GLU 13 1HG GLU 13 -2.749 22.696 -6.587 90 2HG GLU 13 2HG GLU 13 -4.499 22.601 -6.559 91 HE2 GLU 13 HE GLU 13 -3.571 21.203 -3.418 92 H ALA 14 H ALA 14 -1.563 21.234 -10.431 93 HA ALA 14 HA ALA 14 -2.661 19.016 -11.793 94 1HB ALA 14 2HB ALA 14 -2.095 21.499 -12.526 95 2HB ALA 14 3HB ALA 14 -0.527 20.782 -12.971 96 3HB ALA 14 1HB ALA 14 -2.028 20.169 -13.707 97 H GLY 15 H GLY 15 0.725 20.017 -10.952 98 1HA GLY 15 2HA GLY 15 2.575 18.776 -10.632 99 2HA GLY 15 1HA GLY 15 2.134 17.994 -12.136 100 H ASN 16 H ASN 16 0.046 17.872 -9.239 101 HA ASN 16 HA ASN 16 1.096 15.381 -8.394 102 1HB ASN 16 1HB ASN 16 0.135 16.511 -6.584 103 2HB ASN 16 2HB ASN 16 -1.119 17.240 -7.568 104 1HD2 ASN 16 1HD2 ASN 16 -2.995 16.657 -6.782 105 2HD2 ASN 16 2HD2 ASN 16 -3.505 15.054 -6.369 106 H PHE 17 H PHE 17 -1.513 16.612 -10.485 107 HA PHE 17 HA PHE 17 -2.979 14.172 -10.556 108 1HB PHE 17 1HB PHE 17 -3.970 16.423 -10.993 109 2HB PHE 17 2HB PHE 17 -2.824 16.710 -12.286 110 HD1 PHE 17 1HD PHE 17 -3.349 16.114 -14.486 111 HD2 PHE 17 2HD PHE 17 -5.643 14.499 -11.302 112 HE1 PHE 17 1HE PHE 17 -4.978 15.163 -16.142 113 HE2 PHE 17 2HE PHE 17 -7.272 13.549 -12.958 114 HZ PHE 17 HZ PHE 17 -6.921 13.892 -15.358 115 H GLU 18 H GLU 18 -0.839 15.917 -12.926 116 HA GLU 18 HA GLU 18 -0.917 14.286 -14.994 117 1HB GLU 18 1HB GLU 18 1.213 15.946 -13.754 118 2HB GLU 18 2HB GLU 18 1.808 14.729 -14.866 119 1HG GLU 18 1HG GLU 18 0.946 15.799 -16.697 120 2HG GLU 18 2HG GLU 18 -0.576 16.144 -15.899 121 HE2 GLU 18 HE GLU 18 2.767 17.323 -15.220 122 H ARG 19 H ARG 19 0.787 13.630 -11.899 123 HA ARG 19 HA ARG 19 2.122 11.371 -12.781 124 1HB ARG 19 1HB ARG 19 2.063 12.845 -10.452 125 2HB ARG 19 2HB ARG 19 1.197 11.413 -9.932 126 1HG ARG 19 1HG ARG 19 3.044 10.005 -10.233 127 2HG ARG 19 2HG ARG 19 3.740 11.002 -11.495 128 1HD ARG 19 1HD ARG 19 5.099 11.966 -9.953 129 2HD ARG 19 2HD ARG 19 3.692 12.642 -9.158 130 HE ARG 19 HE ARG 19 5.171 10.222 -8.354 131 2HH1 ARG 19 1HH ARG 19 3.256 9.750 -5.495 132 1HH2 ARG 19 2HH2 ARG 19 2.203 12.118 -7.963 133 2HH2 ARG 19 1HH2 ARG 19 1.805 11.411 -6.433 134 H ILE 20 H ILE 20 -1.127 11.889 -11.300 135 HA ILE 20 HA ILE 20 -1.737 9.171 -10.957 136 HB ILE 20 HB ILE 20 -3.558 11.554 -11.318 137 1HG1 ILE 20 1HG1 ILE 20 -2.729 10.333 -8.689 138 2HG1 ILE 20 2HG1 ILE 20 -1.749 11.567 -9.455 139 1HG2 ILE 20 3HG2 ILE 20 -4.043 8.693 -10.638 140 2HG2 ILE 20 1HG2 ILE 20 -4.966 9.928 -9.748 141 3HG2 ILE 20 2HG2 ILE 20 -5.058 9.857 -11.524 142 1HD1 ILE 20 2HD1 ILE 20 -4.121 12.816 -9.681 143 2HD1 ILE 20 3HD1 ILE 20 -4.509 11.783 -8.283 144 3HD1 ILE 20 1HD1 ILE 20 -3.146 12.925 -8.196 145 H SER 21 H SER 21 -2.417 11.523 -13.624 146 HA SER 21 HA SER 21 -3.928 9.880 -15.173 147 1HB SER 21 1HB SER 21 -2.839 11.259 -17.119 148 2HB SER 21 2HB SER 21 -3.795 12.098 -15.913 149 HG SER 21 HG SER 21 -1.086 11.839 -15.221 150 H GLY 22 H GLY 22 -0.331 10.170 -14.962 151 1HA GLY 22 2HA GLY 22 1.329 8.864 -15.733 152 2HA GLY 22 1HA GLY 22 0.290 8.415 -17.071 153 H ASP 23 H ASP 23 0.242 7.869 -13.469 154 HA ASP 23 HA ASP 23 0.870 5.232 -13.545 155 1HB ASP 23 1HB ASP 23 0.289 7.005 -11.582 156 2HB ASP 23 2HB ASP 23 -1.235 6.140 -11.590 157 HD2 ASP 23 HD ASP 23 -0.997 4.542 -9.789 158 H LEU 24 H LEU 24 -2.306 6.907 -13.906 159 HA LEU 24 HA LEU 24 -3.945 4.663 -13.780 160 1HB LEU 24 1HB LEU 24 -4.134 7.464 -14.611 161 2HB LEU 24 2HB LEU 24 -5.210 6.404 -15.499 162 HG LEU 24 HG LEU 24 -5.086 6.591 -12.476 163 1HD1 LEU 24 2HD1 LEU 24 -6.072 8.515 -14.171 164 2HD1 LEU 24 3HD1 LEU 24 -7.517 7.537 -13.818 165 3HD1 LEU 24 1HD1 LEU 24 -6.580 8.254 -12.485 166 1HD2 LEU 24 2HD2 LEU 24 -6.203 4.616 -14.189 167 2HD2 LEU 24 3HD2 LEU 24 -6.325 4.755 -12.419 168 3HD2 LEU 24 1HD2 LEU 24 -7.546 5.527 -13.458 169 H LYS 25 H LYS 25 -2.131 6.169 -16.500 170 HA LYS 25 HA LYS 25 -3.234 4.382 -18.423 171 1HB LYS 25 1HB LYS 25 -2.578 6.415 -19.325 172 2HB LYS 25 2HB LYS 25 -1.097 6.488 -18.392 173 1HG LYS 25 1HG LYS 25 0.051 5.022 -19.822 174 2HG LYS 25 2HG LYS 25 -1.412 4.215 -20.351 175 1HD LYS 25 1HD LYS 25 -0.646 5.556 -22.210 176 2HD LYS 25 2HD LYS 25 -2.074 6.346 -21.572 177 1HE LYS 25 1HE LYS 25 -0.768 8.225 -21.538 178 2HE LYS 25 2HE LYS 25 -0.118 7.557 -20.055 179 H THR 26 H THR 26 -0.317 4.495 -16.342 180 HA THR 26 HA THR 26 1.080 2.409 -17.566 181 HB THR 26 HB THR 26 1.005 3.747 -14.847 182 HG1 THR 26 1HG THR 26 2.091 4.469 -16.946 183 1HG2 THR 26 2HG2 THR 26 2.156 1.069 -15.477 184 2HG2 THR 26 3HG2 THR 26 3.333 2.239 -14.835 185 3HG2 THR 26 1HG2 THR 26 1.878 1.834 -13.894 186 H GLN 27 H GLN 27 -1.435 2.372 -14.982 187 HA GLN 27 HA GLN 27 -1.204 -0.392 -14.595 188 1HB GLN 27 1HB GLN 27 -3.534 1.480 -13.981 189 2HB GLN 27 2HB GLN 27 -3.345 -0.139 -13.337 190 1HG GLN 27 1HG GLN 27 -1.195 1.985 -12.960 191 2HG GLN 27 2HG GLN 27 -2.548 1.845 -11.855 192 1HE2 GLN 27 1HE2 GLN 27 0.554 0.925 -12.455 193 2HE2 GLN 27 2HE2 GLN 27 0.679 -0.499 -11.476 194 H ILE 28 H ILE 28 -3.536 1.674 -16.454 195 HA ILE 28 HA ILE 28 -5.179 -0.338 -17.359 196 HB ILE 28 HB ILE 28 -4.493 2.415 -18.151 197 1HG1 ILE 28 1HG1 ILE 28 -7.222 1.153 -18.134 198 2HG1 ILE 28 2HG1 ILE 28 -6.398 1.470 -16.620 199 1HG2 ILE 28 2HG2 ILE 28 -5.528 0.401 -20.130 200 2HG2 ILE 28 3HG2 ILE 28 -6.026 2.108 -20.215 201 3HG2 ILE 28 1HG2 ILE 28 -4.304 1.676 -20.343 202 1HD1 ILE 28 3HD1 ILE 28 -6.018 3.876 -17.492 203 2HD1 ILE 28 1HD1 ILE 28 -7.195 3.474 -18.765 204 3HD1 ILE 28 2HD1 ILE 28 -7.687 3.436 -17.055 205 H ASP 29 H ASP 29 -2.078 0.905 -18.741 206 HA ASP 29 HA ASP 29 -2.141 -0.642 -21.014 207 1HB ASP 29 1HB ASP 29 -0.337 1.125 -19.705 208 2HB ASP 29 2HB ASP 29 0.565 -0.362 -19.922 209 HD2 ASP 29 HD ASP 29 0.980 2.152 -22.212 210 H GLN 30 H GLN 30 -0.916 -1.243 -17.668 211 HA GLN 30 HA GLN 30 0.418 -3.593 -18.165 212 1HB GLN 30 1HB GLN 30 -0.870 -2.338 -15.751 213 2HB GLN 30 2HB GLN 30 -0.356 -4.009 -15.626 214 1HG GLN 30 1HG GLN 30 1.940 -3.430 -16.214 215 2HG GLN 30 2HG GLN 30 1.480 -1.794 -16.642 216 1HE2 GLN 30 1HE2 GLN 30 2.759 -0.754 -15.210 217 2HE2 GLN 30 2HE2 GLN 30 2.559 -0.794 -13.490 218 H VAL 31 H VAL 31 -3.051 -2.972 -17.376 219 HA VAL 31 HA VAL 31 -3.746 -5.702 -17.212 220 HB VAL 31 HB VAL 31 -5.248 -3.118 -17.556 221 1HG1 VAL 31 3HG1 VAL 31 -6.453 -4.920 -18.792 222 2HG1 VAL 31 1HG1 VAL 31 -6.522 -5.860 -17.283 223 3HG1 VAL 31 2HG1 VAL 31 -7.355 -4.292 -17.392 224 1HG2 VAL 31 2HG2 VAL 31 -4.225 -4.569 -15.340 225 2HG2 VAL 31 3HG2 VAL 31 -5.229 -3.100 -15.327 226 3HG2 VAL 31 1HG2 VAL 31 -5.999 -4.704 -15.279 227 H GLU 32 H GLU 32 -4.190 -3.204 -19.816 228 HA GLU 32 HA GLU 32 -5.374 -4.754 -21.660 229 1HB GLU 32 1HB GLU 32 -3.636 -2.353 -21.705 230 2HB GLU 32 2HB GLU 32 -3.646 -3.240 -23.216 231 1HG GLU 32 1HG GLU 32 -6.288 -3.270 -22.836 232 2HG GLU 32 2HG GLU 32 -5.955 -1.908 -21.786 233 HE2 GLU 32 HE GLU 32 -6.498 -0.312 -24.854 234 H SER 33 H SER 33 -1.854 -4.562 -20.895 235 HA SER 33 HA SER 33 -1.149 -6.310 -22.991 236 1HB SER 33 1HB SER 33 0.195 -4.609 -21.190 237 2HB SER 33 2HB SER 33 0.755 -6.212 -20.758 238 HG SER 33 HG SER 33 1.232 -4.705 -23.081 239 H THR 34 H THR 34 -1.362 -6.637 -19.373 240 HA THR 34 HA THR 34 -0.708 -9.319 -19.212 241 HB THR 34 HB THR 34 -2.215 -7.288 -17.570 242 HG1 THR 34 1HG THR 34 -0.457 -8.243 -16.122 243 1HG2 THR 34 3HG2 THR 34 -3.419 -9.616 -17.380 244 2HG2 THR 34 1HG2 THR 34 -1.900 -10.171 -16.636 245 3HG2 THR 34 2HG2 THR 34 -2.835 -8.861 -15.877 246 H ALA 35 H ALA 35 -3.944 -7.798 -19.731 247 HA ALA 35 HA ALA 35 -5.448 -10.094 -19.631 248 1HB ALA 35 1HB ALA 35 -6.068 -8.016 -21.703 249 2HB ALA 35 3HB ALA 35 -5.974 -7.496 -20.004 250 3HB ALA 35 2HB ALA 35 -7.128 -8.763 -20.483 251 H GLY 36 H GLY 36 -3.236 -8.892 -22.146 252 1HA GLY 36 2HA GLY 36 -2.360 -9.950 -23.933 253 2HA GLY 36 1HA GLY 36 -4.031 -10.220 -24.387 254 H SER 37 H SER 37 -2.181 -11.551 -21.569 255 HA SER 37 HA SER 37 -1.851 -14.060 -22.793 256 1HB SER 37 1HB SER 37 -1.725 -13.385 -19.822 257 2HB SER 37 2HB SER 37 -0.994 -14.771 -20.607 258 HG SER 37 HG SER 37 -0.143 -12.079 -20.531 259 H LEU 38 H LEU 38 -4.337 -12.517 -20.776 260 HA LEU 38 HA LEU 38 -5.607 -14.912 -19.967 261 1HB LEU 38 1HB LEU 38 -6.251 -11.997 -19.948 262 2HB LEU 38 2HB LEU 38 -7.551 -13.144 -19.692 263 HG LEU 38 HG LEU 38 -6.912 -12.682 -17.534 264 1HD1 LEU 38 2HD1 LEU 38 -6.601 -15.191 -18.284 265 2HD1 LEU 38 3HD1 LEU 38 -4.904 -14.876 -17.850 266 3HD1 LEU 38 1HD1 LEU 38 -6.188 -14.660 -16.636 267 1HD2 LEU 38 2HD2 LEU 38 -4.621 -11.633 -18.671 268 2HD2 LEU 38 3HD2 LEU 38 -5.023 -11.660 -16.938 269 3HD2 LEU 38 1HD2 LEU 38 -4.005 -12.942 -17.635 270 H GLN 39 H GLN 39 -6.597 -12.390 -22.397 271 HA GLN 39 HA GLN 39 -8.666 -13.780 -23.452 272 1HB GLN 39 1HB GLN 39 -7.988 -12.456 -25.635 273 2HB GLN 39 2HB GLN 39 -8.512 -11.583 -24.209 274 1HG GLN 39 1HG GLN 39 -5.653 -12.084 -24.021 275 2HG GLN 39 2HG GLN 39 -6.008 -11.360 -25.577 276 1HE2 GLN 39 1HE2 GLN 39 -7.789 -10.966 -22.549 277 2HE2 GLN 39 2HE2 GLN 39 -7.504 -9.272 -22.331 278 H GLY 40 H GLY 40 -5.176 -14.230 -23.958 279 1HA GLY 40 2HA GLY 40 -4.038 -15.560 -25.431 280 2HA GLY 40 1HA GLY 40 -5.537 -15.987 -26.234 281 H GLN 41 H GLN 41 -6.236 -16.332 -22.990 282 HA GLN 41 HA GLN 41 -5.736 -19.175 -23.184 283 1HB GLN 41 1HB GLN 41 -3.981 -17.714 -21.732 284 2HB GLN 41 2HB GLN 41 -5.217 -17.921 -20.507 285 1HG GLN 41 1HG GLN 41 -4.764 -20.451 -21.891 286 2HG GLN 41 2HG GLN 41 -3.240 -19.812 -21.308 287 1HE2 GLN 41 1HE2 GLN 41 -6.504 -19.392 -19.990 288 2HE2 GLN 41 2HE2 GLN 41 -6.228 -20.143 -18.454 289 H TRP 42 H TRP 42 -7.882 -19.792 -23.307 290 HA TRP 42 HA TRP 42 -9.451 -19.510 -20.943 291 1HB TRP 42 1HB TRP 42 -10.308 -18.013 -23.424 292 2HB TRP 42 2HB TRP 42 -11.381 -18.417 -22.098 293 HD1 TRP 42 HD TRP 42 -9.460 -15.561 -23.214 294 HE1 TRP 42 1HE TRP 42 -8.865 -13.817 -21.324 295 HE3 TRP 42 3HE TRP 42 -10.484 -18.652 -19.308 296 HZ2 TRP 42 2HZ TRP 42 -8.890 -13.924 -18.473 297 HZ3 TRP 42 3HZ TRP 42 -10.172 -17.754 -17.004 298 HH2 TRP 42 HH TRP 42 -9.405 -15.478 -16.554 299 H ARG 43 H ARG 43 -11.377 -20.928 -21.094 300 HA ARG 43 HA ARG 43 -11.236 -22.668 -23.420 301 1HB ARG 43 1HB ARG 43 -11.337 -23.412 -20.470 302 2HB ARG 43 2HB ARG 43 -11.928 -24.529 -21.685 303 1HG ARG 43 1HG ARG 43 -9.237 -23.330 -22.225 304 2HG ARG 43 2HG ARG 43 -9.318 -24.425 -20.860 305 1HD ARG 43 1HD ARG 43 -9.990 -26.267 -22.204 306 2HD ARG 43 2HD ARG 43 -10.573 -25.240 -23.499 307 HE ARG 43 HE ARG 43 -7.791 -24.730 -23.221 308 2HH1 ARG 43 1HH ARG 43 -6.580 -27.095 -25.458 309 1HH2 ARG 43 2HH2 ARG 43 -9.904 -27.412 -24.170 310 2HH2 ARG 43 1HH2 ARG 43 -8.728 -28.131 -25.218 311 H GLY 44 H GLY 44 -13.029 -20.738 -23.666 312 1HA GLY 44 2HA GLY 44 -15.564 -22.051 -23.449 313 2HA GLY 44 1HA GLY 44 -15.231 -20.465 -24.114 314 H ALA 45 H ALA 45 -17.092 -19.555 -23.033 315 HA ALA 45 HA ALA 45 -18.182 -18.560 -21.382 316 1HB ALA 45 2HB ALA 45 -18.712 -20.129 -19.865 317 2HB ALA 45 3HB ALA 45 -17.218 -21.029 -20.218 318 3HB ALA 45 1HB ALA 45 -17.212 -19.740 -18.990 319 H ALA 46 H ALA 46 -15.187 -19.352 -19.511 320 HA ALA 46 HA ALA 46 -14.882 -16.792 -18.512 321 1HB ALA 46 1HB ALA 46 -12.363 -18.242 -18.880 322 2HB ALA 46 3HB ALA 46 -13.658 -19.290 -18.254 323 3HB ALA 46 2HB ALA 46 -13.215 -17.805 -17.380 324 H GLY 47 H GLY 47 -13.972 -18.216 -21.632 325 1HA GLY 47 2HA GLY 47 -12.998 -17.346 -23.462 326 2HA GLY 47 1HA GLY 47 -12.028 -16.337 -22.407 327 H THR 48 H THR 48 -15.442 -16.610 -23.630 328 HA THR 48 HA THR 48 -15.458 -14.056 -24.757 329 HB THR 48 HB THR 48 -17.943 -14.504 -24.850 330 HG1 THR 48 1HG THR 48 -17.318 -17.015 -23.570 331 1HG2 THR 48 3HG2 THR 48 -16.402 -15.723 -26.471 332 2HG2 THR 48 1HG2 THR 48 -16.316 -17.060 -25.299 333 3HG2 THR 48 2HG2 THR 48 -17.870 -16.643 -26.061 334 H ALA 49 H ALA 49 -16.016 -15.155 -21.436 335 HA ALA 49 HA ALA 49 -17.370 -12.835 -20.580 336 1HB ALA 49 1HB ALA 49 -15.915 -15.140 -19.297 337 2HB ALA 49 3HB ALA 49 -17.626 -14.667 -19.169 338 3HB ALA 49 2HB ALA 49 -16.379 -13.738 -18.303 339 H ALA 50 H ALA 50 -13.897 -13.879 -20.459 340 HA ALA 50 HA ALA 50 -13.053 -11.427 -19.305 341 1HB ALA 50 3HB ALA 50 -10.956 -12.416 -19.298 342 2HB ALA 50 1HB ALA 50 -11.991 -13.862 -19.376 343 3HB ALA 50 2HB ALA 50 -11.220 -13.239 -20.854 344 H GLN 51 H GLN 51 -12.829 -12.866 -22.634 345 HA GLN 51 HA GLN 51 -11.526 -10.904 -23.887 346 1HB GLN 51 1HB GLN 51 -12.077 -12.762 -25.209 347 2HB GLN 51 2HB GLN 51 -13.766 -12.735 -24.740 348 1HG GLN 51 1HG GLN 51 -12.818 -10.296 -26.180 349 2HG GLN 51 2HG GLN 51 -12.811 -11.767 -27.132 350 1HE2 GLN 51 1HE2 GLN 51 -14.614 -9.188 -26.092 351 2HE2 GLN 51 2HE2 GLN 51 -16.218 -9.761 -26.409 352 H ALA 52 H ALA 52 -15.134 -11.021 -23.426 353 HA ALA 52 HA ALA 52 -15.660 -8.557 -24.588 354 1HB ALA 52 3HB ALA 52 -17.529 -9.897 -24.263 355 2HB ALA 52 2HB ALA 52 -17.701 -8.754 -22.910 356 3HB ALA 52 1HB ALA 52 -17.032 -10.379 -22.623 357 H ALA 53 H ALA 53 -14.936 -9.461 -21.157 358 HA ALA 53 HA ALA 53 -15.266 -6.910 -20.096 359 1HB ALA 53 3HB ALA 53 -13.228 -8.896 -19.078 360 2HB ALA 53 2HB ALA 53 -14.968 -9.259 -18.988 361 3HB ALA 53 1HB ALA 53 -14.313 -7.827 -18.158 362 H VAL 54 H VAL 54 -12.591 -8.449 -21.884 363 HA VAL 54 HA VAL 54 -10.744 -6.353 -21.237 364 HB VAL 54 HB VAL 54 -10.544 -8.425 -23.421 365 1HG1 VAL 54 2HG1 VAL 54 -8.886 -6.371 -22.950 366 2HG1 VAL 54 3HG1 VAL 54 -8.219 -7.534 -21.779 367 3HG1 VAL 54 1HG1 VAL 54 -8.311 -7.962 -23.505 368 1HG2 VAL 54 1HG2 VAL 54 -10.839 -8.901 -20.619 369 2HG2 VAL 54 2HG2 VAL 54 -10.494 -10.069 -21.917 370 3HG2 VAL 54 3HG2 VAL 54 -9.155 -9.261 -21.068 371 H VAL 55 H VAL 55 -12.866 -7.292 -23.997 372 HA VAL 55 HA VAL 55 -11.947 -5.306 -25.743 373 HB VAL 55 HB VAL 55 -13.570 -7.459 -25.906 374 1HG1 VAL 55 1HG1 VAL 55 -15.445 -6.276 -24.809 375 2HG1 VAL 55 2HG1 VAL 55 -15.428 -5.065 -26.113 376 3HG1 VAL 55 3HG1 VAL 55 -15.835 -6.759 -26.477 377 1HG2 VAL 55 3HG2 VAL 55 -12.957 -5.158 -27.694 378 2HG2 VAL 55 1HG2 VAL 55 -12.647 -6.898 -27.909 379 3HG2 VAL 55 2HG2 VAL 55 -14.276 -6.242 -28.200 380 H ARG 56 H ARG 56 -14.668 -5.399 -23.358 381 HA ARG 56 HA ARG 56 -15.608 -2.878 -23.995 382 1HB ARG 56 1HB ARG 56 -15.835 -4.700 -21.581 383 2HB ARG 56 2HB ARG 56 -16.469 -3.070 -21.471 384 1HG ARG 56 1HG ARG 56 -17.640 -3.665 -23.783 385 2HG ARG 56 2HG ARG 56 -17.351 -5.323 -23.294 386 1HD ARG 56 1HD ARG 56 -18.422 -3.885 -21.019 387 2HD ARG 56 2HD ARG 56 -19.439 -3.550 -22.405 388 HE ARG 56 HE ARG 56 -18.984 -6.197 -21.156 389 2HH1 ARG 56 1HH ARG 56 -21.466 -7.706 -23.060 390 1HH2 ARG 56 2HH2 ARG 56 -20.406 -4.379 -23.844 391 2HH2 ARG 56 1HH2 ARG 56 -21.484 -5.655 -24.300 392 H PHE 57 H PHE 57 -13.231 -4.058 -21.538 393 HA PHE 57 HA PHE 57 -12.855 -1.567 -20.300 394 1HB PHE 57 1HB PHE 57 -12.045 -3.409 -19.062 395 2HB PHE 57 2HB PHE 57 -11.572 -4.287 -20.503 396 HD1 PHE 57 1HD PHE 57 -10.542 -1.690 -18.110 397 HD2 PHE 57 2HD PHE 57 -9.358 -4.094 -21.400 398 HE1 PHE 57 1HE PHE 57 -8.146 -1.061 -17.707 399 HE2 PHE 57 2HE PHE 57 -6.962 -3.465 -20.997 400 HZ PHE 57 HZ PHE 57 -6.384 -1.956 -19.155 401 H GLN 58 H GLN 58 -11.229 -3.242 -23.047 402 HA GLN 58 HA GLN 58 -9.100 -1.505 -23.259 403 1HB GLN 58 1HB GLN 58 -10.544 -3.255 -25.280 404 2HB GLN 58 2HB GLN 58 -9.145 -2.303 -25.735 405 1HG GLN 58 1HG GLN 58 -8.621 -3.741 -23.242 406 2HG GLN 58 2HG GLN 58 -9.153 -4.857 -24.484 407 1HE2 GLN 58 1HE2 GLN 58 -6.976 -5.683 -24.276 408 2HE2 GLN 58 2HE2 GLN 58 -5.681 -4.970 -25.180 409 H GLU 59 H GLU 59 -12.241 -1.526 -25.100 410 HA GLU 59 HA GLU 59 -11.746 0.780 -26.502 411 1HB GLU 59 1HB GLU 59 -14.347 -0.504 -25.577 412 2HB GLU 59 2HB GLU 59 -14.317 0.889 -26.640 413 1HG GLU 59 1HG GLU 59 -12.532 -1.374 -27.443 414 2HG GLU 59 2HG GLU 59 -14.251 -1.708 -27.523 415 HE2 GLU 59 HE GLU 59 -14.348 -1.282 -30.128 416 H ALA 60 H ALA 60 -12.726 0.276 -23.141 417 HA ALA 60 HA ALA 60 -13.654 2.964 -22.778 418 1HB ALA 60 2HB ALA 60 -13.057 0.622 -20.938 419 2HB ALA 60 1HB ALA 60 -14.645 1.263 -21.423 420 3HB ALA 60 3HB ALA 60 -13.599 2.207 -20.335 421 H ALA 61 H ALA 61 -10.604 1.160 -22.559 422 HA ALA 61 HA ALA 61 -9.197 2.858 -20.880 423 1HB ALA 61 1HB ALA 61 -8.702 0.529 -22.194 424 2HB ALA 61 2HB ALA 61 -7.757 1.659 -23.193 425 3HB ALA 61 3HB ALA 61 -7.431 1.527 -21.449 426 H ASN 62 H ASN 62 -9.369 2.846 -24.514 427 HA ASN 62 HA ASN 62 -7.820 4.982 -24.989 428 1HB ASN 62 1HB ASN 62 -10.176 5.195 -26.683 429 2HB ASN 62 2HB ASN 62 -8.585 4.594 -27.108 430 1HD2 ASN 62 1HD2 ASN 62 -8.151 2.384 -25.831 431 2HD2 ASN 62 2HD2 ASN 62 -9.346 1.161 -26.109 432 H LYS 63 H LYS 63 -11.389 4.924 -24.278 433 HA LYS 63 HA LYS 63 -11.903 7.611 -24.505 434 1HB LYS 63 1HB LYS 63 -13.131 5.527 -22.679 435 2HB LYS 63 2HB LYS 63 -13.796 7.130 -22.922 436 1HG LYS 63 1HG LYS 63 -13.155 5.693 -25.447 437 2HG LYS 63 2HG LYS 63 -14.390 4.913 -24.478 438 1HD LYS 63 1HD LYS 63 -14.423 7.831 -25.385 439 2HD LYS 63 2HD LYS 63 -15.387 6.540 -26.073 440 1HE LYS 63 1HE LYS 63 -16.167 6.218 -23.521 441 2HE LYS 63 2HE LYS 63 -15.663 7.891 -23.387 442 H GLN 64 H GLN 64 -10.372 5.770 -21.847 443 HA GLN 64 HA GLN 64 -10.465 7.953 -20.061 444 1HB GLN 64 1HB GLN 64 -9.253 5.216 -20.115 445 2HB GLN 64 2HB GLN 64 -8.496 6.372 -19.037 446 1HG GLN 64 1HG GLN 64 -11.486 6.314 -18.958 447 2HG GLN 64 2HG GLN 64 -10.691 4.869 -18.366 448 1HE2 GLN 64 1HE2 GLN 64 -9.248 4.987 -16.624 449 2HE2 GLN 64 2HE2 GLN 64 -9.274 6.292 -15.485 450 H LYS 65 H LYS 65 -7.993 6.547 -22.288 451 HA LYS 65 HA LYS 65 -5.852 8.114 -21.526 452 1HB LYS 65 1HB LYS 65 -6.636 6.560 -23.939 453 2HB LYS 65 2HB LYS 65 -5.365 7.747 -24.155 454 1HG LYS 65 1HG LYS 65 -4.269 5.699 -23.521 455 2HG LYS 65 2HG LYS 65 -4.192 6.746 -22.119 456 1HD LYS 65 1HD LYS 65 -6.562 4.894 -22.370 457 2HD LYS 65 2HD LYS 65 -5.017 4.194 -21.927 458 1HE LYS 65 1HE LYS 65 -5.452 6.624 -20.380 459 2HE LYS 65 2HE LYS 65 -6.853 5.583 -20.230 460 H GLN 66 H GLN 66 -8.605 8.808 -23.730 461 HA GLN 66 HA GLN 66 -7.540 11.208 -24.673 462 1HB GLN 66 1HB GLN 66 -9.668 9.645 -25.354 463 2HB GLN 66 2HB GLN 66 -10.512 10.916 -24.492 464 1HG GLN 66 1HG GLN 66 -8.504 11.432 -26.735 465 2HG GLN 66 2HG GLN 66 -10.237 11.342 -26.982 466 1HE2 GLN 66 1HE2 GLN 66 -7.599 13.262 -26.084 467 2HE2 GLN 66 2HE2 GLN 66 -8.432 14.700 -25.596 468 H GLU 67 H GLU 67 -10.029 10.496 -22.120 469 HA GLU 67 HA GLU 67 -10.380 13.134 -21.384 470 1HB GLU 67 1HB GLU 67 -10.934 10.456 -20.144 471 2HB GLU 67 2HB GLU 67 -11.011 11.852 -19.088 472 1HG GLU 67 1HG GLU 67 -12.529 11.580 -21.727 473 2HG GLU 67 2HG GLU 67 -13.225 11.306 -20.142 474 HE2 GLU 67 HE GLU 67 -14.012 13.180 -21.940 475 H LEU 68 H LEU 68 -7.800 10.840 -20.718 476 HA LEU 68 HA LEU 68 -6.857 12.086 -18.353 477 1HB LEU 68 1HB LEU 68 -6.322 9.769 -19.860 478 2HB LEU 68 2HB LEU 68 -4.824 10.679 -19.832 479 HG LEU 68 HG LEU 68 -4.654 10.580 -17.487 480 1HD1 LEU 68 3HD1 LEU 68 -7.587 10.228 -17.583 481 2HD1 LEU 68 1HD1 LEU 68 -6.741 9.322 -16.305 482 3HD1 LEU 68 2HD1 LEU 68 -6.563 11.090 -16.410 483 1HD2 LEU 68 3HD2 LEU 68 -5.476 8.039 -18.812 484 2HD2 LEU 68 1HD2 LEU 68 -3.919 8.512 -18.091 485 3HD2 LEU 68 2HD2 LEU 68 -5.275 8.032 -17.044 486 H ASP 69 H ASP 69 -5.604 12.074 -21.769 487 HA ASP 69 HA ASP 69 -3.722 14.028 -21.294 488 1HB ASP 69 1HB ASP 69 -4.421 12.427 -23.414 489 2HB ASP 69 2HB ASP 69 -5.026 13.968 -23.990 490 HD2 ASP 69 HD ASP 69 -1.121 13.350 -23.443 491 H GLU 70 H GLU 70 -7.035 14.198 -22.811 492 HA GLU 70 HA GLU 70 -7.169 16.803 -23.392 493 1HB GLU 70 1HB GLU 70 -9.444 16.471 -23.607 494 2HB GLU 70 2HB GLU 70 -8.941 14.798 -23.477 495 1HG GLU 70 1HG GLU 70 -9.418 14.810 -21.042 496 2HG GLU 70 2HG GLU 70 -9.836 16.511 -21.110 497 HE2 GLU 70 HE GLU 70 -12.086 16.885 -21.707 498 H ILE 71 H ILE 71 -7.796 15.299 -20.158 499 HA ILE 71 HA ILE 71 -8.389 17.785 -18.928 500 HB ILE 71 HB ILE 71 -7.756 15.027 -17.895 501 1HG1 ILE 71 1HG1 ILE 71 -10.334 16.624 -17.950 502 2HG1 ILE 71 2HG1 ILE 71 -9.905 15.365 -19.092 503 1HG2 ILE 71 2HG2 ILE 71 -7.243 17.267 -16.432 504 2HG2 ILE 71 3HG2 ILE 71 -8.945 16.959 -16.012 505 3HG2 ILE 71 1HG2 ILE 71 -7.721 15.693 -15.752 506 1HD1 ILE 71 1HD1 ILE 71 -9.651 14.596 -16.220 507 2HD1 ILE 71 2HD1 ILE 71 -11.308 14.907 -16.790 508 3HD1 ILE 71 3HD1 ILE 71 -10.308 13.672 -17.592 509 H SER 72 H SER 72 -5.474 15.646 -19.084 510 HA SER 72 HA SER 72 -3.912 17.167 -17.413 511 1HB SER 72 1HB SER 72 -2.576 15.398 -17.831 512 2HB SER 72 2HB SER 72 -3.592 14.924 -19.178 513 HG SER 72 HG SER 72 -2.362 16.305 -20.574 514 H THR 73 H THR 73 -4.956 17.682 -20.741 515 HA THR 73 HA THR 73 -2.923 19.728 -21.179 516 HB THR 73 HB THR 73 -4.997 18.263 -22.855 517 HG1 THR 73 1HG THR 73 -2.151 18.941 -23.090 518 1HG2 THR 73 3HG2 THR 73 -4.489 20.977 -23.269 519 2HG2 THR 73 1HG2 THR 73 -3.224 20.196 -24.247 520 3HG2 THR 73 2HG2 THR 73 -4.938 19.822 -24.547 521 H ASN 74 H ASN 74 -6.319 19.354 -20.276 522 HA ASN 74 HA ASN 74 -7.252 21.806 -21.015 523 1HB ASN 74 1HB ASN 74 -7.950 19.729 -19.008 524 2HB ASN 74 2HB ASN 74 -8.472 21.332 -18.532 525 1HD2 ASN 74 1HD2 ASN 74 -9.012 18.638 -20.528 526 2HD2 ASN 74 2HD2 ASN 74 -10.347 19.229 -21.459 527 H ILE 75 H ILE 75 -4.925 20.863 -18.554 528 HA ILE 75 HA ILE 75 -5.275 23.139 -16.876 529 HB ILE 75 HB ILE 75 -2.858 21.352 -17.047 530 1HG1 ILE 75 1HG1 ILE 75 -4.878 19.941 -17.009 531 2HG1 ILE 75 2HG1 ILE 75 -3.929 19.796 -15.544 532 1HG2 ILE 75 2HG2 ILE 75 -2.792 23.428 -15.638 533 2HG2 ILE 75 3HG2 ILE 75 -4.106 22.731 -14.660 534 3HG2 ILE 75 1HG2 ILE 75 -2.531 21.907 -14.751 535 1HD1 ILE 75 3HD1 ILE 75 -6.345 21.641 -15.817 536 2HD1 ILE 75 1HD1 ILE 75 -6.409 20.002 -15.126 537 3HD1 ILE 75 2HD1 ILE 75 -5.450 21.269 -14.324 538 H ARG 76 H ARG 76 -2.767 22.137 -19.308 539 HA ARG 76 HA ARG 76 -1.249 24.360 -19.178 540 1HB ARG 76 1HB ARG 76 -1.914 23.050 -21.846 541 2HB ARG 76 2HB ARG 76 -0.380 23.726 -21.333 542 1HG ARG 76 1HG ARG 76 -0.651 21.849 -19.394 543 2HG ARG 76 2HG ARG 76 -1.622 21.077 -20.632 544 1HD ARG 76 1HD ARG 76 0.845 22.118 -21.806 545 2HD ARG 76 2HD ARG 76 1.220 21.095 -20.434 546 HE ARG 76 HE ARG 76 -0.771 19.764 -21.978 547 2HH1 ARG 76 1HH ARG 76 1.324 17.891 -24.019 548 1HH2 ARG 76 2HH2 ARG 76 2.624 20.732 -22.272 549 2HH2 ARG 76 1HH2 ARG 76 3.025 19.446 -23.361 550 H GLN 77 H GLN 77 -4.492 23.973 -20.495 551 HA GLN 77 HA GLN 77 -4.359 26.267 -22.157 552 1HB GLN 77 1HB GLN 77 -6.526 24.366 -21.258 553 2HB GLN 77 2HB GLN 77 -6.990 25.883 -22.001 554 1HG GLN 77 1HG GLN 77 -4.843 24.699 -23.556 555 2HG GLN 77 2HG GLN 77 -6.087 23.491 -23.300 556 1HE2 GLN 77 1HE2 GLN 77 -6.350 23.678 -25.615 557 2HE2 GLN 77 2HE2 GLN 77 -7.381 24.900 -26.281 558 H ALA 78 H ALA 78 -5.099 25.561 -18.774 559 HA ALA 78 HA ALA 78 -6.636 27.838 -18.215 560 1HB ALA 78 3HB ALA 78 -4.765 26.508 -16.246 561 2HB ALA 78 1HB ALA 78 -6.390 27.182 -15.972 562 3HB ALA 78 2HB ALA 78 -6.200 25.651 -16.860 563 H GLY 79 H GLY 79 -3.227 27.344 -18.874 564 1HA GLY 79 2HA GLY 79 -2.723 30.155 -18.103 565 2HA GLY 79 1HA GLY 79 -2.022 29.353 -19.495 566 H VAL 80 H VAL 80 -1.883 26.782 -17.657 567 HA VAL 80 HA VAL 80 0.181 27.581 -15.799 568 HB VAL 80 HB VAL 80 -0.614 24.756 -16.409 569 1HG1 VAL 80 2HG1 VAL 80 0.953 26.089 -14.431 570 2HG1 VAL 80 3HG1 VAL 80 -0.475 25.397 -13.625 571 3HG1 VAL 80 1HG1 VAL 80 0.599 24.351 -14.585 572 1HG2 VAL 80 1HG2 VAL 80 -2.371 26.897 -15.345 573 2HG2 VAL 80 2HG2 VAL 80 -2.782 25.364 -16.151 574 3HG2 VAL 80 3HG2 VAL 80 -2.353 25.374 -14.423 575 H GLN 81 H GLN 81 1.901 28.330 -17.097 576 HA GLN 81 HA GLN 81 3.290 26.164 -18.417 577 1HB GLN 81 1HB GLN 81 1.869 27.805 -20.007 578 2HB GLN 81 2HB GLN 81 3.284 28.823 -19.826 579 1HG GLN 81 1HG GLN 81 4.462 26.371 -20.321 580 2HG GLN 81 2HG GLN 81 2.988 26.226 -21.258 581 1HE2 GLN 81 1HE2 GLN 81 5.498 26.282 -22.404 582 2HE2 GLN 81 2HE2 GLN 81 5.699 27.719 -23.350 583 H TYR 82 H TYR 82 3.306 28.212 -15.965 584 HA TYR 82 HA TYR 82 6.170 28.428 -15.941 585 1HB TYR 82 1HB TYR 82 6.104 30.909 -15.700 586 2HB TYR 82 2HB TYR 82 5.313 30.479 -17.204 587 HD1 TYR 82 1HD TYR 82 2.668 30.063 -16.964 588 HD2 TYR 82 2HD TYR 82 5.042 32.433 -14.308 589 HE1 TYR 82 1HE TYR 82 0.591 31.330 -16.226 590 HE2 TYR 82 2HE TYR 82 2.957 33.692 -13.579 591 HH TYR 82 HH TYR 82 -0.051 32.608 -14.032 592 H SER 83 H SER 83 5.858 26.986 -14.124 593 HA SER 83 HA SER 83 5.107 28.491 -11.768 594 1HB SER 83 1HB SER 83 3.093 27.312 -11.976 595 2HB SER 83 2HB SER 83 3.855 25.919 -12.717 596 HG SER 83 HG SER 83 4.268 25.059 -10.781 597 H ARG 84 H ARG 84 6.206 25.203 -12.901 598 HA ARG 84 HA ARG 84 7.991 25.096 -10.665 599 1HB ARG 84 1HB ARG 84 6.609 23.184 -12.209 600 2HB ARG 84 2HB ARG 84 8.279 22.965 -12.691 601 1HG ARG 84 1HG ARG 84 8.402 23.258 -9.883 602 2HG ARG 84 2HG ARG 84 6.974 22.278 -10.150 603 1HD ARG 84 1HD ARG 84 8.379 20.768 -11.655 604 2HD ARG 84 2HD ARG 84 9.790 21.692 -11.181 605 HE ARG 84 HE ARG 84 8.779 21.026 -8.741 606 2HH1 ARG 84 1HH ARG 84 9.476 17.647 -8.340 607 1HH2 ARG 84 2HH2 ARG 84 9.329 19.049 -11.630 608 2HH2 ARG 84 1HH2 ARG 84 9.597 17.592 -10.733 609 H ALA 85 H ALA 85 8.255 27.009 -13.110 610 HA ALA 85 HA ALA 85 10.561 26.096 -14.514 611 1HB ALA 85 1HB ALA 85 8.668 27.789 -15.188 612 2HB ALA 85 2HB ALA 85 9.678 28.977 -14.328 613 3HB ALA 85 3HB ALA 85 10.340 28.086 -15.720 614 H ASP 86 H ASP 86 11.399 25.558 -12.083 615 HA ASP 86 HA ASP 86 13.221 27.751 -11.534 616 1HB ASP 86 1HB ASP 86 11.351 26.346 -9.642 617 2HB ASP 86 2HB ASP 86 12.953 26.717 -9.036 618 HD2 ASP 86 HD ASP 86 12.288 28.191 -7.655 619 H GLU 87 H GLU 87 12.267 24.291 -10.982 620 HA GLU 87 HA GLU 87 15.038 23.619 -10.540 621 1HB GLU 87 1HB GLU 87 13.005 22.720 -9.176 622 2HB GLU 87 2HB GLU 87 12.702 21.678 -10.552 623 1HG GLU 87 1HG GLU 87 15.004 20.741 -10.371 624 2HG GLU 87 2HG GLU 87 15.346 21.810 -9.025 625 HE2 GLU 87 HE GLU 87 14.083 18.793 -9.767 626 H GLU 88 H GLU 88 13.357 24.326 -13.211 627 HA GLU 88 HA GLU 88 13.206 22.269 -14.877 628 1HB GLU 88 1HB GLU 88 12.765 24.699 -15.400 629 2HB GLU 88 2HB GLU 88 14.490 24.941 -15.597 630 1HG GLU 88 1HG GLU 88 13.283 22.671 -17.146 631 2HG GLU 88 2HG GLU 88 12.832 24.285 -17.659 632 HE2 GLU 88 HE GLU 88 14.498 25.250 -19.043 633 H GLN 89 H GLN 89 16.254 24.083 -14.106 634 HA GLN 89 HA GLN 89 17.974 22.924 -15.766 635 1HB GLN 89 1HB GLN 89 18.153 24.452 -13.445 636 2HB GLN 89 2HB GLN 89 19.033 23.002 -13.004 637 1HG GLN 89 1HG GLN 89 20.641 23.287 -14.715 638 2HG GLN 89 2HG GLN 89 19.580 24.284 -15.691 639 1HE2 GLN 89 1HE2 GLN 89 19.728 26.407 -15.581 640 2HE2 GLN 89 2HE2 GLN 89 20.625 27.322 -14.415 641 H GLN 90 H GLN 90 17.350 21.616 -12.421 642 HA GLN 90 HA GLN 90 18.755 19.337 -12.654 643 1HB GLN 90 1HB GLN 90 17.176 20.396 -10.738 644 2HB GLN 90 2HB GLN 90 16.081 19.147 -11.297 645 1HG GLN 90 1HG GLN 90 17.316 17.486 -10.341 646 2HG GLN 90 2HG GLN 90 18.816 18.111 -10.996 647 1HE2 GLN 90 1HE2 GLN 90 18.438 17.016 -8.417 648 2HE2 GLN 90 2HE2 GLN 90 18.776 18.231 -7.230 649 H GLN 91 H GLN 91 15.261 19.803 -13.533 650 HA GLN 91 HA GLN 91 14.793 17.236 -14.349 651 1HB GLN 91 1HB GLN 91 13.002 18.873 -14.048 652 2HB GLN 91 2HB GLN 91 13.622 19.865 -15.353 653 1HG GLN 91 1HG GLN 91 13.107 17.044 -16.135 654 2HG GLN 91 2HG GLN 91 11.671 17.909 -15.626 655 1HE2 GLN 91 1HE2 GLN 91 12.037 17.003 -18.204 656 2HE2 GLN 91 2HE2 GLN 91 12.189 18.336 -19.299 657 H ALA 92 H ALA 92 16.550 19.869 -15.942 658 HA ALA 92 HA ALA 92 16.723 18.256 -18.384 659 1HB ALA 92 1HB ALA 92 17.947 20.755 -18.790 660 2HB ALA 92 3HB ALA 92 16.518 21.102 -17.787 661 3HB ALA 92 2HB ALA 92 16.330 20.255 -19.341 662 H LEU 93 H LEU 93 18.087 17.485 -15.913 663 HA LEU 93 HA LEU 93 20.858 18.161 -16.585 664 1HB LEU 93 1HB LEU 93 19.661 18.421 -14.222 665 2HB LEU 93 2HB LEU 93 20.114 16.734 -14.080 666 HG LEU 93 HG LEU 93 21.755 18.263 -13.061 667 1HD1 LEU 93 2HD1 LEU 93 22.569 16.496 -15.353 668 2HD1 LEU 93 3HD1 LEU 93 23.790 17.376 -14.403 669 3HD1 LEU 93 1HD1 LEU 93 22.703 16.217 -13.600 670 1HD2 LEU 93 2HD2 LEU 93 21.338 19.828 -15.325 671 2HD2 LEU 93 3HD2 LEU 93 22.546 20.093 -14.045 672 3HD2 LEU 93 1HD2 LEU 93 22.992 19.200 -15.518 673 H SER 94 H SER 94 20.204 16.646 -18.532 674 HA SER 94 HA SER 94 20.486 13.884 -17.686 675 1HB SER 94 1HB SER 94 18.685 14.863 -19.394 676 2HB SER 94 2HB SER 94 19.994 14.708 -20.548 677 HG SER 94 HG SER 94 20.129 12.458 -20.101 678 H SER 95 H SER 95 22.586 16.223 -17.998 679 HA SER 95 HA SER 95 24.197 15.779 -20.131 680 1HB SER 95 1HB SER 95 24.304 17.293 -17.803 681 2HB SER 95 2HB SER 95 25.669 16.213 -17.596 682 HG SER 95 HG SER 95 25.185 17.824 -19.957 683 H GLN 96 H GLN 96 24.641 14.352 -16.803 684 HA GLN 96 HA GLN 96 26.358 12.361 -17.975 685 1HB GLN 96 1HB GLN 96 26.844 13.607 -15.780 686 2HB GLN 96 2HB GLN 96 25.568 12.654 -15.049 687 1HG GLN 96 1HG GLN 96 26.847 10.754 -14.987 688 2HG GLN 96 2HG GLN 96 27.485 11.012 -16.598 689 1HE2 GLN 96 1HE2 GLN 96 28.985 10.106 -14.426 690 2HE2 GLN 96 2HE2 GLN 96 30.202 11.273 -14.025 691 H MET 97 H MET 97 23.344 12.520 -15.951 692 HA MET 97 HA MET 97 22.836 9.860 -15.821 693 1HB MET 97 1HB MET 97 21.519 12.291 -15.222 694 2HB MET 97 2HB MET 97 20.412 11.494 -16.322 695 1HG MET 97 1HG MET 97 19.817 10.772 -14.089 696 2HG MET 97 2HG MET 97 20.579 9.403 -14.874 697 1HE MET 97 1HE MET 97 21.652 8.002 -13.375 698 2HE MET 97 2HE MET 97 23.095 8.533 -14.272 699 3HE MET 97 3HE MET 97 23.151 8.394 -12.499 700 H GLY 98 H GLY 98 22.449 8.291 -17.321 701 1HA GLY 98 2HA GLY 98 22.241 8.863 -20.070 702 2HA GLY 98 1HA GLY 98 20.639 8.545 -19.437 703 H PHE 99 H PHE 99 20.083 6.475 -19.981 704 HA PHE 99 HA PHE 99 22.017 4.394 -19.263 705 1HB PHE 99 1HB PHE 99 19.693 4.521 -18.176 706 2HB PHE 99 2HB PHE 99 18.981 4.341 -19.767 707 HD1 PHE 99 1HD PHE 99 18.954 2.199 -20.883 708 HD2 PHE 99 2HD PHE 99 20.824 2.632 -17.098 709 HE1 PHE 99 1HE PHE 99 19.023 -0.298 -20.631 710 HE2 PHE 99 2HE PHE 99 20.893 0.135 -16.847 711 HZ PHE 99 HZ PHE 99 19.992 -1.300 -18.616 712 H MET 601 H MET 601 4.842 -20.843 -20.335 713 HA MET 601 HA MET 601 7.476 -20.716 -20.224 714 1HB MET 601 1HB MET 601 6.442 -21.574 -17.612 715 2HB MET 601 2HB MET 601 7.436 -22.843 -18.299 716 1HG MET 601 1HG MET 601 8.287 -19.926 -17.944 717 2HG MET 601 2HG MET 601 8.794 -21.262 -16.929 718 1HE MET 601 1HE MET 601 11.017 -21.097 -17.047 719 2HE MET 601 2HE MET 601 11.087 -22.771 -17.648 720 3HE MET 601 3HE MET 601 12.092 -21.511 -18.404 721 H THR 602 H THR 602 4.996 -23.247 -19.398 722 HA THR 602 HA THR 602 6.153 -25.325 -20.820 723 HB THR 602 HB THR 602 4.048 -25.063 -19.150 724 HG1 THR 602 1HG THR 602 5.053 -27.058 -19.915 725 1HG2 THR 602 1HG2 THR 602 2.754 -23.958 -21.197 726 2HG2 THR 602 2HG2 THR 602 2.656 -25.634 -21.787 727 3HG2 THR 602 3HG2 THR 602 1.937 -25.199 -20.218 728 H GLU 603 H GLU 603 4.099 -22.620 -21.944 729 HA GLU 603 HA GLU 603 4.823 -23.438 -24.630 730 1HB GLU 603 1HB GLU 603 2.032 -23.051 -23.552 731 2HB GLU 603 2HB GLU 603 2.358 -22.580 -25.208 732 1HG GLU 603 1HG GLU 603 3.566 -25.176 -24.708 733 2HG GLU 603 2HG GLU 603 1.891 -25.218 -24.193 734 HE2 GLU 603 HE GLU 603 3.553 -26.024 -26.583 735 H GLN 604 H GLN 604 6.002 -21.749 -25.416 736 HA GLN 604 HA GLN 604 6.132 -19.290 -24.285 737 1HB GLN 604 1HB GLN 604 7.523 -20.502 -26.211 738 2HB GLN 604 2HB GLN 604 6.493 -19.558 -27.270 739 1HG GLN 604 1HG GLN 604 7.503 -17.575 -26.707 740 2HG GLN 604 2HG GLN 604 7.612 -17.993 -25.009 741 1HE2 GLN 604 1HE2 GLN 604 9.714 -17.167 -24.955 742 2HE2 GLN 604 2HE2 GLN 604 11.076 -18.045 -25.567 743 H GLN 605 H GLN 605 3.834 -20.536 -26.723 744 HA GLN 605 HA GLN 605 2.842 -18.181 -27.663 745 1HB GLN 605 1HB GLN 605 1.252 -20.715 -27.067 746 2HB GLN 605 2HB GLN 605 0.796 -19.462 -28.204 747 1HG GLN 605 1HG GLN 605 3.310 -20.018 -29.129 748 2HG GLN 605 2HG GLN 605 2.900 -21.581 -28.452 749 1HE2 GLN 605 1HE2 GLN 605 3.138 -22.080 -30.800 750 2HE2 GLN 605 2HE2 GLN 605 1.727 -22.004 -31.803 751 H TRP 606 H TRP 606 2.195 -19.873 -24.574 752 HA TRP 606 HA TRP 606 0.937 -17.442 -23.599 753 1HB TRP 606 1HB TRP 606 -1.037 -18.447 -22.828 754 2HB TRP 606 2HB TRP 606 -0.886 -18.891 -24.517 755 HD1 TRP 606 HD TRP 606 -0.246 -21.536 -25.019 756 HE1 TRP 606 1HE TRP 606 -0.604 -23.774 -23.666 757 HE3 TRP 606 3HE TRP 606 -1.070 -19.305 -20.524 758 HZ2 TRP 606 2HZ TRP 606 -1.179 -24.347 -20.930 759 HZ3 TRP 606 3HZ TRP 606 -1.522 -20.776 -18.563 760 HH2 TRP 606 HH TRP 606 -1.584 -23.215 -18.714 761 H ASN 607 H ASN 607 2.766 -17.140 -22.261 762 HA ASN 607 HA ASN 607 4.035 -19.175 -20.915 763 1HB ASN 607 1HB ASN 607 3.773 -16.182 -20.374 764 2HB ASN 607 2HB ASN 607 4.758 -17.203 -19.347 765 1HD2 ASN 607 1HD2 ASN 607 6.796 -16.909 -19.809 766 2HD2 ASN 607 2HD2 ASN 607 7.519 -16.850 -21.382 767 H PHE 608 H PHE 608 3.442 -20.325 -19.056 768 HA PHE 608 HA PHE 608 0.907 -19.968 -17.932 769 1HB PHE 608 1HB PHE 608 2.547 -22.020 -18.063 770 2HB PHE 608 2HB PHE 608 3.382 -21.304 -16.698 771 HD1 PHE 608 1HD PHE 608 -0.143 -22.128 -17.646 772 HD2 PHE 608 2HD PHE 608 2.847 -22.161 -14.636 773 HE1 PHE 608 1HE PHE 608 -1.737 -23.264 -16.075 774 HE2 PHE 608 2HE PHE 608 1.254 -23.297 -13.065 775 HZ PHE 608 HZ PHE 608 -1.020 -23.835 -13.803 776 H ALA 609 H ALA 609 4.228 -19.266 -16.631 777 HA ALA 609 HA ALA 609 3.330 -18.216 -14.205 778 1HB ALA 609 1HB ALA 609 5.711 -18.951 -15.155 779 2HB ALA 609 2HB ALA 609 5.840 -17.213 -15.514 780 3HB ALA 609 3HB ALA 609 5.567 -17.758 -13.842 781 H GLY 610 H GLY 610 3.011 -17.049 -17.423 782 1HA GLY 610 2HA GLY 610 2.802 -14.908 -18.264 783 2HA GLY 610 1HA GLY 610 2.996 -14.234 -16.659 784 H ILE 611 H ILE 611 0.718 -16.475 -18.407 785 HA ILE 611 HA ILE 611 -1.488 -14.803 -18.057 786 HB ILE 611 HB ILE 611 -1.201 -16.583 -19.765 787 1HG1 ILE 611 1HG1 ILE 611 -3.436 -15.497 -18.895 788 2HG1 ILE 611 2HG1 ILE 611 -3.457 -16.799 -20.068 789 1HG2 ILE 611 3HG2 ILE 611 -1.420 -18.324 -17.344 790 2HG2 ILE 611 1HG2 ILE 611 -2.131 -18.886 -18.876 791 3HG2 ILE 611 2HG2 ILE 611 -0.397 -18.492 -18.791 792 1HD1 ILE 611 1HD1 ILE 611 -3.652 -17.281 -17.064 793 2HD1 ILE 611 2HD1 ILE 611 -5.071 -17.086 -18.120 794 3HD1 ILE 611 3HD1 ILE 611 -3.957 -18.452 -18.368 795 H GLU 612 H GLU 612 0.082 -17.176 -15.957 796 HA GLU 612 HA GLU 612 -2.129 -17.567 -14.281 797 1HB GLU 612 1HB GLU 612 -0.287 -19.167 -14.329 798 2HB GLU 612 2HB GLU 612 0.863 -17.939 -13.840 799 1HG GLU 612 1HG GLU 612 -0.466 -17.657 -11.680 800 2HG GLU 612 2HG GLU 612 -1.450 -19.023 -12.167 801 HE2 GLU 612 HE GLU 612 0.496 -21.093 -10.632 802 H ALA 613 H ALA 613 0.887 -15.563 -13.909 803 HA ALA 613 HA ALA 613 -0.172 -14.260 -11.595 804 1HB ALA 613 1HB ALA 613 1.928 -13.083 -11.599 805 2HB ALA 613 3HB ALA 613 2.220 -13.489 -13.307 806 3HB ALA 613 2HB ALA 613 2.268 -14.766 -12.068 807 H ALA 614 H ALA 614 -0.570 -13.955 -15.011 808 HA ALA 614 HA ALA 614 -0.735 -11.235 -15.381 809 1HB ALA 614 2HB ALA 614 -2.191 -13.605 -16.588 810 2HB ALA 614 3HB ALA 614 -2.468 -11.942 -17.160 811 3HB ALA 614 1HB ALA 614 -0.844 -12.663 -17.270 812 H ALA 615 H ALA 615 -3.314 -13.552 -14.302 813 HA ALA 615 HA ALA 615 -5.348 -11.705 -14.055 814 1HB ALA 615 3HB ALA 615 -6.487 -13.433 -13.029 815 2HB ALA 615 1HB ALA 615 -5.164 -14.355 -13.782 816 3HB ALA 615 2HB ALA 615 -5.081 -13.928 -12.056 817 H SER 616 H SER 616 -2.915 -12.799 -11.592 818 HA SER 616 HA SER 616 -3.831 -11.293 -9.521 819 1HB SER 616 1HB SER 616 -1.620 -12.926 -10.039 820 2HB SER 616 2HB SER 616 -0.883 -11.376 -9.683 821 HG SER 616 HG SER 616 -1.916 -13.166 -7.942 822 H ALA 617 H ALA 617 -1.898 -10.356 -12.372 823 HA ALA 617 HA ALA 617 -1.087 -7.839 -11.358 824 1HB ALA 617 1HB ALA 617 -0.458 -9.451 -13.515 825 2HB ALA 617 3HB ALA 617 0.082 -7.769 -13.296 826 3HB ALA 617 2HB ALA 617 -1.357 -8.121 -14.282 827 H ILE 618 H ILE 618 -3.927 -9.085 -13.155 828 HA ILE 618 HA ILE 618 -4.969 -6.592 -13.876 829 HB ILE 618 HB ILE 618 -6.303 -9.257 -13.397 830 1HG1 ILE 618 1HG1 ILE 618 -4.559 -9.316 -15.115 831 2HG1 ILE 618 2HG1 ILE 618 -6.154 -9.536 -15.807 832 1HG2 ILE 618 1HG2 ILE 618 -7.932 -7.436 -13.247 833 2HG2 ILE 618 2HG2 ILE 618 -7.380 -6.805 -14.817 834 3HG2 ILE 618 3HG2 ILE 618 -8.165 -8.400 -14.725 835 1HD1 ILE 618 3HD1 ILE 618 -5.614 -6.707 -15.760 836 2HD1 ILE 618 1HD1 ILE 618 -4.200 -7.534 -16.458 837 3HD1 ILE 618 2HD1 ILE 618 -5.813 -7.769 -17.175 838 H GLN 619 H GLN 619 -5.393 -8.664 -10.952 839 HA GLN 619 HA GLN 619 -7.357 -7.140 -9.780 840 1HB GLN 619 1HB GLN 619 -5.548 -9.294 -9.019 841 2HB GLN 619 2HB GLN 619 -5.725 -8.165 -7.690 842 1HG GLN 619 1HG GLN 619 -8.062 -9.405 -9.220 843 2HG GLN 619 2HG GLN 619 -7.458 -10.000 -7.686 844 1HE2 GLN 619 1HE2 GLN 619 -10.040 -8.773 -8.595 845 2HE2 GLN 619 2HE2 GLN 619 -10.378 -7.493 -7.478 846 H GLY 620 H GLY 620 -3.795 -7.118 -9.004 847 1HA GLY 620 2HA GLY 620 -2.443 -5.465 -8.305 848 2HA GLY 620 1HA GLY 620 -3.795 -4.917 -7.335 849 H ASN 621 H ASN 621 -3.861 -5.111 -10.916 850 HA ASN 621 HA ASN 621 -3.193 -2.388 -11.242 851 1HB ASN 621 1HB ASN 621 -4.224 -4.614 -13.026 852 2HB ASN 621 2HB ASN 621 -4.291 -2.969 -13.625 853 1HD2 ASN 621 1HD2 ASN 621 -2.175 -1.694 -13.018 854 2HD2 ASN 621 2HD2 ASN 621 -0.695 -2.464 -13.484 855 H VAL 622 H VAL 622 -6.151 -4.378 -10.916 856 HA VAL 622 HA VAL 622 -7.988 -2.474 -11.856 857 HB VAL 622 HB VAL 622 -8.150 -4.886 -10.060 858 1HG1 VAL 622 2HG1 VAL 622 -10.326 -2.923 -10.780 859 2HG1 VAL 622 3HG1 VAL 622 -10.696 -4.636 -10.468 860 3HG1 VAL 622 1HG1 VAL 622 -9.937 -3.643 -9.200 861 1HG2 VAL 622 3HG2 VAL 622 -7.959 -4.613 -12.810 862 2HG2 VAL 622 1HG2 VAL 622 -8.555 -6.045 -11.937 863 3HG2 VAL 622 2HG2 VAL 622 -9.705 -4.830 -12.543 864 H THR 623 H THR 623 -6.984 -3.386 -8.481 865 HA THR 623 HA THR 623 -8.473 -1.389 -7.221 866 HB THR 623 HB THR 623 -6.941 -1.932 -5.308 867 HG1 THR 623 1HG THR 623 -4.962 -2.108 -6.498 868 1HG2 THR 623 1HG2 THR 623 -8.709 -3.678 -6.279 869 2HG2 THR 623 2HG2 THR 623 -7.251 -4.543 -6.823 870 3HG2 THR 623 3HG2 THR 623 -7.500 -4.220 -5.090 871 H SER 624 H SER 624 -5.238 -1.324 -8.741 872 HA SER 624 HA SER 624 -4.327 0.998 -7.657 873 1HB SER 624 1HB SER 624 -3.889 -0.479 -10.223 874 2HB SER 624 2HB SER 624 -3.339 1.184 -10.193 875 HG SER 624 HG SER 624 -2.003 0.721 -8.389 876 H ILE 625 H ILE 625 -6.357 0.521 -10.631 877 HA ILE 625 HA ILE 625 -6.579 3.291 -11.150 878 HB ILE 625 HB ILE 625 -7.721 0.766 -12.195 879 1HG1 ILE 625 1HG1 ILE 625 -7.170 2.588 -14.247 880 2HG1 ILE 625 2HG1 ILE 625 -5.939 2.908 -13.041 881 1HG2 ILE 625 3HG2 ILE 625 -9.085 3.445 -12.528 882 2HG2 ILE 625 1HG2 ILE 625 -9.312 2.075 -13.641 883 3HG2 ILE 625 2HG2 ILE 625 -9.783 1.920 -11.932 884 1HD1 ILE 625 3HD1 ILE 625 -6.617 0.092 -13.992 885 2HD1 ILE 625 1HD1 ILE 625 -5.349 1.096 -14.736 886 3HD1 ILE 625 2HD1 ILE 625 -5.208 0.601 -13.032 887 H HIS 626 H HIS 626 -8.308 0.965 -9.103 888 HA HIS 626 HA HIS 626 -10.673 2.363 -8.792 889 1HB HIS 626 1HB HIS 626 -10.175 0.019 -8.065 890 2HB HIS 626 2HB HIS 626 -9.249 0.666 -6.725 891 HD1 HIS 626 1HD HIS 626 -10.997 -0.583 -5.140 892 HD2 HIS 626 2HD HIS 626 -12.558 2.573 -7.421 893 HE1 HIS 626 1HE HIS 626 -13.256 -0.004 -4.107 894 H SER 627 H SER 627 -7.604 2.508 -6.860 895 HA SER 627 HA SER 627 -8.640 4.646 -5.306 896 1HB SER 627 1HB SER 627 -6.141 3.021 -5.414 897 2HB SER 627 2HB SER 627 -5.939 4.651 -4.803 898 HG SER 627 HG SER 627 -7.395 2.468 -3.704 899 H LEU 628 H LEU 628 -6.222 4.225 -7.965 900 HA LEU 628 HA LEU 628 -5.133 6.688 -8.102 901 1HB LEU 628 1HB LEU 628 -5.795 4.567 -10.052 902 2HB LEU 628 2HB LEU 628 -5.458 6.146 -10.732 903 HG LEU 628 HG LEU 628 -3.566 4.884 -8.753 904 1HD1 LEU 628 3HD1 LEU 628 -4.133 3.989 -11.487 905 2HD1 LEU 628 1HD1 LEU 628 -2.421 4.384 -11.202 906 3HD1 LEU 628 2HD1 LEU 628 -3.242 3.187 -10.171 907 1HD2 LEU 628 2HD2 LEU 628 -3.353 7.299 -9.332 908 2HD2 LEU 628 3HD2 LEU 628 -1.924 6.323 -9.750 909 3HD2 LEU 628 1HD2 LEU 628 -3.062 6.825 -11.023 910 H LEU 629 H LEU 629 -8.252 5.695 -9.681 911 HA LEU 629 HA LEU 629 -8.900 8.138 -10.738 912 1HB LEU 629 1HB LEU 629 -10.161 5.622 -10.237 913 2HB LEU 629 2HB LEU 629 -11.276 6.900 -9.797 914 HG LEU 629 HG LEU 629 -11.481 6.065 -12.148 915 1HD1 LEU 629 1HD1 LEU 629 -11.180 8.896 -11.332 916 2HD1 LEU 629 2HD1 LEU 629 -11.214 8.581 -13.084 917 3HD1 LEU 629 3HD1 LEU 629 -12.564 8.041 -12.057 918 1HD2 LEU 629 1HD2 LEU 629 -8.660 6.568 -12.163 919 2HD2 LEU 629 2HD2 LEU 629 -9.679 5.814 -13.413 920 3HD2 LEU 629 3HD2 LEU 629 -9.441 7.578 -13.404 921 H ASP 630 H ASP 630 -9.446 6.876 -7.403 922 HA ASP 630 HA ASP 630 -10.920 9.077 -6.566 923 1HB ASP 630 1HB ASP 630 -9.452 6.800 -5.300 924 2HB ASP 630 2HB ASP 630 -9.697 8.191 -4.262 925 HD2 ASP 630 HD ASP 630 -12.902 8.427 -4.556 926 H GLU 631 H GLU 631 -7.455 8.395 -6.963 927 HA GLU 631 HA GLU 631 -6.580 10.470 -5.256 928 1HB GLU 631 1HB GLU 631 -5.397 8.367 -6.898 929 2HB GLU 631 2HB GLU 631 -4.526 9.871 -7.121 930 1HG GLU 631 1HG GLU 631 -4.152 10.097 -4.715 931 2HG GLU 631 2HG GLU 631 -5.222 8.753 -4.367 932 HE2 GLU 631 HE GLU 631 -3.113 6.308 -5.012 933 H GLY 632 H GLY 632 -7.096 10.076 -8.805 934 1HA GLY 632 2HA GLY 632 -7.025 11.566 -10.499 935 2HA GLY 632 1HA GLY 632 -6.072 12.643 -9.497 936 H LYS 633 H LYS 633 -9.310 11.301 -8.664 937 HA LYS 633 HA LYS 633 -10.850 13.418 -9.550 938 1HB LYS 633 1HB LYS 633 -11.546 11.103 -8.694 939 2HB LYS 633 2HB LYS 633 -11.440 11.777 -7.080 940 1HG LYS 633 1HG LYS 633 -13.736 12.029 -7.788 941 2HG LYS 633 2HG LYS 633 -13.022 13.629 -7.818 942 1HD LYS 633 1HD LYS 633 -12.457 12.756 -10.380 943 2HD LYS 633 2HD LYS 633 -13.977 11.938 -10.078 944 1HE LYS 633 1HE LYS 633 -14.929 14.197 -9.316 945 2HE LYS 633 2HE LYS 633 -13.448 14.938 -9.888 946 H GLN 634 H GLN 634 -8.820 13.041 -6.643 947 HA GLN 634 HA GLN 634 -9.906 15.216 -5.273 948 1HB GLN 634 1HB GLN 634 -7.266 13.728 -5.107 949 2HB GLN 634 2HB GLN 634 -7.584 15.112 -4.080 950 1HG GLN 634 1HG GLN 634 -9.826 13.883 -3.476 951 2HG GLN 634 2HG GLN 634 -9.069 12.462 -4.169 952 1HE2 GLN 634 1HE2 GLN 634 -9.811 13.576 -1.372 953 2HE2 GLN 634 2HE2 GLN 634 -8.435 13.205 -0.387 954 H SER 635 H SER 635 -7.670 14.924 -7.970 955 HA SER 635 HA SER 635 -6.596 17.544 -7.555 956 1HB SER 635 1HB SER 635 -5.852 15.209 -9.021 957 2HB SER 635 2HB SER 635 -6.095 16.473 -10.210 958 HG SER 635 HG SER 635 -4.747 17.704 -8.315 959 H LEU 636 H LEU 636 -9.039 15.873 -9.577 960 HA LEU 636 HA LEU 636 -9.512 17.657 -11.544 961 1HB LEU 636 1HB LEU 636 -11.014 15.616 -10.116 962 2HB LEU 636 2HB LEU 636 -12.052 16.899 -10.706 963 HG LEU 636 HG LEU 636 -11.740 14.899 -12.225 964 1HD1 LEU 636 2HD1 LEU 636 -11.611 17.753 -12.914 965 2HD1 LEU 636 3HD1 LEU 636 -11.072 16.660 -14.212 966 3HD1 LEU 636 1HD1 LEU 636 -12.694 16.470 -13.503 967 1HD2 LEU 636 3HD2 LEU 636 -9.133 15.039 -11.718 968 2HD2 LEU 636 1HD2 LEU 636 -9.771 14.390 -13.248 969 3HD2 LEU 636 2HD2 LEU 636 -9.164 16.061 -13.175 970 H THR 637 H THR 637 -10.812 17.816 -8.163 971 HA THR 637 HA THR 637 -12.159 20.262 -8.579 972 HB THR 637 HB THR 637 -12.916 18.962 -6.750 973 HG1 THR 637 1HG THR 637 -12.465 20.434 -5.058 974 1HG2 THR 637 1HG2 THR 637 -9.952 18.560 -6.189 975 2HG2 THR 637 2HG2 THR 637 -11.149 18.358 -4.888 976 3HG2 THR 637 3HG2 THR 637 -11.228 17.328 -6.337 977 H LYS 638 H LYS 638 -8.794 19.433 -7.883 978 HA LYS 638 HA LYS 638 -8.146 22.075 -6.998 979 1HB LYS 638 1HB LYS 638 -6.323 19.812 -7.865 980 2HB LYS 638 2HB LYS 638 -5.853 21.249 -6.980 981 1HG LYS 638 1HG LYS 638 -7.113 20.597 -5.033 982 2HG LYS 638 2HG LYS 638 -8.003 19.375 -5.918 983 1HD LYS 638 1HD LYS 638 -6.362 17.813 -5.637 984 2HD LYS 638 2HD LYS 638 -5.096 18.937 -6.089 985 1HE LYS 638 1HE LYS 638 -5.220 17.987 -3.608 986 2HE LYS 638 2HE LYS 638 -4.734 19.646 -3.893 987 H LEU 639 H LEU 639 -8.108 20.224 -10.061 988 HA LEU 639 HA LEU 639 -6.801 22.418 -11.421 989 1HB LEU 639 1HB LEU 639 -7.777 19.700 -12.287 990 2HB LEU 639 2HB LEU 639 -7.146 20.887 -13.411 991 HG LEU 639 HG LEU 639 -5.257 19.673 -13.046 992 1HD1 LEU 639 3HD1 LEU 639 -4.919 22.056 -12.276 993 2HD1 LEU 639 1HD1 LEU 639 -5.020 21.445 -10.607 994 3HD1 LEU 639 2HD1 LEU 639 -3.727 20.871 -11.689 995 1HD2 LEU 639 2HD2 LEU 639 -6.608 18.313 -11.232 996 2HD2 LEU 639 3HD2 LEU 639 -4.833 18.220 -11.328 997 3HD2 LEU 639 1HD2 LEU 639 -5.605 19.257 -10.104 998 H ALA 640 H ALA 640 -9.955 21.551 -10.413 999 HA ALA 640 HA ALA 640 -11.612 22.150 -12.461 1000 1HB ALA 640 1HB ALA 640 -12.247 21.470 -10.142 1001 2HB ALA 640 3HB ALA 640 -13.207 22.841 -10.747 1002 3HB ALA 640 2HB ALA 640 -11.886 23.122 -9.588 1003 H ALA 641 H ALA 641 -9.724 24.441 -10.418 1004 HA ALA 641 HA ALA 641 -10.873 26.776 -11.443 1005 1HB ALA 641 1HB ALA 641 -8.907 27.864 -10.456 1006 2HB ALA 641 2HB ALA 641 -9.533 26.610 -9.358 1007 3HB ALA 641 3HB ALA 641 -8.078 26.293 -10.333 1008 H ALA 642 H ALA 642 -8.378 24.546 -12.651 1009 HA ALA 642 HA ALA 642 -7.089 26.171 -14.456 1010 1HB ALA 642 1HB ALA 642 -6.829 23.630 -13.725 1011 2HB ALA 642 3HB ALA 642 -6.243 24.188 -15.310 1012 3HB ALA 642 2HB ALA 642 -7.803 23.342 -15.187 1013 H TRP 643 H TRP 643 -10.276 24.521 -14.670 1014 HA TRP 643 HA TRP 643 -10.640 25.258 -17.410 1015 1HB TRP 643 1HB TRP 643 -12.397 24.032 -15.294 1016 2HB TRP 643 2HB TRP 643 -13.034 24.513 -16.854 1017 HD1 TRP 643 HD TRP 643 -12.522 22.884 -18.910 1018 HE1 TRP 643 1HE TRP 643 -11.378 20.530 -19.245 1019 HE3 TRP 643 3HE TRP 643 -10.412 22.666 -14.289 1020 HZ2 TRP 643 2HZ TRP 643 -9.756 18.877 -17.576 1021 HZ3 TRP 643 3HZ TRP 643 -9.064 20.648 -13.722 1022 HH2 TRP 643 HH TRP 643 -8.721 18.795 -15.278 1023 H GLY 644 H GLY 644 -11.061 26.696 -14.228 1024 1HA GLY 644 2HA GLY 644 -12.971 28.685 -15.150 1025 2HA GLY 644 1HA GLY 644 -11.336 29.262 -14.898 1026 H GLY 645 H GLY 645 -13.378 26.820 -13.135 1027 1HA GLY 645 2HA GLY 645 -14.031 28.356 -10.934 1028 2HA GLY 645 1HA GLY 645 -12.449 27.686 -10.590 1029 H SER 646 H SER 646 -13.778 26.601 -8.802 1030 HA SER 646 HA SER 646 -14.473 23.987 -9.771 1031 1HB SER 646 1HB SER 646 -14.671 23.552 -7.216 1032 2HB SER 646 2HB SER 646 -13.079 23.875 -7.873 1033 HG SER 646 HG SER 646 -12.957 25.719 -6.768 1034 H GLY 647 H GLY 647 -16.492 24.710 -10.874 1035 1HA GLY 647 2HA GLY 647 -18.628 25.778 -9.248 1036 2HA GLY 647 1HA GLY 647 -18.808 24.080 -9.640 1037 H SER 648 H SER 648 -17.049 26.230 -11.851 1038 HA SER 648 HA SER 648 -19.201 27.081 -13.358 1039 1HB SER 648 1HB SER 648 -16.273 27.029 -13.576 1040 2HB SER 648 2HB SER 648 -17.034 26.832 -15.142 1041 HG SER 648 HG SER 648 -16.603 29.112 -14.266 1042 H GLU 649 H GLU 649 -20.192 26.256 -15.279 1043 HA GLU 649 HA GLU 649 -20.619 23.590 -15.384 1044 1HB GLU 649 1HB GLU 649 -22.056 25.216 -16.513 1045 2HB GLU 649 2HB GLU 649 -20.772 25.654 -17.622 1046 1HG GLU 649 1HG GLU 649 -20.980 22.842 -17.866 1047 2HG GLU 649 2HG GLU 649 -22.640 23.393 -17.748 1048 HE2 GLU 649 HE GLU 649 -21.932 22.458 -20.137 1049 H ALA 650 H ALA 650 -17.978 25.488 -16.839 1050 HA ALA 650 HA ALA 650 -17.074 23.713 -18.737 1051 1HB ALA 650 2HB ALA 650 -16.054 25.996 -17.190 1052 2HB ALA 650 1HB ALA 650 -15.809 25.577 -18.902 1053 3HB ALA 650 3HB ALA 650 -14.780 24.842 -17.650 1054 H TYR 651 H TYR 651 -15.433 24.108 -15.528 1055 HA TYR 651 HA TYR 651 -14.085 21.735 -15.580 1056 1HB TYR 651 1HB TYR 651 -13.572 23.302 -13.844 1057 2HB TYR 651 2HB TYR 651 -15.262 23.636 -13.525 1058 HD1 TYR 651 1HD TYR 651 -12.925 20.696 -13.322 1059 HD2 TYR 651 2HD TYR 651 -16.084 22.920 -11.483 1060 HE1 TYR 651 1HE TYR 651 -12.861 19.140 -11.313 1061 HE2 TYR 651 2HE TYR 651 -16.008 21.356 -9.480 1062 HH TYR 651 HH TYR 651 -13.520 18.873 -9.224 1063 H GLN 652 H GLN 652 -17.499 22.352 -14.730 1064 HA GLN 652 HA GLN 652 -17.985 20.009 -13.379 1065 1HB GLN 652 1HB GLN 652 -19.751 21.795 -15.089 1066 2HB GLN 652 2HB GLN 652 -20.398 20.392 -14.262 1067 1HG GLN 652 1HG GLN 652 -18.828 21.753 -12.317 1068 2HG GLN 652 2HG GLN 652 -19.699 23.012 -13.170 1069 1HE2 GLN 652 1HE2 GLN 652 -21.654 23.466 -12.516 1070 2HE2 GLN 652 2HE2 GLN 652 -22.719 22.449 -11.603 1071 H GLY 653 H GLY 653 -18.427 20.764 -16.909 1072 1HA GLY 653 2HA GLY 653 -18.438 19.432 -18.718 1073 2HA GLY 653 1HA GLY 653 -19.318 18.276 -17.738 1074 H VAL 654 H VAL 654 -16.105 19.318 -16.678 1075 HA VAL 654 HA VAL 654 -14.762 17.145 -17.992 1076 HB VAL 654 HB VAL 654 -13.962 19.288 -16.030 1077 1HG1 VAL 654 1HG1 VAL 654 -12.729 17.095 -15.646 1078 2HG1 VAL 654 2HG1 VAL 654 -12.050 17.299 -17.279 1079 3HG1 VAL 654 3HG1 VAL 654 -11.718 18.512 -16.019 1080 1HG2 VAL 654 2HG2 VAL 654 -14.220 19.231 -18.831 1081 2HG2 VAL 654 3HG2 VAL 654 -13.440 20.486 -17.839 1082 3HG2 VAL 654 1HG2 VAL 654 -12.471 19.152 -18.509 1083 H GLN 655 H GLN 655 -16.006 17.965 -14.718 1084 HA GLN 655 HA GLN 655 -14.847 15.882 -13.366 1085 1HB GLN 655 1HB GLN 655 -17.067 17.769 -12.953 1086 2HB GLN 655 2HB GLN 655 -17.361 16.231 -12.165 1087 1HG GLN 655 1HG GLN 655 -14.596 16.956 -11.718 1088 2HG GLN 655 2HG GLN 655 -15.593 18.345 -11.332 1089 1HE2 GLN 655 1HE2 GLN 655 -14.106 16.865 -9.477 1090 2HE2 GLN 655 2HE2 GLN 655 -15.176 16.105 -8.347 1091 H GLN 656 H GLN 656 -18.047 16.039 -15.067 1092 HA GLN 656 HA GLN 656 -18.746 13.420 -14.425 1093 1HB GLN 656 1HB GLN 656 -20.517 13.702 -16.097 1094 2HB GLN 656 2HB GLN 656 -20.364 15.164 -15.143 1095 1HG GLN 656 1HG GLN 656 -18.740 15.982 -17.035 1096 2HG GLN 656 2HG GLN 656 -19.413 14.675 -17.988 1097 1HE2 GLN 656 1HE2 GLN 656 -20.402 17.362 -15.878 1098 2HE2 GLN 656 2HE2 GLN 656 -21.795 17.854 -16.782 1099 H LYS 657 H LYS 657 -17.053 14.906 -17.238 1100 HA LYS 657 HA LYS 657 -16.986 12.589 -18.806 1101 1HB LYS 657 1HB LYS 657 -15.392 15.146 -18.740 1102 2HB LYS 657 2HB LYS 657 -14.964 13.852 -19.840 1103 1HG LYS 657 1HG LYS 657 -17.332 13.856 -20.717 1104 2HG LYS 657 2HG LYS 657 -17.698 15.206 -19.662 1105 1HD LYS 657 1HD LYS 657 -15.268 15.665 -21.283 1106 2HD LYS 657 2HD LYS 657 -16.689 15.385 -22.270 1107 1HE LYS 657 1HE LYS 657 -17.873 17.115 -20.685 1108 2HE LYS 657 2HE LYS 657 -16.252 17.555 -20.185 1109 H TRP 658 H TRP 658 -15.140 13.661 -15.991 1110 HA TRP 658 HA TRP 658 -12.954 11.889 -16.428 1111 1HB TRP 658 1HB TRP 658 -12.490 13.786 -15.144 1112 2HB TRP 658 2HB TRP 658 -13.907 13.578 -14.134 1113 HD1 TRP 658 HD TRP 658 -13.665 11.896 -12.032 1114 HE1 TRP 658 1HE TRP 658 -11.658 10.710 -10.797 1115 HE3 TRP 658 3HE TRP 658 -10.232 12.730 -15.690 1116 HZ2 TRP 658 2HZ TRP 658 -8.921 10.263 -11.472 1117 HZ3 TRP 658 3HZ TRP 658 -7.916 11.886 -15.323 1118 HH2 TRP 658 HH TRP 658 -7.239 10.690 -13.302 1119 H ASP 659 H ASP 659 -15.824 11.940 -14.188 1120 HA ASP 659 HA ASP 659 -15.343 9.411 -13.175 1121 1HB ASP 659 1HB ASP 659 -17.259 11.483 -12.862 1122 2HB ASP 659 2HB ASP 659 -18.196 10.077 -13.323 1123 HD2 ASP 659 HD ASP 659 -18.317 11.294 -10.857 1124 H ALA 660 H ALA 660 -16.834 10.618 -16.152 1125 HA ALA 660 HA ALA 660 -18.524 8.548 -16.819 1126 1HB ALA 660 3HB ALA 660 -18.719 10.290 -18.290 1127 2HB ALA 660 1HB ALA 660 -16.980 10.668 -18.239 1128 3HB ALA 660 2HB ALA 660 -17.569 9.316 -19.236 1129 H THR 661 H THR 661 -15.535 8.866 -18.756 1130 HA THR 661 HA THR 661 -15.310 6.177 -19.293 1131 HB THR 661 HB THR 661 -13.073 6.810 -20.110 1132 HG1 THR 661 1HG THR 661 -12.362 7.976 -18.232 1133 1HG2 THR 661 3HG2 THR 661 -15.275 8.034 -21.060 1134 2HG2 THR 661 1HG2 THR 661 -14.519 9.458 -20.306 1135 3HG2 THR 661 2HG2 THR 661 -13.652 8.556 -21.572 1136 H ALA 662 H ALA 662 -14.491 7.910 -16.354 1137 HA ALA 662 HA ALA 662 -12.537 6.243 -15.332 1138 1HB ALA 662 3HB ALA 662 -12.850 8.142 -14.068 1139 2HB ALA 662 2HB ALA 662 -13.815 7.002 -13.100 1140 3HB ALA 662 1HB ALA 662 -14.621 8.101 -14.244 1141 H THR 663 H THR 663 -15.870 6.170 -13.960 1142 HA THR 663 HA THR 663 -15.748 3.631 -12.979 1143 HB THR 663 HB THR 663 -17.567 5.026 -12.321 1144 HG1 THR 663 1HG THR 663 -18.671 3.315 -14.424 1145 1HG2 THR 663 3HG2 THR 663 -17.570 5.798 -15.141 1146 2HG2 THR 663 1HG2 THR 663 -19.202 5.291 -14.643 1147 3HG2 THR 663 2HG2 THR 663 -18.371 6.601 -13.770 1148 H GLU 664 H GLU 664 -16.081 4.623 -16.342 1149 HA GLU 664 HA GLU 664 -17.205 2.248 -17.264 1150 1HB GLU 664 1HB GLU 664 -17.202 4.308 -18.599 1151 2HB GLU 664 2HB GLU 664 -15.451 4.315 -18.660 1152 1HG GLU 664 1HG GLU 664 -16.258 3.402 -20.762 1153 2HG GLU 664 2HG GLU 664 -15.520 2.092 -19.862 1154 HE2 GLU 664 HE GLU 664 -18.499 0.447 -20.633 1155 H LEU 665 H LEU 665 -13.772 3.391 -17.015 1156 HA LEU 665 HA LEU 665 -12.783 0.874 -17.968 1157 1HB LEU 665 1HB LEU 665 -11.759 3.154 -18.349 1158 2HB LEU 665 2HB LEU 665 -11.255 3.127 -16.671 1159 HG LEU 665 HG LEU 665 -9.424 2.483 -18.119 1160 1HD1 LEU 665 2HD1 LEU 665 -10.139 1.208 -15.839 1161 2HD1 LEU 665 3HD1 LEU 665 -10.019 -0.170 -16.959 1162 3HD1 LEU 665 1HD1 LEU 665 -8.623 0.909 -16.724 1163 1HD2 LEU 665 2HD2 LEU 665 -11.261 0.283 -19.098 1164 2HD2 LEU 665 3HD2 LEU 665 -10.602 1.643 -20.038 1165 3HD2 LEU 665 1HD2 LEU 665 -9.515 0.370 -19.431 1166 H ASN 666 H ASN 666 -13.771 2.277 -14.919 1167 HA ASN 666 HA ASN 666 -12.130 0.669 -13.305 1168 1HB ASN 666 1HB ASN 666 -13.841 2.830 -12.898 1169 2HB ASN 666 2HB ASN 666 -14.764 1.519 -12.190 1170 1HD2 ASN 666 1HD2 ASN 666 -13.102 3.896 -11.197 1171 2HD2 ASN 666 2HD2 ASN 666 -12.119 3.248 -9.926 1172 H ASN 667 H ASN 667 -15.620 0.586 -14.340 1173 HA ASN 667 HA ASN 667 -16.240 -1.753 -12.996 1174 1HB ASN 667 1HB ASN 667 -18.308 -1.653 -14.170 1175 2HB ASN 667 2HB ASN 667 -17.790 0.021 -14.156 1176 1HD2 ASN 667 1HD2 ASN 667 -17.955 1.039 -15.990 1177 2HD2 ASN 667 2HD2 ASN 667 -17.850 0.370 -17.584 1178 H ALA 668 H ALA 668 -14.955 -1.014 -16.280 1179 HA ALA 668 HA ALA 668 -15.250 -3.577 -17.369 1180 1HB ALA 668 3HB ALA 668 -14.721 -1.258 -18.453 1181 2HB ALA 668 2HB ALA 668 -13.993 -2.722 -19.156 1182 3HB ALA 668 1HB ALA 668 -13.025 -1.666 -18.099 1183 H LEU 669 H LEU 669 -12.706 -2.018 -15.368 1184 HA LEU 669 HA LEU 669 -10.829 -4.097 -15.680 1185 1HB LEU 669 1HB LEU 669 -11.137 -1.630 -14.146 1186 2HB LEU 669 2HB LEU 669 -10.297 -2.883 -13.254 1187 HG LEU 669 HG LEU 669 -9.468 -2.153 -16.060 1188 1HD1 LEU 669 1HD1 LEU 669 -9.578 -0.118 -14.526 1189 2HD1 LEU 669 2HD1 LEU 669 -8.264 -0.883 -13.601 1190 3HD1 LEU 669 3HD1 LEU 669 -8.019 -0.461 -15.313 1191 1HD2 LEU 669 2HD2 LEU 669 -8.694 -4.241 -14.615 1192 2HD2 LEU 669 3HD2 LEU 669 -7.571 -3.354 -15.673 1193 3HD2 LEU 669 1HD2 LEU 669 -7.584 -3.034 -13.922 1194 H GLN 670 H GLN 670 -13.412 -3.394 -13.257 1195 HA GLN 670 HA GLN 670 -12.759 -5.495 -11.576 1196 1HB GLN 670 1HB GLN 670 -15.166 -3.760 -12.036 1197 2HB GLN 670 2HB GLN 670 -15.409 -5.223 -11.103 1198 1HG GLN 670 1HG GLN 670 -13.007 -4.094 -10.088 1199 2HG GLN 670 2HG GLN 670 -14.086 -2.733 -10.318 1200 1HE2 GLN 670 1HE2 GLN 670 -13.082 -4.918 -8.155 1201 2HE2 GLN 670 2HE2 GLN 670 -14.463 -5.066 -7.120 1202 H ASN 671 H ASN 671 -15.244 -5.258 -14.218 1203 HA ASN 671 HA ASN 671 -16.158 -7.836 -13.965 1204 1HB ASN 671 1HB ASN 671 -16.699 -5.645 -15.607 1205 2HB ASN 671 2HB ASN 671 -16.033 -6.791 -16.754 1206 1HD2 ASN 671 1HD2 ASN 671 -17.606 -7.742 -17.791 1207 2HD2 ASN 671 2HD2 ASN 671 -19.054 -8.414 -17.119 1208 H LEU 672 H LEU 672 -13.297 -6.418 -15.555 1209 HA LEU 672 HA LEU 672 -12.705 -8.699 -17.151 1210 1HB LEU 672 1HB LEU 672 -11.931 -6.653 -17.955 1211 2HB LEU 672 2HB LEU 672 -11.280 -6.168 -16.403 1212 HG LEU 672 HG LEU 672 -9.966 -8.579 -17.316 1213 1HD1 LEU 672 3HD1 LEU 672 -10.764 -7.105 -19.483 1214 2HD1 LEU 672 1HD1 LEU 672 -9.147 -6.439 -19.154 1215 3HD1 LEU 672 2HD1 LEU 672 -9.350 -8.186 -19.432 1216 1HD2 LEU 672 1HD2 LEU 672 -9.328 -6.569 -15.690 1217 2HD2 LEU 672 2HD2 LEU 672 -8.100 -7.546 -16.529 1218 3HD2 LEU 672 3HD2 LEU 672 -8.564 -5.954 -17.176 1219 H ALA 673 H ALA 673 -11.570 -7.395 -13.976 1220 HA ALA 673 HA ALA 673 -9.738 -9.534 -13.585 1221 1HB ALA 673 3HB ALA 673 -10.158 -7.027 -12.509 1222 2HB ALA 673 1HB ALA 673 -10.738 -8.094 -11.208 1223 3HB ALA 673 2HB ALA 673 -9.078 -8.267 -11.826 1224 H ARG 674 H ARG 674 -13.183 -9.162 -13.327 1225 HA ARG 674 HA ARG 674 -13.548 -10.995 -11.233 1226 1HB ARG 674 1HB ARG 674 -15.293 -9.654 -13.296 1227 2HB ARG 674 2HB ARG 674 -15.947 -11.071 -12.498 1228 1HG ARG 674 1HG ARG 674 -14.834 -9.598 -10.380 1229 2HG ARG 674 2HG ARG 674 -15.498 -8.357 -11.425 1230 1HD ARG 674 1HD ARG 674 -17.221 -10.771 -10.885 1231 2HD ARG 674 2HD ARG 674 -17.001 -9.632 -9.571 1232 HE ARG 674 HE ARG 674 -17.665 -8.293 -12.075 1233 2HH1 ARG 674 1HH ARG 674 -20.969 -7.654 -11.217 1234 1HH2 ARG 674 2HH2 ARG 674 -19.060 -9.996 -9.298 1235 2HH2 ARG 674 1HH2 ARG 674 -20.610 -9.239 -9.455 1236 H THR 675 H THR 675 -13.139 -11.193 -14.759 1237 HA THR 675 HA THR 675 -13.724 -14.075 -14.653 1238 HB THR 675 HB THR 675 -13.564 -12.154 -17.035 1239 HG1 THR 675 1HG THR 675 -15.363 -11.712 -15.598 1240 1HG2 THR 675 1HG2 THR 675 -13.346 -14.822 -17.258 1241 2HG2 THR 675 2HG2 THR 675 -15.097 -14.762 -16.943 1242 3HG2 THR 675 3HG2 THR 675 -14.417 -13.910 -18.350 1243 H ILE 676 H ILE 676 -11.184 -11.819 -14.560 1244 HA ILE 676 HA ILE 676 -9.364 -13.614 -15.962 1245 HB ILE 676 HB ILE 676 -9.249 -10.767 -15.039 1246 1HG1 ILE 676 1HG1 ILE 676 -8.919 -12.215 -17.670 1247 2HG1 ILE 676 2HG1 ILE 676 -10.137 -11.037 -17.223 1248 1HG2 ILE 676 3HG2 ILE 676 -7.035 -12.631 -14.994 1249 2HG2 ILE 676 1HG2 ILE 676 -6.759 -11.337 -16.184 1250 3HG2 ILE 676 2HG2 ILE 676 -7.104 -10.926 -14.487 1251 1HD1 ILE 676 3HD1 ILE 676 -7.975 -9.491 -16.794 1252 2HD1 ILE 676 1HD1 ILE 676 -7.260 -10.609 -17.980 1253 3HD1 ILE 676 2HD1 ILE 676 -8.701 -9.656 -18.411 1254 H SER 677 H SER 677 -9.737 -11.943 -12.760 1255 HA SER 677 HA SER 677 -7.649 -12.987 -11.468 1256 1HB SER 677 1HB SER 677 -8.945 -12.728 -9.392 1257 2HB SER 677 2HB SER 677 -9.267 -11.394 -10.482 1258 HG SER 677 HG SER 677 -11.311 -11.942 -10.000 1259 H GLU 678 H GLU 678 -10.578 -14.667 -12.548 1260 HA GLU 678 HA GLU 678 -10.345 -16.876 -10.862 1261 1HB GLU 678 1HB GLU 678 -11.729 -17.966 -12.826 1262 2HB GLU 678 2HB GLU 678 -12.448 -16.697 -11.854 1263 1HG GLU 678 1HG GLU 678 -12.462 -15.189 -13.587 1264 2HG GLU 678 2HG GLU 678 -10.883 -15.681 -14.165 1265 HE2 GLU 678 HE GLU 678 -13.907 -16.274 -16.051 1266 H ALA 679 H ALA 679 -8.715 -15.895 -13.842 1267 HA ALA 679 HA ALA 679 -7.903 -18.278 -14.891 1268 1HB ALA 679 3HB ALA 679 -5.964 -15.985 -14.635 1269 2HB ALA 679 1HB ALA 679 -6.326 -17.011 -16.044 1270 3HB ALA 679 2HB ALA 679 -7.480 -15.753 -15.539 1271 H GLY 680 H GLY 680 -7.086 -16.833 -11.798 1272 1HA GLY 680 2HA GLY 680 -5.843 -17.579 -10.081 1273 2HA GLY 680 1HA GLY 680 -4.600 -17.926 -11.267 1274 H GLN 681 H GLN 681 -7.519 -19.253 -9.633 1275 HA GLN 681 HA GLN 681 -6.444 -21.899 -10.232 1276 1HB GLN 681 1HB GLN 681 -7.033 -20.652 -7.719 1277 2HB GLN 681 2HB GLN 681 -8.214 -21.927 -7.942 1278 1HG GLN 681 1HG GLN 681 -5.740 -23.043 -8.795 1279 2HG GLN 681 2HG GLN 681 -5.361 -22.145 -7.339 1280 1HE2 GLN 681 1HE2 GLN 681 -5.788 -25.084 -8.185 1281 2HE2 GLN 681 2HE2 GLN 681 -6.755 -25.762 -6.918 1282 H ALA 682 H ALA 682 -9.366 -19.842 -9.856 1283 HA ALA 682 HA ALA 682 -11.400 -21.554 -10.126 1284 1HB ALA 682 3HB ALA 682 -10.811 -18.796 -11.071 1285 2HB ALA 682 1HB ALA 682 -12.190 -19.602 -11.857 1286 3HB ALA 682 2HB ALA 682 -12.164 -19.406 -10.088 1287 H MET 683 H MET 683 -9.835 -20.056 -13.051 1288 HA MET 683 HA MET 683 -10.962 -21.428 -14.975 1289 1HB MET 683 1HB MET 683 -8.394 -20.141 -14.530 1290 2HB MET 683 2HB MET 683 -8.112 -21.574 -15.499 1291 1HG MET 683 1HG MET 683 -10.297 -19.558 -16.185 1292 2HG MET 683 2HG MET 683 -8.659 -19.399 -16.787 1293 1HE MET 683 3HE MET 683 -11.846 -20.144 -17.800 1294 2HE MET 683 1HE MET 683 -11.927 -21.716 -18.631 1295 3HE MET 683 2HE MET 683 -11.944 -21.648 -16.853 1296 H ALA 684 H ALA 684 -8.681 -22.786 -12.602 1297 HA ALA 684 HA ALA 684 -8.466 -25.271 -14.066 1298 1HB ALA 684 1HB ALA 684 -6.883 -25.872 -12.374 1299 2HB ALA 684 2HB ALA 684 -6.593 -24.155 -12.739 1300 3HB ALA 684 3HB ALA 684 -7.482 -24.613 -11.267 1301 H SER 685 H SER 685 -11.157 -24.595 -13.540 1302 HA SER 685 HA SER 685 -11.762 -26.517 -11.429 1303 1HB SER 685 1HB SER 685 -13.029 -23.887 -12.164 1304 2HB SER 685 2HB SER 685 -14.079 -25.154 -11.561 1305 HG SER 685 HG SER 685 -13.265 -24.938 -9.578 1306 H THR 686 H THR 686 -13.936 -24.951 -13.844 1307 HA THR 686 HA THR 686 -13.915 -26.897 -15.799 1308 HB THR 686 HB THR 686 -15.474 -27.598 -13.328 1309 HG1 THR 686 1HG THR 686 -13.522 -28.644 -14.473 1310 1HG2 THR 686 3HG2 THR 686 -17.225 -27.159 -15.186 1311 2HG2 THR 686 1HG2 THR 686 -16.412 -28.445 -16.110 1312 3HG2 THR 686 2HG2 THR 686 -17.174 -28.819 -14.545 1313 H GLU 687 H GLU 687 -15.551 -26.567 -17.414 1314 HA GLU 687 HA GLU 687 -16.264 -23.915 -17.619 1315 1HB GLU 687 1HB GLU 687 -17.502 -24.599 -19.624 1316 2HB GLU 687 2HB GLU 687 -15.978 -25.460 -19.544 1317 1HG GLU 687 1HG GLU 687 -17.234 -27.341 -19.849 1318 2HG GLU 687 2HG GLU 687 -17.626 -27.186 -18.148 1319 HE2 GLU 687 HE GLU 687 -19.758 -28.234 -19.154 1320 H GLY 688 H GLY 688 -17.833 -22.761 -16.591 1321 1HA GLY 688 2HA GLY 688 -20.452 -23.938 -16.183 1322 2HA GLY 688 1HA GLY 688 -19.966 -22.277 -15.910 1323 H ASN 689 H ASN 689 -18.267 -25.192 -14.651 1324 HA ASN 689 HA ASN 689 -19.416 -24.741 -12.058 1325 1HB ASN 689 1HB ASN 689 -18.272 -26.976 -13.468 1326 2HB ASN 689 2HB ASN 689 -17.258 -26.699 -12.066 1327 1HD2 ASN 689 1HD2 ASN 689 -17.852 -28.413 -10.873 1328 2HD2 ASN 689 2HD2 ASN 689 -19.430 -28.671 -10.208 1329 H VAL 690 H VAL 690 -17.204 -23.091 -13.728 1330 HA VAL 690 HA VAL 690 -14.889 -23.255 -12.077 1331 HB VAL 690 HB VAL 690 -14.871 -22.639 -14.461 1332 1HG1 VAL 690 2HG1 VAL 690 -17.025 -21.240 -14.240 1333 2HG1 VAL 690 3HG1 VAL 690 -15.956 -19.927 -13.691 1334 3HG1 VAL 690 1HG1 VAL 690 -15.742 -20.630 -15.312 1335 1HG2 VAL 690 1HG2 VAL 690 -13.080 -21.937 -12.804 1336 2HG2 VAL 690 2HG2 VAL 690 -13.174 -20.977 -14.300 1337 3HG2 VAL 690 3HG2 VAL 690 -13.848 -20.331 -12.785 1338 H THR 691 H THR 691 -15.032 -22.704 -9.952 1339 HA THR 691 HA THR 691 -16.917 -21.160 -8.752 1340 HB THR 691 HB THR 691 -15.220 -22.557 -7.588 1341 HG1 THR 691 1HG THR 691 -16.124 -20.867 -6.320 1342 1HG2 THR 691 3HG2 THR 691 -13.348 -21.078 -9.153 1343 2HG2 THR 691 1HG2 THR 691 -13.124 -20.521 -7.477 1344 3HG2 THR 691 2HG2 THR 691 -12.972 -22.251 -7.867 1345 H GLY 692 H GLY 692 -14.123 -20.061 -10.657 1346 1HA GLY 692 2HA GLY 692 -13.829 -18.025 -11.621 1347 2HA GLY 692 1HA GLY 692 -13.707 -17.520 -9.948 1348 H MET 693 H MET 693 -16.704 -18.810 -11.443 1349 HA MET 693 HA MET 693 -17.741 -16.189 -11.862 1350 1HB MET 693 1HB MET 693 -19.725 -17.413 -12.684 1351 2HB MET 693 2HB MET 693 -18.287 -18.196 -13.309 1352 1HG MET 693 1HG MET 693 -18.758 -20.139 -12.214 1353 2HG MET 693 2HG MET 693 -19.005 -19.307 -10.692 1354 1HE MET 693 1HE MET 693 -20.500 -20.411 -9.779 1355 2HE MET 693 2HE MET 693 -22.074 -19.581 -9.772 1356 3HE MET 693 3HE MET 693 -21.927 -21.203 -10.489 1357 H PHE 694 H PHE 694 -16.935 -16.752 -9.105 1358 HA PHE 694 HA PHE 694 -18.652 -17.597 -7.307 1359 1HB PHE 694 1HB PHE 694 -17.628 -14.713 -7.208 1360 2HB PHE 694 2HB PHE 694 -17.730 -15.846 -5.875 1361 HD1 PHE 694 1HD PHE 694 -16.332 -18.154 -6.506 1362 HD2 PHE 694 2HD PHE 694 -15.481 -14.219 -7.849 1363 HE1 PHE 694 1HE PHE 694 -13.932 -18.796 -6.868 1364 HE2 PHE 694 2HE PHE 694 -13.082 -14.861 -8.211 1365 HZ PHE 694 HZ PHE 694 -12.336 -17.142 -7.716 1366 H ALA 695 H ALA 695 -20.867 -17.610 -7.445 1367 HA ALA 695 HA ALA 695 -22.198 -15.150 -8.258 1368 1HB ALA 695 1HB ALA 695 -22.681 -17.992 -8.492 1369 2HB ALA 695 2HB ALA 695 -24.054 -17.218 -7.666 1370 3HB ALA 695 3HB ALA 695 -23.540 -16.640 -9.269 No H/Q in entry = 1370 Start of MODEL 16 1 H ALA 1 H ALA 1 -8.586 34.060 0.251 2 HA ALA 1 HA ALA 1 -6.704 32.335 0.136 3 1HB ALA 1 1HB ALA 1 -8.899 31.144 -1.377 4 2HB ALA 1 3HB ALA 1 -7.383 30.406 -0.806 5 3HB ALA 1 2HB ALA 1 -7.421 31.271 -2.361 6 H GLU 2 H GLU 2 -5.180 32.501 -1.878 7 HA GLU 2 HA GLU 2 -5.683 35.126 -3.046 8 1HB GLU 2 1HB GLU 2 -3.116 33.751 -2.185 9 2HB GLU 2 2HB GLU 2 -3.086 35.091 -3.314 10 1HG GLU 2 1HG GLU 2 -4.090 36.598 -1.707 11 2HG GLU 2 2HG GLU 2 -4.528 35.282 -0.636 12 HE2 GLU 2 HE GLU 2 -2.035 37.608 -0.647 13 H MET 3 H MET 3 -4.038 31.939 -3.644 14 HA MET 3 HA MET 3 -4.360 32.454 -6.484 15 1HB MET 3 1HB MET 3 -2.773 30.442 -6.657 16 2HB MET 3 2HB MET 3 -2.091 31.831 -5.833 17 1HG MET 3 1HG MET 3 -3.535 30.025 -3.989 18 2HG MET 3 2HG MET 3 -2.218 29.220 -4.818 19 1HE MET 3 3HE MET 3 -2.015 29.024 -2.265 20 2HE MET 3 1HE MET 3 -0.253 29.186 -2.457 21 3HE MET 3 2HE MET 3 -1.109 30.164 -1.242 22 H LYS 4 H LYS 4 -6.551 31.928 -6.854 23 HA LYS 4 HA LYS 4 -7.557 29.423 -5.839 24 1HB LYS 4 1HB LYS 4 -9.670 30.137 -6.736 25 2HB LYS 4 2HB LYS 4 -8.940 31.476 -5.874 26 1HG LYS 4 1HG LYS 4 -7.970 32.184 -8.206 27 2HG LYS 4 2HG LYS 4 -9.144 31.071 -8.881 28 1HD LYS 4 1HD LYS 4 -10.840 32.547 -8.564 29 2HD LYS 4 2HD LYS 4 -10.430 32.747 -6.872 30 1HE LYS 4 1HE LYS 4 -8.453 34.081 -8.577 31 2HE LYS 4 2HE LYS 4 -10.070 34.646 -8.949 32 H THR 5 H THR 5 -6.803 30.931 -9.047 33 HA THR 5 HA THR 5 -6.649 28.189 -10.118 34 HB THR 5 HB THR 5 -8.603 29.198 -11.097 35 HG1 THR 5 1HG THR 5 -7.786 29.328 -13.265 36 1HG2 THR 5 1HG2 THR 5 -7.980 31.603 -10.373 37 2HG2 THR 5 2HG2 THR 5 -6.921 31.651 -11.804 38 3HG2 THR 5 3HG2 THR 5 -8.678 31.445 -12.003 39 H ASP 6 H ASP 6 -4.891 30.851 -9.134 40 HA ASP 6 HA ASP 6 -3.215 31.526 -11.076 41 1HB ASP 6 1HB ASP 6 -3.192 31.519 -8.232 42 2HB ASP 6 2HB ASP 6 -1.662 30.803 -8.699 43 HD2 ASP 6 HD ASP 6 -0.483 34.022 -8.828 44 H ALA 7 H ALA 7 -1.495 30.545 -12.243 45 HA ALA 7 HA ALA 7 -1.410 27.858 -12.618 46 1HB ALA 7 1HB ALA 7 0.639 30.060 -12.963 47 2HB ALA 7 2HB ALA 7 1.004 28.380 -13.424 48 3HB ALA 7 3HB ALA 7 -0.345 29.244 -14.201 49 H ALA 8 H ALA 8 0.097 29.796 -10.042 50 HA ALA 8 HA ALA 8 1.997 27.990 -9.165 51 1HB ALA 8 2HB ALA 8 2.247 29.942 -8.031 52 2HB ALA 8 3HB ALA 8 0.510 30.324 -8.112 53 3HB ALA 8 1HB ALA 8 1.119 29.208 -6.866 54 H THR 9 H THR 9 -1.535 28.232 -8.468 55 HA THR 9 HA THR 9 -1.441 26.004 -6.654 56 HB THR 9 HB THR 9 -3.068 28.176 -6.937 57 HG1 THR 9 1HG THR 9 -4.337 26.922 -5.443 58 1HG2 THR 9 3HG2 THR 9 -4.458 25.821 -8.318 59 2HG2 THR 9 1HG2 THR 9 -5.312 27.236 -7.658 60 3HG2 THR 9 2HG2 THR 9 -4.175 27.435 -9.013 61 H LEU 10 H LEU 10 -2.683 26.565 -10.009 62 HA LEU 10 HA LEU 10 -3.643 24.017 -10.422 63 1HB LEU 10 1HB LEU 10 -2.460 26.051 -12.307 64 2HB LEU 10 2HB LEU 10 -3.181 24.551 -12.855 65 HG LEU 10 HG LEU 10 -4.515 26.900 -11.518 66 1HD1 LEU 10 2HD1 LEU 10 -4.167 26.717 -14.044 67 2HD1 LEU 10 3HD1 LEU 10 -5.375 25.410 -13.996 68 3HD1 LEU 10 1HD1 LEU 10 -5.816 27.050 -13.464 69 1HD2 LEU 10 1HD2 LEU 10 -5.409 24.041 -11.551 70 2HD2 LEU 10 2HD2 LEU 10 -5.569 25.278 -10.280 71 3HD2 LEU 10 3HD2 LEU 10 -6.617 25.338 -11.718 72 H ALA 11 H ALA 11 -0.318 25.340 -10.981 73 HA ALA 11 HA ALA 11 0.702 22.881 -11.922 74 1HB ALA 11 1HB ALA 11 2.315 25.085 -10.612 75 2HB ALA 11 2HB ALA 11 2.774 24.013 -11.957 76 3HB ALA 11 3HB ALA 11 1.578 25.305 -12.218 77 H GLN 12 H GLN 12 0.080 24.271 -8.730 78 HA GLN 12 HA GLN 12 1.869 22.576 -7.369 79 1HB GLN 12 1HB GLN 12 1.239 24.611 -6.280 80 2HB GLN 12 2HB GLN 12 -0.471 24.312 -6.515 81 1HG GLN 12 1HG GLN 12 -0.622 23.038 -4.628 82 2HG GLN 12 2HG GLN 12 0.816 22.120 -5.030 83 1HE2 GLN 12 1HE2 GLN 12 -0.327 25.224 -3.776 84 2HE2 GLN 12 2HE2 GLN 12 1.018 25.563 -2.739 85 H GLU 13 H GLU 13 -1.570 22.411 -8.354 86 HA GLU 13 HA GLU 13 -1.843 19.917 -6.923 87 1HB GLU 13 1HB GLU 13 -3.929 21.378 -8.596 88 2HB GLU 13 2HB GLU 13 -4.222 20.090 -7.445 89 1HG GLU 13 1HG GLU 13 -3.076 22.837 -6.752 90 2HG GLU 13 2HG GLU 13 -4.737 22.344 -6.490 91 HE2 GLU 13 HE GLU 13 -2.982 19.772 -4.255 92 H ALA 14 H ALA 14 -2.015 21.268 -10.276 93 HA ALA 14 HA ALA 14 -2.657 18.946 -11.609 94 1HB ALA 14 3HB ALA 14 -2.609 21.219 -12.588 95 2HB ALA 14 2HB ALA 14 -1.662 20.069 -13.562 96 3HB ALA 14 1HB ALA 14 -0.832 21.221 -12.488 97 H GLY 15 H GLY 15 0.595 20.250 -10.678 98 1HA GLY 15 2HA GLY 15 2.538 19.175 -10.297 99 2HA GLY 15 1HA GLY 15 2.235 18.407 -11.843 100 H ASN 16 H ASN 16 0.086 18.000 -9.009 101 HA ASN 16 HA ASN 16 1.321 15.520 -8.323 102 1HB ASN 16 1HB ASN 16 0.445 16.477 -6.384 103 2HB ASN 16 2HB ASN 16 -0.862 17.272 -7.239 104 1HD2 ASN 16 1HD2 ASN 16 -2.718 16.611 -6.488 105 2HD2 ASN 16 2HD2 ASN 16 -3.193 14.983 -6.137 106 H PHE 17 H PHE 17 -1.442 16.792 -10.176 107 HA PHE 17 HA PHE 17 -2.878 14.346 -10.292 108 1HB PHE 17 1HB PHE 17 -3.907 16.591 -10.618 109 2HB PHE 17 2HB PHE 17 -2.799 16.949 -11.928 110 HD1 PHE 17 1HD PHE 17 -5.600 14.715 -10.962 111 HD2 PHE 17 2HD PHE 17 -3.346 16.393 -14.142 112 HE1 PHE 17 1HE PHE 17 -7.264 13.819 -12.614 113 HE2 PHE 17 2HE PHE 17 -5.010 15.497 -15.794 114 HZ PHE 17 HZ PHE 17 -6.949 14.221 -15.010 115 H GLU 18 H GLU 18 -0.844 16.176 -12.692 116 HA GLU 18 HA GLU 18 -1.004 14.594 -14.801 117 1HB GLU 18 1HB GLU 18 1.180 16.237 -13.615 118 2HB GLU 18 2HB GLU 18 1.702 15.082 -14.825 119 1HG GLU 18 1HG GLU 18 0.653 16.196 -16.541 120 2HG GLU 18 2HG GLU 18 -0.757 16.577 -15.573 121 HE2 GLU 18 HE GLU 18 1.787 17.882 -17.004 122 H ARG 19 H ARG 19 0.730 13.854 -11.762 123 HA ARG 19 HA ARG 19 2.072 11.628 -12.793 124 1HB ARG 19 1HB ARG 19 2.100 13.087 -10.406 125 2HB ARG 19 2HB ARG 19 1.429 11.551 -9.895 126 1HG ARG 19 1HG ARG 19 3.431 10.487 -10.114 127 2HG ARG 19 2HG ARG 19 3.699 11.152 -11.713 128 1HD ARG 19 1HD ARG 19 4.023 13.367 -9.987 129 2HD ARG 19 2HD ARG 19 4.782 12.042 -9.127 130 HE ARG 19 HE ARG 19 5.742 11.755 -11.714 131 2HH1 ARG 19 1HH ARG 19 8.303 14.099 -11.839 132 1HH2 ARG 19 2HH2 ARG 19 5.711 14.432 -9.393 133 2HH2 ARG 19 1HH2 ARG 19 7.170 15.140 -10.001 134 H ILE 20 H ILE 20 -1.028 12.128 -11.005 135 HA ILE 20 HA ILE 20 -1.647 9.464 -10.561 136 HB ILE 20 HB ILE 20 -3.451 11.841 -11.026 137 1HG1 ILE 20 1HG1 ILE 20 -2.579 10.654 -8.385 138 2HG1 ILE 20 2HG1 ILE 20 -1.691 11.945 -9.171 139 1HG2 ILE 20 1HG2 ILE 20 -4.552 9.593 -11.299 140 2HG2 ILE 20 2HG2 ILE 20 -4.136 9.262 -9.600 141 3HG2 ILE 20 3HG2 ILE 20 -5.216 10.619 -10.004 142 1HD1 ILE 20 1HD1 ILE 20 -4.265 12.923 -9.330 143 2HD1 ILE 20 2HD1 ILE 20 -4.322 12.025 -7.794 144 3HD1 ILE 20 3HD1 ILE 20 -3.119 13.317 -8.026 145 H SER 21 H SER 21 -2.657 11.624 -13.304 146 HA SER 21 HA SER 21 -4.012 9.697 -14.688 147 1HB SER 21 1HB SER 21 -3.742 12.281 -15.080 148 2HB SER 21 2HB SER 21 -2.379 11.835 -16.087 149 HG SER 21 HG SER 21 -4.292 10.203 -16.895 150 H GLY 22 H GLY 22 -0.515 10.612 -14.772 151 1HA GLY 22 2HA GLY 22 1.296 9.525 -15.536 152 2HA GLY 22 1HA GLY 22 0.309 9.023 -16.895 153 H ASP 23 H ASP 23 0.190 8.257 -13.339 154 HA ASP 23 HA ASP 23 1.160 5.676 -13.681 155 1HB ASP 23 1HB ASP 23 -0.186 7.254 -11.527 156 2HB ASP 23 2HB ASP 23 -0.333 5.514 -11.373 157 HD2 ASP 23 HD ASP 23 1.328 4.529 -10.476 158 H LEU 24 H LEU 24 -2.083 7.188 -13.777 159 HA LEU 24 HA LEU 24 -3.612 4.859 -13.520 160 1HB LEU 24 1HB LEU 24 -4.368 7.227 -13.264 161 2HB LEU 24 2HB LEU 24 -4.297 7.397 -15.006 162 HG LEU 24 HG LEU 24 -5.940 5.421 -15.106 163 1HD1 LEU 24 3HD1 LEU 24 -5.455 5.076 -12.507 164 2HD1 LEU 24 1HD1 LEU 24 -6.844 6.181 -12.372 165 3HD1 LEU 24 2HD1 LEU 24 -7.010 4.646 -13.258 166 1HD2 LEU 24 1HD2 LEU 24 -6.779 8.105 -13.981 167 2HD2 LEU 24 2HD2 LEU 24 -6.607 7.658 -15.695 168 3HD2 LEU 24 3HD2 LEU 24 -7.884 6.913 -14.704 169 H LYS 25 H LYS 25 -2.052 6.472 -16.325 170 HA LYS 25 HA LYS 25 -3.264 4.752 -18.229 171 1HB LYS 25 1HB LYS 25 -0.712 6.313 -18.633 172 2HB LYS 25 2HB LYS 25 -1.921 5.866 -19.820 173 1HG LYS 25 1HG LYS 25 -3.260 7.352 -17.746 174 2HG LYS 25 2HG LYS 25 -1.812 8.241 -18.177 175 1HD LYS 25 1HD LYS 25 -3.917 7.242 -20.155 176 2HD LYS 25 2HD LYS 25 -3.767 8.894 -19.590 177 1HE LYS 25 1HE LYS 25 -1.508 7.416 -21.016 178 2HE LYS 25 2HE LYS 25 -2.684 8.403 -21.861 179 H THR 26 H THR 26 -0.152 4.797 -16.417 180 HA THR 26 HA THR 26 1.084 2.698 -17.752 181 HB THR 26 HB THR 26 1.251 4.035 -15.050 182 HG1 THR 26 1HG THR 26 2.963 3.317 -17.324 183 1HG2 THR 26 1HG2 THR 26 2.139 1.261 -15.624 184 2HG2 THR 26 2HG2 THR 26 3.471 2.344 -15.156 185 3HG2 THR 26 3HG2 THR 26 2.079 2.125 -14.069 186 H GLN 27 H GLN 27 -1.160 2.629 -14.919 187 HA GLN 27 HA GLN 27 -0.977 -0.142 -14.642 188 1HB GLN 27 1HB GLN 27 -3.205 1.760 -13.789 189 2HB GLN 27 2HB GLN 27 -3.005 0.119 -13.207 190 1HG GLN 27 1HG GLN 27 -0.808 2.216 -12.942 191 2HG GLN 27 2HG GLN 27 -2.045 2.001 -11.720 192 1HE2 GLN 27 1HE2 GLN 27 0.987 1.142 -12.681 193 2HE2 GLN 27 2HE2 GLN 27 1.215 -0.329 -11.795 194 H ILE 28 H ILE 28 -3.283 2.030 -16.380 195 HA ILE 28 HA ILE 28 -5.104 0.092 -17.145 196 HB ILE 28 HB ILE 28 -4.259 2.740 -18.271 197 1HG1 ILE 28 1HG1 ILE 28 -6.834 1.781 -16.987 198 2HG1 ILE 28 2HG1 ILE 28 -5.553 2.643 -16.157 199 1HG2 ILE 28 3HG2 ILE 28 -5.759 0.639 -19.659 200 2HG2 ILE 28 1HG2 ILE 28 -6.632 2.186 -19.546 201 3HG2 ILE 28 2HG2 ILE 28 -5.013 2.130 -20.284 202 1HD1 ILE 28 2HD1 ILE 28 -5.831 4.458 -18.019 203 2HD1 ILE 28 3HD1 ILE 28 -7.381 3.651 -18.360 204 3HD1 ILE 28 1HD1 ILE 28 -7.078 4.356 -16.753 205 H ASP 29 H ASP 29 -2.237 1.373 -18.977 206 HA ASP 29 HA ASP 29 -2.487 -0.266 -21.128 207 1HB ASP 29 1HB ASP 29 -0.681 1.623 -20.276 208 2HB ASP 29 2HB ASP 29 0.294 0.176 -20.112 209 HD2 ASP 29 HD ASP 29 1.339 0.419 -23.141 210 H GLN 30 H GLN 30 -0.963 -0.811 -17.904 211 HA GLN 30 HA GLN 30 0.387 -3.120 -18.435 212 1HB GLN 30 1HB GLN 30 -0.719 -1.767 -16.041 213 2HB GLN 30 2HB GLN 30 -0.529 -3.498 -15.842 214 1HG GLN 30 1HG GLN 30 1.519 -2.166 -15.187 215 2HG GLN 30 2HG GLN 30 1.834 -3.396 -16.395 216 1HE2 GLN 30 1HE2 GLN 30 3.167 -0.831 -15.715 217 2HE2 GLN 30 2HE2 GLN 30 3.277 0.071 -17.189 218 H VAL 31 H VAL 31 -3.070 -2.660 -17.468 219 HA VAL 31 HA VAL 31 -3.660 -5.402 -17.331 220 HB VAL 31 HB VAL 31 -5.250 -2.868 -17.603 221 1HG1 VAL 31 2HG1 VAL 31 -6.493 -4.549 -18.874 222 2HG1 VAL 31 3HG1 VAL 31 -6.388 -5.683 -17.506 223 3HG1 VAL 31 1HG1 VAL 31 -7.323 -4.177 -17.344 224 1HG2 VAL 31 2HG2 VAL 31 -4.119 -4.239 -15.444 225 2HG2 VAL 31 3HG2 VAL 31 -5.329 -2.935 -15.369 226 3HG2 VAL 31 1HG2 VAL 31 -5.853 -4.636 -15.371 227 H GLU 32 H GLU 32 -3.976 -2.929 -19.953 228 HA GLU 32 HA GLU 32 -5.255 -4.497 -21.773 229 1HB GLU 32 1HB GLU 32 -3.354 -2.166 -21.964 230 2HB GLU 32 2HB GLU 32 -3.789 -2.998 -23.444 231 1HG GLU 32 1HG GLU 32 -6.255 -2.733 -22.709 232 2HG GLU 32 2HG GLU 32 -5.672 -1.646 -21.465 233 HE2 GLU 32 HE GLU 32 -6.502 0.419 -24.261 234 H SER 33 H SER 33 -1.761 -4.324 -20.946 235 HA SER 33 HA SER 33 -1.047 -6.063 -23.071 236 1HB SER 33 1HB SER 33 0.295 -4.334 -21.254 237 2HB SER 33 2HB SER 33 0.923 -5.937 -20.924 238 HG SER 33 HG SER 33 0.681 -5.227 -23.662 239 H THR 34 H THR 34 -1.198 -6.320 -19.444 240 HA THR 34 HA THR 34 -0.513 -9.003 -19.264 241 HB THR 34 HB THR 34 -1.935 -6.936 -17.597 242 HG1 THR 34 1HG THR 34 -0.106 -7.648 -16.261 243 1HG2 THR 34 3HG2 THR 34 -3.218 -9.165 -17.286 244 2HG2 THR 34 1HG2 THR 34 -1.679 -9.849 -16.711 245 3HG2 THR 34 2HG2 THR 34 -2.442 -8.507 -15.826 246 H ALA 35 H ALA 35 -3.774 -7.489 -19.652 247 HA ALA 35 HA ALA 35 -5.199 -9.874 -19.523 248 1HB ALA 35 3HB ALA 35 -7.000 -8.576 -20.518 249 2HB ALA 35 2HB ALA 35 -5.844 -7.365 -21.122 250 3HB ALA 35 1HB ALA 35 -6.113 -7.544 -19.371 251 H GLY 36 H GLY 36 -2.942 -8.717 -21.869 252 1HA GLY 36 2HA GLY 36 -2.358 -9.414 -23.926 253 2HA GLY 36 1HA GLY 36 -4.036 -9.820 -24.225 254 H SER 37 H SER 37 -2.733 -11.291 -21.355 255 HA SER 37 HA SER 37 -2.030 -13.672 -22.862 256 1HB SER 37 1HB SER 37 -1.115 -12.448 -20.333 257 2HB SER 37 2HB SER 37 -1.414 -14.168 -20.183 258 HG SER 37 HG SER 37 0.783 -13.681 -20.863 259 H LEU 38 H LEU 38 -4.592 -12.230 -21.128 260 HA LEU 38 HA LEU 38 -5.574 -14.669 -19.948 261 1HB LEU 38 1HB LEU 38 -6.394 -11.799 -20.003 262 2HB LEU 38 2HB LEU 38 -7.604 -13.009 -19.625 263 HG LEU 38 HG LEU 38 -6.891 -12.476 -17.523 264 1HD1 LEU 38 1HD1 LEU 38 -6.358 -14.950 -18.210 265 2HD1 LEU 38 2HD1 LEU 38 -4.672 -14.445 -17.941 266 3HD1 LEU 38 3HD1 LEU 38 -5.860 -14.322 -16.621 267 1HD2 LEU 38 1HD2 LEU 38 -4.263 -11.846 -18.817 268 2HD2 LEU 38 2HD2 LEU 38 -5.299 -10.838 -17.778 269 3HD2 LEU 38 3HD2 LEU 38 -4.329 -12.149 -17.064 270 H GLN 39 H GLN 39 -7.208 -12.299 -22.154 271 HA GLN 39 HA GLN 39 -9.052 -14.018 -23.102 272 1HB GLN 39 1HB GLN 39 -8.924 -12.498 -25.240 273 2HB GLN 39 2HB GLN 39 -9.378 -11.781 -23.707 274 1HG GLN 39 1HG GLN 39 -7.592 -10.520 -25.068 275 2HG GLN 39 2HG GLN 39 -7.219 -10.807 -23.380 276 1HE2 GLN 39 1HE2 GLN 39 -5.551 -12.078 -22.798 277 2HE2 GLN 39 2HE2 GLN 39 -4.437 -12.824 -23.894 278 H GLY 40 H GLY 40 -5.644 -14.169 -23.589 279 1HA GLY 40 2HA GLY 40 -4.346 -15.184 -25.183 280 2HA GLY 40 1HA GLY 40 -5.767 -15.537 -26.146 281 H GLN 41 H GLN 41 -6.675 -16.423 -23.068 282 HA GLN 41 HA GLN 41 -6.315 -19.169 -23.699 283 1HB GLN 41 1HB GLN 41 -4.176 -18.985 -22.683 284 2HB GLN 41 2HB GLN 41 -4.750 -17.886 -21.444 285 1HG GLN 41 1HG GLN 41 -6.230 -19.815 -20.587 286 2HG GLN 41 2HG GLN 41 -5.353 -20.866 -21.682 287 1HE2 GLN 41 1HE2 GLN 41 -5.447 -19.447 -18.645 288 2HE2 GLN 41 2HE2 GLN 41 -3.849 -19.811 -18.084 289 H TRP 42 H TRP 42 -8.316 -19.981 -23.267 290 HA TRP 42 HA TRP 42 -9.473 -19.639 -20.689 291 1HB TRP 42 1HB TRP 42 -10.742 -18.205 -23.025 292 2HB TRP 42 2HB TRP 42 -11.593 -18.604 -21.546 293 HD1 TRP 42 HD TRP 42 -9.702 -15.811 -23.001 294 HE1 TRP 42 1HE TRP 42 -8.932 -14.004 -21.240 295 HE3 TRP 42 3HE TRP 42 -10.566 -18.682 -18.894 296 HZ2 TRP 42 2HZ TRP 42 -8.775 -13.977 -18.390 297 HZ3 TRP 42 3HZ TRP 42 -10.078 -17.689 -16.660 298 HH2 TRP 42 HH TRP 42 -9.212 -15.422 -16.370 299 H ARG 43 H ARG 43 -11.721 -20.823 -20.725 300 HA ARG 43 HA ARG 43 -11.703 -22.790 -22.860 301 1HB ARG 43 1HB ARG 43 -11.670 -23.269 -19.862 302 2HB ARG 43 2HB ARG 43 -12.461 -24.433 -20.906 303 1HG ARG 43 1HG ARG 43 -9.781 -23.603 -21.878 304 2HG ARG 43 2HG ARG 43 -9.742 -24.392 -20.314 305 1HD ARG 43 1HD ARG 43 -11.367 -26.154 -21.489 306 2HD ARG 43 2HD ARG 43 -10.695 -25.496 -22.968 307 HE ARG 43 HE ARG 43 -8.606 -26.136 -21.050 308 2HH1 ARG 43 1HH ARG 43 -7.645 -29.103 -22.580 309 1HH2 ARG 43 2HH2 ARG 43 -10.756 -27.575 -23.471 310 2HH2 ARG 43 1HH2 ARG 43 -9.713 -28.923 -23.777 311 H GLY 44 H GLY 44 -13.393 -20.720 -23.119 312 1HA GLY 44 2HA GLY 44 -15.983 -21.889 -22.837 313 2HA GLY 44 1HA GLY 44 -15.584 -20.314 -23.495 314 H ALA 45 H ALA 45 -17.252 -19.183 -22.395 315 HA ALA 45 HA ALA 45 -18.305 -18.205 -20.702 316 1HB ALA 45 2HB ALA 45 -17.699 -20.736 -19.676 317 2HB ALA 45 3HB ALA 45 -17.108 -19.610 -18.431 318 3HB ALA 45 1HB ALA 45 -18.807 -19.542 -18.958 319 H ALA 46 H ALA 46 -15.256 -19.147 -18.983 320 HA ALA 46 HA ALA 46 -14.816 -16.578 -18.001 321 1HB ALA 46 2HB ALA 46 -12.472 -18.362 -18.443 322 2HB ALA 46 1HB ALA 46 -13.824 -19.062 -17.520 323 3HB ALA 46 3HB ALA 46 -13.041 -17.566 -16.956 324 H GLY 47 H GLY 47 -14.222 -18.035 -21.141 325 1HA GLY 47 2HA GLY 47 -13.113 -17.319 -22.974 326 2HA GLY 47 1HA GLY 47 -12.128 -16.280 -21.964 327 H THR 48 H THR 48 -15.528 -16.560 -23.219 328 HA THR 48 HA THR 48 -15.528 -14.083 -24.467 329 HB THR 48 HB THR 48 -18.124 -15.074 -23.392 330 HG1 THR 48 1HG THR 48 -17.753 -17.081 -24.721 331 1HG2 THR 48 1HG2 THR 48 -16.935 -14.132 -25.933 332 2HG2 THR 48 2HG2 THR 48 -17.948 -15.581 -26.146 333 3HG2 THR 48 3HG2 THR 48 -18.638 -14.113 -25.413 334 H ALA 49 H ALA 49 -15.978 -14.928 -21.064 335 HA ALA 49 HA ALA 49 -17.238 -12.491 -20.352 336 1HB ALA 49 3HB ALA 49 -15.891 -14.778 -18.919 337 2HB ALA 49 2HB ALA 49 -17.584 -14.236 -18.840 338 3HB ALA 49 1HB ALA 49 -16.310 -13.297 -18.026 339 H ALA 50 H ALA 50 -13.832 -13.715 -20.318 340 HA ALA 50 HA ALA 50 -12.846 -11.225 -19.308 341 1HB ALA 50 1HB ALA 50 -10.630 -12.463 -20.097 342 2HB ALA 50 3HB ALA 50 -11.721 -13.866 -20.201 343 3HB ALA 50 2HB ALA 50 -11.518 -13.009 -18.654 344 H GLN 51 H GLN 51 -12.556 -13.017 -22.462 345 HA GLN 51 HA GLN 51 -11.200 -11.153 -23.842 346 1HB GLN 51 1HB GLN 51 -11.535 -12.703 -25.444 347 2HB GLN 51 2HB GLN 51 -12.738 -13.478 -24.432 348 1HG GLN 51 1HG GLN 51 -13.884 -12.960 -26.466 349 2HG GLN 51 2HG GLN 51 -14.432 -11.755 -25.319 350 1HE2 GLN 51 1HE2 GLN 51 -14.978 -10.351 -26.981 351 2HE2 GLN 51 2HE2 GLN 51 -13.804 -9.439 -27.871 352 H ALA 52 H ALA 52 -14.713 -11.208 -23.085 353 HA ALA 52 HA ALA 52 -15.288 -8.942 -24.720 354 1HB ALA 52 1HB ALA 52 -16.945 -10.701 -24.191 355 2HB ALA 52 3HB ALA 52 -17.502 -9.101 -23.647 356 3HB ALA 52 2HB ALA 52 -16.854 -10.266 -22.467 357 H ALA 53 H ALA 53 -14.390 -9.563 -21.311 358 HA ALA 53 HA ALA 53 -15.006 -6.950 -20.411 359 1HB ALA 53 1HB ALA 53 -13.061 -8.991 -19.264 360 2HB ALA 53 2HB ALA 53 -13.845 -7.649 -18.396 361 3HB ALA 53 3HB ALA 53 -14.820 -9.014 -18.992 362 H VAL 54 H VAL 54 -12.223 -8.507 -21.997 363 HA VAL 54 HA VAL 54 -10.396 -6.421 -21.387 364 HB VAL 54 HB VAL 54 -10.227 -8.360 -23.686 365 1HG1 VAL 54 2HG1 VAL 54 -8.502 -6.570 -23.457 366 2HG1 VAL 54 3HG1 VAL 54 -8.080 -7.232 -21.859 367 3HG1 VAL 54 1HG1 VAL 54 -7.842 -8.218 -23.322 368 1HG2 VAL 54 1HG2 VAL 54 -10.511 -9.003 -20.882 369 2HG2 VAL 54 2HG2 VAL 54 -10.360 -10.090 -22.283 370 3HG2 VAL 54 3HG2 VAL 54 -8.900 -9.484 -21.465 371 H VAL 55 H VAL 55 -12.666 -7.171 -24.069 372 HA VAL 55 HA VAL 55 -11.732 -5.145 -25.782 373 HB VAL 55 HB VAL 55 -14.284 -6.724 -25.538 374 1HG1 VAL 55 1HG1 VAL 55 -13.969 -4.216 -26.894 375 2HG1 VAL 55 2HG1 VAL 55 -14.141 -5.507 -28.107 376 3HG1 VAL 55 3HG1 VAL 55 -15.383 -5.297 -26.850 377 1HG2 VAL 55 2HG2 VAL 55 -11.715 -7.062 -26.861 378 2HG2 VAL 55 3HG2 VAL 55 -13.029 -8.235 -26.606 379 3HG2 VAL 55 1HG2 VAL 55 -13.064 -7.152 -28.018 380 H ARG 56 H ARG 56 -14.591 -5.299 -23.541 381 HA ARG 56 HA ARG 56 -15.447 -2.759 -23.974 382 1HB ARG 56 1HB ARG 56 -15.702 -4.775 -21.784 383 2HB ARG 56 2HB ARG 56 -16.036 -3.127 -21.294 384 1HG ARG 56 1HG ARG 56 -18.150 -3.866 -22.026 385 2HG ARG 56 2HG ARG 56 -17.548 -3.011 -23.433 386 1HD ARG 56 1HD ARG 56 -16.673 -5.249 -24.316 387 2HD ARG 56 2HD ARG 56 -17.496 -6.032 -22.982 388 HE ARG 56 HE ARG 56 -18.752 -4.819 -25.348 389 2HH1 ARG 56 1HH ARG 56 -21.970 -5.690 -24.373 390 1HH2 ARG 56 2HH2 ARG 56 -19.271 -5.976 -22.039 391 2HH2 ARG 56 1HH2 ARG 56 -20.975 -6.201 -22.253 392 H PHE 57 H PHE 57 -13.112 -3.986 -21.476 393 HA PHE 57 HA PHE 57 -12.656 -1.548 -20.234 394 1HB PHE 57 1HB PHE 57 -11.818 -3.478 -19.127 395 2HB PHE 57 2HB PHE 57 -11.293 -4.222 -20.624 396 HD1 PHE 57 1HD PHE 57 -10.436 -1.576 -18.176 397 HD2 PHE 57 2HD PHE 57 -9.057 -4.044 -21.341 398 HE1 PHE 57 1HE PHE 57 -8.076 -0.865 -17.703 399 HE2 PHE 57 2HE PHE 57 -6.697 -3.333 -20.867 400 HZ PHE 57 HZ PHE 57 -6.235 -1.751 -19.054 401 H GLN 58 H GLN 58 -10.829 -3.196 -22.906 402 HA GLN 58 HA GLN 58 -8.842 -1.373 -23.169 403 1HB GLN 58 1HB GLN 58 -10.272 -3.097 -25.224 404 2HB GLN 58 2HB GLN 58 -8.890 -2.112 -25.661 405 1HG GLN 58 1HG GLN 58 -8.414 -3.676 -23.201 406 2HG GLN 58 2HG GLN 58 -8.797 -4.697 -24.573 407 1HE2 GLN 58 1HE2 GLN 58 -6.595 -5.426 -24.284 408 2HE2 GLN 58 2HE2 GLN 58 -5.285 -4.567 -25.024 409 H GLU 59 H GLU 59 -11.988 -1.417 -25.003 410 HA GLU 59 HA GLU 59 -11.584 0.896 -26.380 411 1HB GLU 59 1HB GLU 59 -13.999 -0.634 -25.459 412 2HB GLU 59 2HB GLU 59 -14.269 0.981 -26.084 413 1HG GLU 59 1HG GLU 59 -12.488 -0.899 -27.646 414 2HG GLU 59 2HG GLU 59 -14.224 -1.130 -27.720 415 HE2 GLU 59 HE GLU 59 -12.659 2.215 -29.315 416 H ALA 60 H ALA 60 -12.591 0.395 -22.994 417 HA ALA 60 HA ALA 60 -13.401 3.100 -22.598 418 1HB ALA 60 3HB ALA 60 -12.673 0.891 -20.632 419 2HB ALA 60 1HB ALA 60 -13.517 2.407 -20.234 420 3HB ALA 60 2HB ALA 60 -14.297 1.205 -21.290 421 H ALA 61 H ALA 61 -10.386 1.216 -22.374 422 HA ALA 61 HA ALA 61 -8.924 2.943 -20.768 423 1HB ALA 61 3HB ALA 61 -8.462 0.548 -21.828 424 2HB ALA 61 1HB ALA 61 -7.648 1.512 -23.084 425 3HB ALA 61 2HB ALA 61 -7.119 1.630 -21.388 426 H ASN 62 H ASN 62 -9.439 2.891 -24.351 427 HA ASN 62 HA ASN 62 -7.729 4.972 -24.911 428 1HB ASN 62 1HB ASN 62 -10.351 4.284 -26.341 429 2HB ASN 62 2HB ASN 62 -9.008 5.167 -27.039 430 1HD2 ASN 62 1HD2 ASN 62 -10.161 2.082 -25.884 431 2HD2 ASN 62 2HD2 ASN 62 -8.964 1.074 -26.626 432 H LYS 63 H LYS 63 -11.342 4.906 -24.415 433 HA LYS 63 HA LYS 63 -11.849 7.580 -24.720 434 1HB LYS 63 1HB LYS 63 -13.171 5.502 -22.958 435 2HB LYS 63 2HB LYS 63 -13.819 7.112 -23.196 436 1HG LYS 63 1HG LYS 63 -13.099 5.878 -25.761 437 2HG LYS 63 2HG LYS 63 -14.213 4.863 -24.867 438 1HD LYS 63 1HD LYS 63 -14.611 7.777 -25.671 439 2HD LYS 63 2HD LYS 63 -15.533 6.391 -26.218 440 1HE LYS 63 1HE LYS 63 -15.973 6.105 -23.566 441 2HE LYS 63 2HE LYS 63 -15.650 7.827 -23.572 442 H GLN 64 H GLN 64 -10.648 5.796 -21.832 443 HA GLN 64 HA GLN 64 -10.781 8.065 -20.178 444 1HB GLN 64 1HB GLN 64 -9.964 5.263 -19.972 445 2HB GLN 64 2HB GLN 64 -8.841 6.301 -19.115 446 1HG GLN 64 1HG GLN 64 -11.658 7.068 -18.656 447 2HG GLN 64 2HG GLN 64 -11.326 5.420 -18.161 448 1HE2 GLN 64 1HE2 GLN 64 -9.990 8.709 -17.992 449 2HE2 GLN 64 2HE2 GLN 64 -9.357 8.611 -16.383 450 H LYS 65 H LYS 65 -8.342 6.659 -22.371 451 HA LYS 65 HA LYS 65 -6.146 8.120 -21.411 452 1HB LYS 65 1HB LYS 65 -6.774 6.326 -23.620 453 2HB LYS 65 2HB LYS 65 -5.715 7.624 -24.131 454 1HG LYS 65 1HG LYS 65 -4.289 5.856 -23.318 455 2HG LYS 65 2HG LYS 65 -4.241 7.127 -22.113 456 1HD LYS 65 1HD LYS 65 -4.780 5.506 -20.606 457 2HD LYS 65 2HD LYS 65 -6.407 5.617 -21.247 458 1HE LYS 65 1HE LYS 65 -6.007 3.328 -21.506 459 2HE LYS 65 2HE LYS 65 -5.512 3.915 -23.081 460 H GLN 66 H GLN 66 -8.863 8.891 -23.568 461 HA GLN 66 HA GLN 66 -7.622 11.208 -24.607 462 1HB GLN 66 1HB GLN 66 -9.708 9.690 -25.426 463 2HB GLN 66 2HB GLN 66 -10.612 10.935 -24.587 464 1HG GLN 66 1HG GLN 66 -10.328 11.563 -26.951 465 2HG GLN 66 2HG GLN 66 -9.463 12.695 -25.930 466 1HE2 GLN 66 1HE2 GLN 66 -8.104 13.285 -27.604 467 2HE2 GLN 66 2HE2 GLN 66 -6.805 12.288 -28.169 468 H GLU 67 H GLU 67 -10.263 10.604 -22.183 469 HA GLU 67 HA GLU 67 -10.555 13.287 -21.527 470 1HB GLU 67 1HB GLU 67 -12.112 12.542 -19.979 471 2HB GLU 67 2HB GLU 67 -12.030 11.135 -21.019 472 1HG GLU 67 1HG GLU 67 -11.754 10.134 -18.926 473 2HG GLU 67 2HG GLU 67 -10.081 10.370 -19.391 474 HE2 GLU 67 HE GLU 67 -9.132 12.280 -17.145 475 H LEU 68 H LEU 68 -8.221 10.818 -20.567 476 HA LEU 68 HA LEU 68 -7.405 12.014 -18.151 477 1HB LEU 68 1HB LEU 68 -6.394 9.916 -19.999 478 2HB LEU 68 2HB LEU 68 -5.243 10.628 -18.886 479 HG LEU 68 HG LEU 68 -7.784 9.135 -18.204 480 1HD1 LEU 68 3HD1 LEU 68 -5.356 8.114 -18.778 481 2HD1 LEU 68 1HD1 LEU 68 -5.162 8.403 -17.032 482 3HD1 LEU 68 2HD1 LEU 68 -6.492 7.378 -17.622 483 1HD2 LEU 68 1HD2 LEU 68 -6.386 11.179 -16.666 484 2HD2 LEU 68 2HD2 LEU 68 -7.961 10.400 -16.380 485 3HD2 LEU 68 3HD2 LEU 68 -6.465 9.618 -15.813 486 H ASP 69 H ASP 69 -6.331 12.311 -21.582 487 HA ASP 69 HA ASP 69 -4.266 14.112 -20.858 488 1HB ASP 69 1HB ASP 69 -4.756 12.523 -23.036 489 2HB ASP 69 2HB ASP 69 -5.323 14.058 -23.662 490 HD2 ASP 69 HD ASP 69 -2.054 13.126 -24.475 491 H GLU 70 H GLU 70 -7.543 14.252 -22.406 492 HA GLU 70 HA GLU 70 -7.643 16.830 -23.149 493 1HB GLU 70 1HB GLU 70 -9.925 16.514 -23.337 494 2HB GLU 70 2HB GLU 70 -9.431 14.844 -23.144 495 1HG GLU 70 1HG GLU 70 -9.907 14.944 -20.716 496 2HG GLU 70 2HG GLU 70 -10.296 16.649 -20.835 497 HE2 GLU 70 HE GLU 70 -13.137 14.895 -20.511 498 H ILE 71 H ILE 71 -8.009 15.483 -19.836 499 HA ILE 71 HA ILE 71 -8.637 18.064 -18.739 500 HB ILE 71 HB ILE 71 -8.363 15.274 -17.732 501 1HG1 ILE 71 1HG1 ILE 71 -10.493 17.134 -16.828 502 2HG1 ILE 71 2HG1 ILE 71 -10.483 16.759 -18.540 503 1HG2 ILE 71 1HG2 ILE 71 -7.664 17.689 -16.187 504 2HG2 ILE 71 2HG2 ILE 71 -8.846 16.607 -15.412 505 3HG2 ILE 71 3HG2 ILE 71 -7.256 15.979 -15.908 506 1HD1 ILE 71 2HD1 ILE 71 -10.097 14.250 -17.551 507 2HD1 ILE 71 3HD1 ILE 71 -11.014 14.970 -16.205 508 3HD1 ILE 71 1HD1 ILE 71 -11.711 14.941 -17.843 509 H SER 72 H SER 72 -5.861 15.729 -18.582 510 HA SER 72 HA SER 72 -4.236 17.281 -17.043 511 1HB SER 72 1HB SER 72 -2.522 15.796 -17.632 512 2HB SER 72 2HB SER 72 -3.956 14.847 -17.971 513 HG SER 72 HG SER 72 -2.026 15.261 -19.660 514 H THR 73 H THR 73 -5.261 17.708 -20.366 515 HA THR 73 HA THR 73 -3.069 19.551 -20.937 516 HB THR 73 HB THR 73 -5.279 18.183 -22.523 517 HG1 THR 73 1HG THR 73 -3.177 17.668 -23.683 518 1HG2 THR 73 3HG2 THR 73 -4.276 20.818 -23.070 519 2HG2 THR 73 1HG2 THR 73 -3.432 19.704 -24.173 520 3HG2 THR 73 2HG2 THR 73 -5.211 19.770 -24.163 521 H ASN 74 H ASN 74 -6.504 19.487 -20.059 522 HA ASN 74 HA ASN 74 -7.307 21.909 -20.905 523 1HB ASN 74 1HB ASN 74 -8.055 20.022 -18.801 524 2HB ASN 74 2HB ASN 74 -8.268 21.659 -18.212 525 1HD2 ASN 74 1HD2 ASN 74 -9.748 19.181 -19.721 526 2HD2 ASN 74 2HD2 ASN 74 -10.982 20.001 -20.619 527 H ILE 75 H ILE 75 -5.742 21.105 -17.706 528 HA ILE 75 HA ILE 75 -5.546 23.727 -16.804 529 HB ILE 75 HB ILE 75 -3.726 21.413 -16.141 530 1HG1 ILE 75 1HG1 ILE 75 -5.737 21.596 -14.200 531 2HG1 ILE 75 2HG1 ILE 75 -6.589 21.731 -15.726 532 1HG2 ILE 75 1HG2 ILE 75 -4.296 24.073 -14.906 533 2HG2 ILE 75 2HG2 ILE 75 -3.974 22.688 -13.836 534 3HG2 ILE 75 3HG2 ILE 75 -2.765 23.176 -15.049 535 1HD1 ILE 75 1HD1 ILE 75 -5.115 19.697 -16.487 536 2HD1 ILE 75 2HD1 ILE 75 -4.820 19.473 -14.746 537 3HD1 ILE 75 3HD1 ILE 75 -6.479 19.396 -15.384 538 H ARG 76 H ARG 76 -3.228 21.665 -18.663 539 HA ARG 76 HA ARG 76 -1.120 23.345 -18.663 540 1HB ARG 76 1HB ARG 76 -2.146 21.187 -20.420 541 2HB ARG 76 2HB ARG 76 -1.111 22.317 -21.271 542 1HG ARG 76 1HG ARG 76 0.170 20.410 -20.266 543 2HG ARG 76 2HG ARG 76 0.708 21.968 -19.671 544 1HD ARG 76 1HD ARG 76 -1.207 21.424 -17.799 545 2HD ARG 76 2HD ARG 76 -0.758 19.785 -18.225 546 HE ARG 76 HE ARG 76 1.699 20.902 -17.878 547 2HH1 ARG 76 1HH ARG 76 2.061 21.319 -14.449 548 1HH2 ARG 76 2HH2 ARG 76 -1.215 21.084 -15.870 549 2HH2 ARG 76 1HH2 ARG 76 -0.335 21.278 -14.392 550 H GLN 77 H GLN 77 -4.057 23.398 -20.756 551 HA GLN 77 HA GLN 77 -3.051 25.573 -22.291 552 1HB GLN 77 1HB GLN 77 -5.838 24.338 -22.159 553 2HB GLN 77 2HB GLN 77 -5.320 25.514 -23.351 554 1HG GLN 77 1HG GLN 77 -3.439 23.255 -23.166 555 2HG GLN 77 2HG GLN 77 -5.063 22.714 -23.542 556 1HE2 GLN 77 1HE2 GLN 77 -3.410 22.224 -25.442 557 2HE2 GLN 77 2HE2 GLN 77 -3.502 23.322 -26.778 558 H ALA 78 H ALA 78 -4.635 25.170 -19.241 559 HA ALA 78 HA ALA 78 -6.218 27.476 -19.179 560 1HB ALA 78 3HB ALA 78 -4.765 26.235 -16.822 561 2HB ALA 78 1HB ALA 78 -6.342 27.058 -16.839 562 3HB ALA 78 2HB ALA 78 -6.167 25.456 -17.594 563 H GLY 79 H GLY 79 -2.749 26.965 -19.114 564 1HA GLY 79 2HA GLY 79 -2.388 29.830 -18.467 565 2HA GLY 79 1HA GLY 79 -1.449 28.947 -19.654 566 H VAL 80 H VAL 80 -1.640 26.496 -17.672 567 HA VAL 80 HA VAL 80 0.496 27.457 -15.895 568 HB VAL 80 HB VAL 80 -1.136 26.967 -14.392 569 1HG1 VAL 80 1HG1 VAL 80 -2.821 26.336 -16.098 570 2HG1 VAL 80 2HG1 VAL 80 -2.142 24.691 -16.134 571 3HG1 VAL 80 3HG1 VAL 80 -2.899 25.309 -14.646 572 1HG2 VAL 80 1HG2 VAL 80 0.892 25.326 -14.269 573 2HG2 VAL 80 2HG2 VAL 80 -0.533 25.041 -13.241 574 3HG2 VAL 80 3HG2 VAL 80 -0.306 24.093 -14.731 575 H GLN 81 H GLN 81 2.206 26.959 -17.318 576 HA GLN 81 HA GLN 81 2.560 24.094 -17.646 577 1HB GLN 81 1HB GLN 81 3.157 24.247 -19.920 578 2HB GLN 81 2HB GLN 81 1.779 25.322 -19.802 579 1HG GLN 81 1HG GLN 81 3.097 26.936 -20.706 580 2HG GLN 81 2HG GLN 81 3.934 26.998 -19.168 581 1HE2 GLN 81 1HE2 GLN 81 4.916 27.451 -21.870 582 2HE2 GLN 81 2HE2 GLN 81 6.229 26.354 -22.139 583 H TYR 82 H TYR 82 3.559 26.693 -16.039 584 HA TYR 82 HA TYR 82 6.326 25.786 -16.025 585 1HB TYR 82 1HB TYR 82 7.112 28.085 -16.357 586 2HB TYR 82 2HB TYR 82 5.928 27.805 -17.619 587 HD1 TYR 82 1HD TYR 82 3.402 28.425 -16.862 588 HD2 TYR 82 2HD TYR 82 6.976 30.088 -15.201 589 HE1 TYR 82 1HE TYR 82 2.100 30.466 -16.084 590 HE2 TYR 82 2HE TYR 82 5.662 32.123 -14.429 591 HH TYR 82 HH TYR 82 2.674 32.260 -13.948 592 H SER 83 H SER 83 6.741 25.271 -13.939 593 HA SER 83 HA SER 83 5.828 27.156 -11.939 594 1HB SER 83 1HB SER 83 4.111 25.515 -11.754 595 2HB SER 83 2HB SER 83 5.224 24.185 -12.008 596 HG SER 83 HG SER 83 5.280 25.930 -9.695 597 H ARG 84 H ARG 84 7.712 24.139 -12.661 598 HA ARG 84 HA ARG 84 9.498 24.768 -10.511 599 1HB ARG 84 1HB ARG 84 10.576 22.610 -11.087 600 2HB ARG 84 2HB ARG 84 8.841 22.404 -10.953 601 1HG ARG 84 1HG ARG 84 8.561 22.395 -13.364 602 2HG ARG 84 2HG ARG 84 10.204 22.946 -13.625 603 1HD ARG 84 1HD ARG 84 10.979 20.770 -12.457 604 2HD ARG 84 2HD ARG 84 9.317 20.225 -12.568 605 HE ARG 84 HE ARG 84 11.230 20.366 -14.745 606 2HH1 ARG 84 1HH ARG 84 8.944 19.668 -17.266 607 1HH2 ARG 84 2HH2 ARG 84 7.770 20.621 -14.022 608 2HH2 ARG 84 1HH2 ARG 84 7.277 20.166 -15.619 609 H ALA 85 H ALA 85 9.146 26.343 -13.212 610 HA ALA 85 HA ALA 85 11.223 26.065 -14.913 611 1HB ALA 85 3HB ALA 85 11.077 28.764 -14.764 612 2HB ALA 85 2HB ALA 85 9.592 28.340 -13.878 613 3HB ALA 85 1HB ALA 85 9.828 27.767 -15.547 614 H ASP 86 H ASP 86 11.314 27.055 -11.521 615 HA ASP 86 HA ASP 86 14.005 28.019 -11.805 616 1HB ASP 86 1HB ASP 86 12.649 27.541 -9.145 617 2HB ASP 86 2HB ASP 86 13.792 28.796 -9.581 618 HD2 ASP 86 HD ASP 86 10.981 29.126 -8.441 619 H GLU 87 H GLU 87 13.686 25.278 -12.561 620 HA GLU 87 HA GLU 87 14.318 23.675 -10.279 621 1HB GLU 87 1HB GLU 87 14.360 21.808 -11.905 622 2HB GLU 87 2HB GLU 87 12.898 22.759 -12.069 623 1HG GLU 87 1HG GLU 87 13.390 23.018 -14.267 624 2HG GLU 87 2HG GLU 87 14.743 24.025 -13.795 625 HE2 GLU 87 HE GLU 87 16.916 22.062 -13.286 626 H GLU 88 H GLU 88 16.026 25.788 -12.301 627 HA GLU 88 HA GLU 88 18.388 24.226 -12.536 628 1HB GLU 88 1HB GLU 88 17.689 26.030 -14.161 629 2HB GLU 88 2HB GLU 88 18.012 27.228 -12.923 630 1HG GLU 88 1HG GLU 88 20.207 27.227 -13.477 631 2HG GLU 88 2HG GLU 88 20.323 25.530 -13.055 632 HE2 GLU 88 HE GLU 88 20.407 27.679 -15.524 633 H GLN 89 H GLN 89 16.869 25.830 -9.966 634 HA GLN 89 HA GLN 89 19.377 26.613 -8.752 635 1HB GLN 89 1HB GLN 89 18.064 27.828 -7.152 636 2HB GLN 89 2HB GLN 89 17.330 28.124 -8.715 637 1HG GLN 89 1HG GLN 89 15.361 27.360 -7.894 638 2HG GLN 89 2HG GLN 89 16.074 25.766 -7.751 639 1HE2 GLN 89 1HE2 GLN 89 14.101 27.094 -6.082 640 2HE2 GLN 89 2HE2 GLN 89 14.723 27.135 -4.465 641 H GLN 90 H GLN 90 18.483 23.744 -9.270 642 HA GLN 90 HA GLN 90 17.741 22.689 -6.773 643 1HB GLN 90 1HB GLN 90 18.293 20.487 -7.849 644 2HB GLN 90 2HB GLN 90 17.211 21.477 -8.808 645 1HG GLN 90 1HG GLN 90 18.815 21.910 -10.443 646 2HG GLN 90 2HG GLN 90 20.153 21.822 -9.314 647 1HE2 GLN 90 1HE2 GLN 90 20.530 20.602 -11.600 648 2HE2 GLN 90 2HE2 GLN 90 20.430 18.876 -11.484 649 H GLN 91 H GLN 91 20.591 24.154 -7.769 650 HA GLN 91 HA GLN 91 22.521 22.402 -6.826 651 1HB GLN 91 1HB GLN 91 22.380 25.096 -7.843 652 2HB GLN 91 2HB GLN 91 23.366 25.120 -6.394 653 1HG GLN 91 1HG GLN 91 24.297 22.831 -7.660 654 2HG GLN 91 2HG GLN 91 23.908 23.854 -9.029 655 1HE2 GLN 91 1HE2 GLN 91 26.490 23.027 -8.293 656 2HE2 GLN 91 2HE2 GLN 91 27.439 24.411 -7.865 657 H ALA 92 H ALA 92 20.050 24.076 -5.155 658 HA ALA 92 HA ALA 92 21.583 24.358 -2.706 659 1HB ALA 92 3HB ALA 92 19.923 26.079 -3.514 660 2HB ALA 92 1HB ALA 92 18.634 24.882 -3.242 661 3HB ALA 92 2HB ALA 92 19.606 25.471 -1.871 662 H LEU 93 H LEU 93 20.734 21.722 -4.232 663 HA LEU 93 HA LEU 93 18.993 20.474 -2.330 664 1HB LEU 93 1HB LEU 93 18.727 19.736 -4.514 665 2HB LEU 93 2HB LEU 93 20.451 19.627 -4.806 666 HG LEU 93 HG LEU 93 19.596 17.820 -2.678 667 1HD1 LEU 93 1HD1 LEU 93 17.588 18.070 -4.430 668 2HD1 LEU 93 2HD1 LEU 93 18.583 16.888 -5.314 669 3HD1 LEU 93 3HD1 LEU 93 18.021 16.522 -3.665 670 1HD2 LEU 93 3HD2 LEU 93 21.716 17.974 -4.303 671 2HD2 LEU 93 1HD2 LEU 93 21.165 16.448 -3.571 672 3HD2 LEU 93 2HD2 LEU 93 20.722 16.841 -5.250 673 H SER 94 H SER 94 20.708 21.428 -0.630 674 HA SER 94 HA SER 94 22.875 19.543 -0.327 675 1HB SER 94 1HB SER 94 23.188 22.058 -0.058 676 2HB SER 94 2HB SER 94 22.203 21.972 1.389 677 HG SER 94 HG SER 94 24.285 20.086 1.325 678 H SER 95 H SER 95 19.680 20.356 0.922 679 HA SER 95 HA SER 95 19.763 19.432 3.451 680 1HB SER 95 1HB SER 95 17.313 18.576 2.818 681 2HB SER 95 2HB SER 95 17.687 20.286 2.900 682 HG SER 95 HG SER 95 16.826 18.841 0.760 683 H GLN 96 H GLN 96 18.677 17.422 0.607 684 HA GLN 96 HA GLN 96 18.767 15.044 2.001 685 1HB GLN 96 1HB GLN 96 17.540 15.383 -0.130 686 2HB GLN 96 2HB GLN 96 19.056 15.542 -0.996 687 1HG GLN 96 1HG GLN 96 18.622 13.063 0.675 688 2HG GLN 96 2HG GLN 96 17.770 13.191 -0.851 689 1HE2 GLN 96 1HE2 GLN 96 19.018 13.653 -2.784 690 2HE2 GLN 96 2HE2 GLN 96 20.631 13.042 -2.942 691 H MET 97 H MET 97 21.239 16.747 0.012 692 HA MET 97 HA MET 97 23.085 14.839 -0.306 693 1HB MET 97 1HB MET 97 23.006 17.518 -0.709 694 2HB MET 97 2HB MET 97 23.992 17.538 0.739 695 1HG MET 97 1HG MET 97 25.162 15.501 -0.807 696 2HG MET 97 2HG MET 97 24.711 16.702 -2.000 697 1HE MET 97 2HE MET 97 27.272 15.772 -1.694 698 2HE MET 97 3HE MET 97 27.896 17.355 -2.218 699 3HE MET 97 1HE MET 97 28.485 16.621 -0.706 700 H GLY 98 H GLY 98 23.370 13.268 1.298 701 1HA GLY 98 2HA GLY 98 23.854 12.401 3.339 702 2HA GLY 98 1HA GLY 98 23.749 13.998 4.052 703 H PHE 99 H PHE 99 25.765 12.385 4.962 704 HA PHE 99 HA PHE 99 28.114 13.636 3.738 705 1HB PHE 99 1HB PHE 99 27.640 14.189 6.122 706 2HB PHE 99 2HB PHE 99 27.438 12.493 6.511 707 HD1 PHE 99 1HD PHE 99 29.158 11.600 7.738 708 HD2 PHE 99 2HD PHE 99 30.069 14.577 4.855 709 HE1 PHE 99 1HE PHE 99 31.588 11.451 8.352 710 HE2 PHE 99 2HE PHE 99 32.499 14.428 5.468 711 HZ PHE 99 HZ PHE 99 33.229 12.867 7.209 712 H MET 601 H MET 601 7.325 -19.899 -19.331 713 HA MET 601 HA MET 601 8.664 -21.671 -20.098 714 1HB MET 601 1HB MET 601 8.731 -20.946 -17.158 715 2HB MET 601 2HB MET 601 9.815 -22.214 -17.694 716 1HG MET 601 1HG MET 601 9.875 -19.924 -19.538 717 2HG MET 601 2HG MET 601 10.248 -19.425 -17.900 718 1HE MET 601 3HE MET 601 11.921 -19.756 -16.688 719 2HE MET 601 1HE MET 601 13.266 -20.915 -16.809 720 3HE MET 601 2HE MET 601 13.320 -19.390 -17.725 721 H THR 602 H THR 602 6.606 -22.589 -17.268 722 HA THR 602 HA THR 602 7.273 -25.307 -17.259 723 HB THR 602 HB THR 602 6.142 -24.062 -15.406 724 HG1 THR 602 1HG THR 602 5.173 -26.020 -14.982 725 1HG2 THR 602 2HG2 THR 602 3.765 -24.115 -17.339 726 2HG2 THR 602 3HG2 THR 602 3.648 -23.737 -15.604 727 3HG2 THR 602 1HG2 THR 602 4.553 -22.656 -16.691 728 H GLU 603 H GLU 603 5.308 -23.411 -19.455 729 HA GLU 603 HA GLU 603 4.922 -25.792 -20.994 730 1HB GLU 603 1HB GLU 603 2.681 -24.412 -19.571 731 2HB GLU 603 2HB GLU 603 2.373 -24.855 -21.238 732 1HG GLU 603 1HG GLU 603 3.551 -27.168 -20.331 733 2HG GLU 603 2HG GLU 603 2.793 -26.608 -18.854 734 HE2 GLU 603 HE GLU 603 1.795 -28.710 -21.224 735 H GLN 604 H GLN 604 5.627 -25.199 -22.995 736 HA GLN 604 HA GLN 604 5.954 -22.525 -23.678 737 1HB GLN 604 1HB GLN 604 6.994 -24.849 -24.587 738 2HB GLN 604 2HB GLN 604 5.789 -24.607 -25.837 739 1HG GLN 604 1HG GLN 604 6.715 -22.462 -26.459 740 2HG GLN 604 2HG GLN 604 7.704 -22.385 -25.015 741 1HE2 GLN 604 1HE2 GLN 604 9.409 -23.957 -24.743 742 2HE2 GLN 604 2HE2 GLN 604 10.243 -24.593 -26.122 743 H GLN 605 H GLN 605 3.525 -25.013 -24.704 744 HA GLN 605 HA GLN 605 2.184 -23.762 -26.595 745 1HB GLN 605 1HB GLN 605 0.089 -24.844 -25.663 746 2HB GLN 605 2HB GLN 605 1.462 -25.923 -25.817 747 1HG GLN 605 1HG GLN 605 1.996 -25.586 -23.393 748 2HG GLN 605 2HG GLN 605 0.620 -24.512 -23.240 749 1HE2 GLN 605 1HE2 GLN 605 -1.022 -25.426 -22.297 750 2HE2 GLN 605 2HE2 GLN 605 -1.569 -27.060 -22.472 751 H TRP 606 H TRP 606 2.081 -22.948 -23.098 752 HA TRP 606 HA TRP 606 1.319 -20.288 -23.655 753 1HB TRP 606 1HB TRP 606 -0.838 -22.203 -23.249 754 2HB TRP 606 2HB TRP 606 -0.855 -20.928 -22.047 755 HD1 TRP 606 HD TRP 606 -1.588 -21.527 -25.727 756 HE1 TRP 606 1HE TRP 606 -2.581 -19.382 -26.901 757 HE3 TRP 606 3HE TRP 606 -0.642 -18.340 -21.880 758 HZ2 TRP 606 2HZ TRP 606 -2.853 -16.655 -26.106 759 HZ3 TRP 606 3HZ TRP 606 -1.302 -15.953 -22.160 760 HH2 TRP 606 HH TRP 606 -2.372 -15.096 -24.183 761 H ASN 607 H ASN 607 3.181 -19.895 -22.364 762 HA ASN 607 HA ASN 607 3.943 -21.111 -20.127 763 1HB ASN 607 1HB ASN 607 5.309 -19.325 -20.976 764 2HB ASN 607 2HB ASN 607 3.995 -18.168 -20.908 765 1HD2 ASN 607 1HD2 ASN 607 5.441 -16.799 -19.769 766 2HD2 ASN 607 2HD2 ASN 607 5.711 -16.982 -18.068 767 H PHE 608 H PHE 608 2.268 -21.804 -18.681 768 HA PHE 608 HA PHE 608 0.086 -20.300 -17.923 769 1HB PHE 608 1HB PHE 608 1.067 -22.831 -17.522 770 2HB PHE 608 2HB PHE 608 1.505 -22.142 -15.972 771 HD1 PHE 608 1HD PHE 608 -1.418 -22.556 -18.243 772 HD2 PHE 608 2HD PHE 608 -0.056 -22.097 -14.250 773 HE1 PHE 608 1HE PHE 608 -3.746 -22.969 -17.401 774 HE2 PHE 608 2HE PHE 608 -2.384 -22.509 -13.408 775 HZ PHE 608 HZ PHE 608 -4.202 -22.940 -14.994 776 H ALA 609 H ALA 609 3.369 -20.556 -16.431 777 HA ALA 609 HA ALA 609 2.804 -19.061 -14.152 778 1HB ALA 609 3HB ALA 609 5.450 -19.150 -15.643 779 2HB ALA 609 2HB ALA 609 4.831 -20.519 -14.688 780 3HB ALA 609 1HB ALA 609 5.181 -18.965 -13.893 781 H GLY 610 H GLY 610 2.900 -18.157 -17.486 782 1HA GLY 610 2HA GLY 610 3.186 -16.145 -18.533 783 2HA GLY 610 1HA GLY 610 3.703 -15.413 -17.028 784 H ILE 611 H ILE 611 0.719 -16.980 -18.408 785 HA ILE 611 HA ILE 611 -0.812 -14.639 -18.041 786 HB ILE 611 HB ILE 611 -1.332 -16.165 -19.792 787 1HG1 ILE 611 1HG1 ILE 611 -3.396 -15.862 -17.626 788 2HG1 ILE 611 2HG1 ILE 611 -3.262 -15.022 -19.159 789 1HG2 ILE 611 1HG2 ILE 611 -0.697 -18.168 -17.969 790 2HG2 ILE 611 2HG2 ILE 611 -2.442 -18.371 -18.256 791 3HG2 ILE 611 3HG2 ILE 611 -1.307 -18.383 -19.627 792 1HD1 ILE 611 3HD1 ILE 611 -3.482 -17.719 -19.914 793 2HD1 ILE 611 1HD1 ILE 611 -4.604 -17.557 -18.542 794 3HD1 ILE 611 2HD1 ILE 611 -4.781 -16.503 -19.965 795 H GLU 612 H GLU 612 0.001 -17.426 -16.017 796 HA GLU 612 HA GLU 612 -2.119 -17.309 -14.273 797 1HB GLU 612 1HB GLU 612 -0.551 -19.166 -14.249 798 2HB GLU 612 2HB GLU 612 0.789 -18.109 -13.849 799 1HG GLU 612 1HG GLU 612 0.368 -18.550 -11.663 800 2HG GLU 612 2HG GLU 612 -1.086 -17.583 -11.819 801 HE2 GLU 612 HE GLU 612 -2.449 -19.406 -10.427 802 H ALA 613 H ALA 613 0.913 -15.394 -14.441 803 HA ALA 613 HA ALA 613 0.271 -14.032 -11.970 804 1HB ALA 613 1HB ALA 613 2.606 -14.698 -12.643 805 2HB ALA 613 3HB ALA 613 2.421 -12.964 -12.286 806 3HB ALA 613 2HB ALA 613 2.503 -13.522 -13.975 807 H ALA 614 H ALA 614 -0.449 -13.812 -15.349 808 HA ALA 614 HA ALA 614 -0.533 -11.061 -15.714 809 1HB ALA 614 3HB ALA 614 -2.326 -13.228 -16.884 810 2HB ALA 614 1HB ALA 614 -2.057 -11.605 -17.565 811 3HB ALA 614 2HB ALA 614 -0.718 -12.775 -17.498 812 H ALA 615 H ALA 615 -3.103 -13.365 -14.583 813 HA ALA 615 HA ALA 615 -5.104 -11.496 -14.243 814 1HB ALA 615 1HB ALA 615 -6.233 -13.274 -13.386 815 2HB ALA 615 2HB ALA 615 -4.806 -14.200 -13.909 816 3HB ALA 615 3HB ALA 615 -4.945 -13.658 -12.220 817 H SER 616 H SER 616 -2.601 -12.653 -11.883 818 HA SER 616 HA SER 616 -3.428 -11.186 -9.752 819 1HB SER 616 1HB SER 616 -1.209 -12.780 -10.423 820 2HB SER 616 2HB SER 616 -0.497 -11.238 -9.991 821 HG SER 616 HG SER 616 -2.460 -12.583 -8.343 822 H ALA 617 H ALA 617 -1.672 -10.178 -12.679 823 HA ALA 617 HA ALA 617 -0.811 -7.678 -11.637 824 1HB ALA 617 1HB ALA 617 -0.549 -9.254 -14.044 825 2HB ALA 617 3HB ALA 617 0.441 -7.883 -13.489 826 3HB ALA 617 2HB ALA 617 -1.013 -7.589 -14.472 827 H ILE 618 H ILE 618 -3.647 -8.870 -13.514 828 HA ILE 618 HA ILE 618 -4.737 -6.380 -14.093 829 HB ILE 618 HB ILE 618 -6.048 -9.066 -13.667 830 1HG1 ILE 618 1HG1 ILE 618 -4.359 -9.128 -15.407 831 2HG1 ILE 618 2HG1 ILE 618 -5.960 -9.233 -16.113 832 1HG2 ILE 618 1HG2 ILE 618 -7.598 -7.088 -13.471 833 2HG2 ILE 618 2HG2 ILE 618 -7.189 -6.696 -15.159 834 3HG2 ILE 618 3HG2 ILE 618 -7.982 -8.242 -14.771 835 1HD1 ILE 618 1HD1 ILE 618 -5.412 -6.457 -15.988 836 2HD1 ILE 618 2HD1 ILE 618 -3.897 -7.215 -16.534 837 3HD1 ILE 618 3HD1 ILE 618 -5.404 -7.485 -17.441 838 H GLN 619 H GLN 619 -5.040 -8.518 -11.207 839 HA GLN 619 HA GLN 619 -7.021 -7.079 -9.956 840 1HB GLN 619 1HB GLN 619 -5.096 -9.170 -9.268 841 2HB GLN 619 2HB GLN 619 -5.333 -8.081 -7.916 842 1HG GLN 619 1HG GLN 619 -7.656 -9.301 -9.472 843 2HG GLN 619 2HG GLN 619 -6.956 -10.070 -8.061 844 1HE2 GLN 619 1HE2 GLN 619 -9.549 -8.551 -8.877 845 2HE2 GLN 619 2HE2 GLN 619 -9.885 -7.532 -7.516 846 H GLY 620 H GLY 620 -3.415 -6.873 -9.506 847 1HA GLY 620 2HA GLY 620 -2.105 -5.211 -8.752 848 2HA GLY 620 1HA GLY 620 -3.433 -4.729 -7.715 849 H ASN 621 H ASN 621 -3.499 -4.864 -11.316 850 HA ASN 621 HA ASN 621 -2.999 -2.120 -11.615 851 1HB ASN 621 1HB ASN 621 -4.143 -4.290 -13.428 852 2HB ASN 621 2HB ASN 621 -4.048 -2.629 -13.977 853 1HD2 ASN 621 1HD2 ASN 621 -1.894 -1.545 -13.627 854 2HD2 ASN 621 2HD2 ASN 621 -0.467 -2.451 -14.000 855 H VAL 622 H VAL 622 -5.875 -4.212 -11.206 856 HA VAL 622 HA VAL 622 -7.825 -2.412 -12.072 857 HB VAL 622 HB VAL 622 -7.773 -4.771 -10.208 858 1HG1 VAL 622 2HG1 VAL 622 -10.047 -2.866 -10.729 859 2HG1 VAL 622 3HG1 VAL 622 -10.368 -4.593 -10.442 860 3HG1 VAL 622 1HG1 VAL 622 -9.531 -3.626 -9.204 861 1HG2 VAL 622 3HG2 VAL 622 -7.756 -4.621 -12.931 862 2HG2 VAL 622 1HG2 VAL 622 -8.409 -5.990 -12.000 863 3HG2 VAL 622 2HG2 VAL 622 -9.503 -4.724 -12.607 864 H THR 623 H THR 623 -6.578 -3.127 -8.732 865 HA THR 623 HA THR 623 -8.089 -1.117 -7.489 866 HB THR 623 HB THR 623 -6.435 -1.544 -5.625 867 HG1 THR 623 1HG THR 623 -4.829 -3.296 -6.375 868 1HG2 THR 623 1HG2 THR 623 -7.464 -3.951 -7.202 869 2HG2 THR 623 2HG2 THR 623 -6.609 -4.129 -5.651 870 3HG2 THR 623 3HG2 THR 623 -8.153 -3.247 -5.720 871 H SER 624 H SER 624 -4.884 -1.079 -9.088 872 HA SER 624 HA SER 624 -3.967 1.289 -8.148 873 1HB SER 624 1HB SER 624 -3.229 -0.520 -10.126 874 2HB SER 624 2HB SER 624 -3.553 0.927 -11.060 875 HG SER 624 HG SER 624 -1.534 0.430 -9.129 876 H ILE 625 H ILE 625 -6.221 0.675 -10.917 877 HA ILE 625 HA ILE 625 -6.473 3.446 -11.524 878 HB ILE 625 HB ILE 625 -7.655 0.884 -12.464 879 1HG1 ILE 625 1HG1 ILE 625 -7.081 2.563 -14.606 880 2HG1 ILE 625 2HG1 ILE 625 -5.847 2.971 -13.430 881 1HG2 ILE 625 3HG2 ILE 625 -8.968 3.581 -12.767 882 2HG2 ILE 625 1HG2 ILE 625 -9.174 2.291 -13.976 883 3HG2 ILE 625 2HG2 ILE 625 -9.691 2.025 -12.294 884 1HD1 ILE 625 1HD1 ILE 625 -6.449 0.052 -13.878 885 2HD1 ILE 625 2HD1 ILE 625 -5.517 0.926 -15.116 886 3HD1 ILE 625 3HD1 ILE 625 -4.910 0.836 -13.445 887 H HIS 626 H HIS 626 -8.128 1.085 -9.433 888 HA HIS 626 HA HIS 626 -10.476 2.501 -9.039 889 1HB HIS 626 1HB HIS 626 -9.783 0.102 -8.354 890 2HB HIS 626 2HB HIS 626 -9.135 0.844 -6.905 891 HD1 HIS 626 1HD HIS 626 -11.152 -0.888 -5.974 892 HD2 HIS 626 2HD HIS 626 -12.290 2.748 -7.728 893 HE1 HIS 626 1HE HIS 626 -13.539 -0.434 -5.194 894 H SER 627 H SER 627 -7.289 2.651 -7.339 895 HA SER 627 HA SER 627 -8.262 4.685 -5.602 896 1HB SER 627 1HB SER 627 -6.361 2.857 -5.249 897 2HB SER 627 2HB SER 627 -5.328 4.068 -5.982 898 HG SER 627 HG SER 627 -5.621 5.440 -4.276 899 H LEU 628 H LEU 628 -5.948 4.436 -8.384 900 HA LEU 628 HA LEU 628 -4.983 6.947 -8.500 901 1HB LEU 628 1HB LEU 628 -5.684 4.890 -10.528 902 2HB LEU 628 2HB LEU 628 -5.321 6.501 -11.114 903 HG LEU 628 HG LEU 628 -3.395 5.318 -9.173 904 1HD1 LEU 628 3HD1 LEU 628 -4.178 3.940 -11.608 905 2HD1 LEU 628 1HD1 LEU 628 -2.460 4.403 -11.632 906 3HD1 LEU 628 2HD1 LEU 628 -3.098 3.420 -10.293 907 1HD2 LEU 628 2HD2 LEU 628 -3.340 7.618 -10.435 908 2HD2 LEU 628 3HD2 LEU 628 -1.850 6.672 -10.201 909 3HD2 LEU 628 1HD2 LEU 628 -2.691 6.636 -11.770 910 H LEU 629 H LEU 629 -8.127 5.852 -9.955 911 HA LEU 629 HA LEU 629 -8.918 8.303 -10.916 912 1HB LEU 629 1HB LEU 629 -10.067 5.712 -10.414 913 2HB LEU 629 2HB LEU 629 -11.218 6.963 -9.988 914 HG LEU 629 HG LEU 629 -11.389 6.096 -12.334 915 1HD1 LEU 629 3HD1 LEU 629 -11.115 8.972 -11.599 916 2HD1 LEU 629 1HD1 LEU 629 -11.277 8.564 -13.324 917 3HD1 LEU 629 2HD1 LEU 629 -12.532 8.057 -12.168 918 1HD2 LEU 629 2HD2 LEU 629 -8.849 5.969 -12.603 919 2HD2 LEU 629 3HD2 LEU 629 -9.793 6.571 -13.986 920 3HD2 LEU 629 1HD2 LEU 629 -8.916 7.715 -12.942 921 H ASP 630 H ASP 630 -9.262 6.897 -7.614 922 HA ASP 630 HA ASP 630 -10.812 8.999 -6.648 923 1HB ASP 630 1HB ASP 630 -10.252 6.608 -5.665 924 2HB ASP 630 2HB ASP 630 -8.870 7.406 -4.941 925 HD2 ASP 630 HD ASP 630 -9.313 7.804 -2.941 926 H GLU 631 H GLU 631 -7.339 8.469 -7.176 927 HA GLU 631 HA GLU 631 -6.482 10.492 -5.403 928 1HB GLU 631 1HB GLU 631 -5.256 8.639 -7.377 929 2HB GLU 631 2HB GLU 631 -4.401 10.157 -7.190 930 1HG GLU 631 1HG GLU 631 -5.096 8.157 -4.995 931 2HG GLU 631 2HG GLU 631 -3.496 8.575 -5.574 932 HE2 GLU 631 HE GLU 631 -2.760 10.609 -5.099 933 H GLY 632 H GLY 632 -7.102 10.259 -8.952 934 1HA GLY 632 2HA GLY 632 -7.125 11.839 -10.567 935 2HA GLY 632 1HA GLY 632 -6.227 12.918 -9.517 936 H LYS 633 H LYS 633 -9.357 11.334 -8.706 937 HA LYS 633 HA LYS 633 -11.033 13.409 -9.459 938 1HB LYS 633 1HB LYS 633 -11.574 10.997 -8.754 939 2HB LYS 633 2HB LYS 633 -11.516 11.580 -7.103 940 1HG LYS 633 1HG LYS 633 -13.821 11.728 -7.808 941 2HG LYS 633 2HG LYS 633 -13.211 13.369 -7.744 942 1HD LYS 633 1HD LYS 633 -12.586 12.638 -10.353 943 2HD LYS 633 2HD LYS 633 -14.085 11.768 -10.090 944 1HE LYS 633 1HE LYS 633 -15.205 13.874 -9.373 945 2HE LYS 633 2HE LYS 633 -13.704 14.756 -9.566 946 H GLN 634 H GLN 634 -8.920 12.981 -6.631 947 HA GLN 634 HA GLN 634 -10.141 15.017 -5.127 948 1HB GLN 634 1HB GLN 634 -7.465 13.591 -4.978 949 2HB GLN 634 2HB GLN 634 -7.851 14.901 -3.880 950 1HG GLN 634 1HG GLN 634 -10.033 12.912 -4.113 951 2HG GLN 634 2HG GLN 634 -8.539 12.218 -3.518 952 1HE2 GLN 634 1HE2 GLN 634 -8.682 12.038 -1.416 953 2HE2 GLN 634 2HE2 GLN 634 -9.193 13.253 -0.293 954 H SER 635 H SER 635 -7.923 14.956 -7.828 955 HA SER 635 HA SER 635 -6.975 17.613 -7.229 956 1HB SER 635 1HB SER 635 -5.947 15.363 -8.658 957 2HB SER 635 2HB SER 635 -6.174 16.633 -9.843 958 HG SER 635 HG SER 635 -4.839 18.032 -8.626 959 H LEU 636 H LEU 636 -9.251 15.844 -9.307 960 HA LEU 636 HA LEU 636 -9.658 17.549 -11.372 961 1HB LEU 636 1HB LEU 636 -11.069 15.433 -10.054 962 2HB LEU 636 2HB LEU 636 -12.209 16.695 -10.477 963 HG LEU 636 HG LEU 636 -11.919 14.869 -12.180 964 1HD1 LEU 636 2HD1 LEU 636 -12.544 17.458 -12.527 965 2HD1 LEU 636 3HD1 LEU 636 -11.119 17.357 -13.589 966 3HD1 LEU 636 1HD1 LEU 636 -12.505 16.272 -13.854 967 1HD2 LEU 636 3HD2 LEU 636 -9.361 14.840 -11.807 968 2HD2 LEU 636 1HD2 LEU 636 -9.993 14.610 -13.455 969 3HD2 LEU 636 2HD2 LEU 636 -9.332 16.189 -12.968 970 H THR 637 H THR 637 -11.161 17.761 -8.076 971 HA THR 637 HA THR 637 -12.490 20.197 -8.660 972 HB THR 637 HB THR 637 -13.446 18.924 -6.913 973 HG1 THR 637 1HG THR 637 -12.898 20.255 -5.009 974 1HG2 THR 637 3HG2 THR 637 -10.566 18.377 -6.179 975 2HG2 THR 637 1HG2 THR 637 -11.772 18.386 -4.870 976 3HG2 THR 637 2HG2 THR 637 -11.945 17.253 -6.231 977 H LYS 638 H LYS 638 -9.194 19.383 -7.821 978 HA LYS 638 HA LYS 638 -8.637 22.026 -6.817 979 1HB LYS 638 1HB LYS 638 -6.904 19.602 -7.364 980 2HB LYS 638 2HB LYS 638 -6.275 21.127 -6.773 981 1HG LYS 638 1HG LYS 638 -8.129 20.909 -4.912 982 2HG LYS 638 2HG LYS 638 -8.197 19.225 -5.392 983 1HD LYS 638 1HD LYS 638 -5.563 20.585 -4.690 984 2HD LYS 638 2HD LYS 638 -6.574 19.847 -3.464 985 1HE LYS 638 1HE LYS 638 -6.489 17.819 -5.331 986 2HE LYS 638 2HE LYS 638 -4.919 18.554 -5.586 987 H LEU 639 H LEU 639 -8.577 20.238 -9.868 988 HA LEU 639 HA LEU 639 -7.039 22.373 -11.118 989 1HB LEU 639 1HB LEU 639 -7.947 19.650 -12.041 990 2HB LEU 639 2HB LEU 639 -7.220 20.827 -13.118 991 HG LEU 639 HG LEU 639 -5.392 19.564 -12.574 992 1HD1 LEU 639 2HD1 LEU 639 -5.073 21.982 -11.907 993 2HD1 LEU 639 3HD1 LEU 639 -5.291 21.458 -10.220 994 3HD1 LEU 639 1HD1 LEU 639 -3.939 20.816 -11.184 995 1HD2 LEU 639 3HD2 LEU 639 -6.819 18.245 -10.863 996 2HD2 LEU 639 1HD2 LEU 639 -5.049 18.272 -10.677 997 3HD2 LEU 639 2HD2 LEU 639 -6.068 19.313 -9.654 998 H ALA 640 H ALA 640 -10.264 21.547 -10.355 999 HA ALA 640 HA ALA 640 -11.744 22.125 -12.544 1000 1HB ALA 640 2HB ALA 640 -12.455 21.509 -10.158 1001 2HB ALA 640 1HB ALA 640 -13.495 22.668 -11.020 1002 3HB ALA 640 3HB ALA 640 -12.347 23.247 -9.789 1003 H ALA 641 H ALA 641 -10.154 24.467 -10.291 1004 HA ALA 641 HA ALA 641 -11.157 26.791 -11.361 1005 1HB ALA 641 3HB ALA 641 -9.697 27.741 -9.909 1006 2HB ALA 641 1HB ALA 641 -9.354 26.069 -9.404 1007 3HB ALA 641 2HB ALA 641 -8.304 26.872 -10.596 1008 H ALA 642 H ALA 642 -8.703 24.544 -12.611 1009 HA ALA 642 HA ALA 642 -7.472 26.247 -14.435 1010 1HB ALA 642 1HB ALA 642 -7.019 23.756 -13.613 1011 2HB ALA 642 3HB ALA 642 -6.457 24.316 -15.207 1012 3HB ALA 642 2HB ALA 642 -7.948 23.351 -15.077 1013 H TRP 643 H TRP 643 -10.691 24.885 -14.326 1014 HA TRP 643 HA TRP 643 -11.074 25.289 -17.183 1015 1HB TRP 643 1HB TRP 643 -12.690 24.019 -14.990 1016 2HB TRP 643 2HB TRP 643 -13.436 24.473 -16.509 1017 HD1 TRP 643 HD TRP 643 -12.934 22.893 -18.616 1018 HE1 TRP 643 1HE TRP 643 -11.726 20.581 -19.015 1019 HE3 TRP 643 3HE TRP 643 -10.647 22.707 -14.078 1020 HZ2 TRP 643 2HZ TRP 643 -9.988 18.971 -17.425 1021 HZ3 TRP 643 3HZ TRP 643 -9.212 20.731 -13.581 1022 HH2 TRP 643 HH TRP 643 -8.865 18.904 -15.168 1023 H GLY 644 H GLY 644 -10.926 27.140 -14.398 1024 1HA GLY 644 2HA GLY 644 -12.889 29.070 -15.475 1025 2HA GLY 644 1HA GLY 644 -11.389 29.488 -14.670 1026 H GLY 645 H GLY 645 -12.319 26.835 -12.958 1027 1HA GLY 645 2HA GLY 645 -14.253 28.244 -11.247 1028 2HA GLY 645 1HA GLY 645 -12.737 27.696 -10.560 1029 H SER 646 H SER 646 -14.710 26.562 -9.281 1030 HA SER 646 HA SER 646 -14.894 23.919 -10.487 1031 1HB SER 646 1HB SER 646 -15.340 23.183 -8.078 1032 2HB SER 646 2HB SER 646 -13.724 23.774 -8.410 1033 HG SER 646 HG SER 646 -15.751 25.584 -7.471 1034 H GLY 647 H GLY 647 -16.654 26.763 -9.766 1035 1HA GLY 647 2HA GLY 647 -18.907 26.985 -9.063 1036 2HA GLY 647 1HA GLY 647 -19.204 25.311 -9.488 1037 H SER 648 H SER 648 -17.525 25.662 -12.051 1038 HA SER 648 HA SER 648 -19.478 27.268 -13.502 1039 1HB SER 648 1HB SER 648 -16.534 26.881 -13.769 1040 2HB SER 648 2HB SER 648 -17.415 26.904 -15.284 1041 HG SER 648 HG SER 648 -17.343 28.953 -13.247 1042 H GLU 649 H GLU 649 -20.595 26.326 -15.256 1043 HA GLU 649 HA GLU 649 -21.023 23.644 -15.198 1044 1HB GLU 649 1HB GLU 649 -22.183 23.949 -17.349 1045 2HB GLU 649 2HB GLU 649 -22.529 25.288 -16.273 1046 1HG GLU 649 1HG GLU 649 -20.612 26.563 -17.419 1047 2HG GLU 649 2HG GLU 649 -20.553 25.267 -18.598 1048 HE2 GLU 649 HE GLU 649 -21.789 28.136 -18.085 1049 H ALA 650 H ALA 650 -18.456 25.477 -16.801 1050 HA ALA 650 HA ALA 650 -17.700 23.688 -18.762 1051 1HB ALA 650 1HB ALA 650 -16.603 25.993 -17.338 1052 2HB ALA 650 3HB ALA 650 -16.376 25.491 -19.030 1053 3HB ALA 650 2HB ALA 650 -15.338 24.811 -17.753 1054 H TYR 651 H TYR 651 -16.050 24.055 -15.542 1055 HA TYR 651 HA TYR 651 -14.626 21.715 -15.663 1056 1HB TYR 651 1HB TYR 651 -14.160 23.279 -13.900 1057 2HB TYR 651 2HB TYR 651 -15.860 23.524 -13.550 1058 HD1 TYR 651 1HD TYR 651 -16.746 22.577 -11.619 1059 HD2 TYR 651 2HD TYR 651 -13.257 20.825 -13.368 1060 HE1 TYR 651 1HE TYR 651 -16.569 20.961 -9.664 1061 HE2 TYR 651 2HE TYR 651 -13.092 19.215 -11.408 1062 HH TYR 651 HH TYR 651 -15.290 19.494 -8.656 1063 H GLN 652 H GLN 652 -18.049 22.245 -14.770 1064 HA GLN 652 HA GLN 652 -18.486 19.864 -13.480 1065 1HB GLN 652 1HB GLN 652 -20.259 21.703 -15.113 1066 2HB GLN 652 2HB GLN 652 -20.909 20.224 -14.433 1067 1HG GLN 652 1HG GLN 652 -19.391 21.498 -12.354 1068 2HG GLN 652 2HG GLN 652 -20.372 22.743 -13.101 1069 1HE2 GLN 652 1HE2 GLN 652 -21.552 22.871 -11.157 1070 2HE2 GLN 652 2HE2 GLN 652 -22.798 21.734 -10.762 1071 H GLY 653 H GLY 653 -18.918 20.681 -16.997 1072 1HA GLY 653 2HA GLY 653 -18.917 19.384 -18.831 1073 2HA GLY 653 1HA GLY 653 -19.760 18.185 -17.871 1074 H VAL 654 H VAL 654 -16.576 19.294 -16.796 1075 HA VAL 654 HA VAL 654 -15.179 17.182 -18.158 1076 HB VAL 654 HB VAL 654 -14.427 19.318 -16.169 1077 1HG1 VAL 654 3HG1 VAL 654 -13.122 17.191 -15.785 1078 2HG1 VAL 654 1HG1 VAL 654 -12.496 17.358 -17.443 1079 3HG1 VAL 654 2HG1 VAL 654 -12.143 18.610 -16.229 1080 1HG2 VAL 654 2HG2 VAL 654 -14.755 19.375 -18.925 1081 2HG2 VAL 654 3HG2 VAL 654 -13.839 20.548 -17.949 1082 3HG2 VAL 654 1HG2 VAL 654 -12.997 19.182 -18.719 1083 H GLN 655 H GLN 655 -16.357 17.940 -14.836 1084 HA GLN 655 HA GLN 655 -15.154 15.881 -13.522 1085 1HB GLN 655 1HB GLN 655 -17.429 17.681 -13.088 1086 2HB GLN 655 2HB GLN 655 -17.708 16.116 -12.350 1087 1HG GLN 655 1HG GLN 655 -14.955 16.993 -11.875 1088 2HG GLN 655 2HG GLN 655 -16.087 18.220 -11.344 1089 1HE2 GLN 655 1HE2 GLN 655 -14.496 16.887 -9.571 1090 2HE2 GLN 655 2HE2 GLN 655 -15.436 15.850 -8.550 1091 H GLN 656 H GLN 656 -18.393 15.911 -15.166 1092 HA GLN 656 HA GLN 656 -18.977 13.269 -14.572 1093 1HB GLN 656 1HB GLN 656 -20.714 13.481 -16.313 1094 2HB GLN 656 2HB GLN 656 -20.668 14.913 -15.303 1095 1HG GLN 656 1HG GLN 656 -19.018 15.865 -17.127 1096 2HG GLN 656 2HG GLN 656 -19.642 14.579 -18.141 1097 1HE2 GLN 656 1HE2 GLN 656 -20.747 17.132 -15.923 1098 2HE2 GLN 656 2HE2 GLN 656 -22.139 17.626 -16.828 1099 H LYS 657 H LYS 657 -17.205 14.812 -17.289 1100 HA LYS 657 HA LYS 657 -17.062 12.511 -18.892 1101 1HB LYS 657 1HB LYS 657 -15.425 15.051 -18.756 1102 2HB LYS 657 2HB LYS 657 -15.118 13.793 -19.936 1103 1HG LYS 657 1HG LYS 657 -17.292 14.043 -20.936 1104 2HG LYS 657 2HG LYS 657 -17.905 14.960 -19.575 1105 1HD LYS 657 1HD LYS 657 -16.039 16.705 -20.170 1106 2HD LYS 657 2HD LYS 657 -15.926 15.860 -21.700 1107 1HE LYS 657 1HE LYS 657 -18.575 16.152 -21.731 1108 2HE LYS 657 2HE LYS 657 -18.258 17.429 -20.574 1109 H TRP 658 H TRP 658 -15.334 13.595 -16.009 1110 HA TRP 658 HA TRP 658 -13.106 11.850 -16.402 1111 1HB TRP 658 1HB TRP 658 -12.742 13.818 -15.143 1112 2HB TRP 658 2HB TRP 658 -14.109 13.505 -14.093 1113 HD1 TRP 658 HD TRP 658 -13.696 11.795 -12.038 1114 HE1 TRP 658 1HE TRP 658 -11.578 10.720 -10.887 1115 HE3 TRP 658 3HE TRP 658 -10.438 12.931 -15.773 1116 HZ2 TRP 658 2HZ TRP 658 -8.840 10.471 -11.651 1117 HZ3 TRP 658 3HZ TRP 658 -8.061 12.236 -15.492 1118 HH2 TRP 658 HH TRP 658 -7.245 11.046 -13.519 1119 H ASP 659 H ASP 659 -16.025 11.912 -14.227 1120 HA ASP 659 HA ASP 659 -15.539 9.402 -13.163 1121 1HB ASP 659 1HB ASP 659 -17.137 11.248 -12.337 1122 2HB ASP 659 2HB ASP 659 -18.269 10.704 -13.559 1123 HD2 ASP 659 HD ASP 659 -18.454 10.153 -10.293 1124 H ALA 660 H ALA 660 -17.038 10.569 -16.162 1125 HA ALA 660 HA ALA 660 -18.674 8.448 -16.819 1126 1HB ALA 660 2HB ALA 660 -18.926 10.190 -18.283 1127 2HB ALA 660 3HB ALA 660 -17.196 10.609 -18.251 1128 3HB ALA 660 1HB ALA 660 -17.762 9.242 -19.240 1129 H THR 661 H THR 661 -15.712 8.853 -18.778 1130 HA THR 661 HA THR 661 -15.403 6.178 -19.318 1131 HB THR 661 HB THR 661 -13.110 6.894 -20.033 1132 HG1 THR 661 1HG THR 661 -13.045 8.289 -17.963 1133 1HG2 THR 661 3HG2 THR 661 -15.408 7.859 -21.130 1134 2HG2 THR 661 1HG2 THR 661 -14.720 9.387 -20.531 1135 3HG2 THR 661 2HG2 THR 661 -13.801 8.389 -21.683 1136 H ALA 662 H ALA 662 -14.611 7.929 -16.376 1137 HA ALA 662 HA ALA 662 -12.621 6.312 -15.358 1138 1HB ALA 662 3HB ALA 662 -13.019 8.222 -14.114 1139 2HB ALA 662 2HB ALA 662 -13.876 7.020 -13.119 1140 3HB ALA 662 1HB ALA 662 -14.788 8.065 -14.235 1141 H THR 663 H THR 663 -15.938 6.126 -13.966 1142 HA THR 663 HA THR 663 -15.742 3.589 -13.007 1143 HB THR 663 HB THR 663 -17.607 4.926 -12.349 1144 HG1 THR 663 1HG THR 663 -19.415 3.583 -13.310 1145 1HG2 THR 663 3HG2 THR 663 -17.611 5.736 -15.144 1146 2HG2 THR 663 1HG2 THR 663 -19.222 5.113 -14.713 1147 3HG2 THR 663 2HG2 THR 663 -18.510 6.455 -13.786 1148 H GLU 664 H GLU 664 -16.130 4.585 -16.368 1149 HA GLU 664 HA GLU 664 -17.166 2.182 -17.303 1150 1HB GLU 664 1HB GLU 664 -17.213 4.248 -18.628 1151 2HB GLU 664 2HB GLU 664 -15.463 4.300 -18.685 1152 1HG GLU 664 1HG GLU 664 -16.308 3.378 -20.794 1153 2HG GLU 664 2HG GLU 664 -15.439 2.127 -19.929 1154 HE2 GLU 664 HE GLU 664 -16.787 0.791 -21.270 1155 H LEU 665 H LEU 665 -13.768 3.416 -17.033 1156 HA LEU 665 HA LEU 665 -12.706 0.932 -17.992 1157 1HB LEU 665 1HB LEU 665 -11.736 3.228 -18.371 1158 2HB LEU 665 2HB LEU 665 -11.258 3.233 -16.685 1159 HG LEU 665 HG LEU 665 -9.371 2.630 -18.045 1160 1HD1 LEU 665 2HD1 LEU 665 -10.104 1.301 -15.831 1161 2HD1 LEU 665 3HD1 LEU 665 -10.018 -0.063 -16.973 1162 3HD1 LEU 665 1HD1 LEU 665 -8.594 0.973 -16.714 1163 1HD2 LEU 665 2HD2 LEU 665 -10.846 1.735 -19.940 1164 2HD2 LEU 665 3HD2 LEU 665 -9.294 0.916 -19.639 1165 3HD2 LEU 665 1HD2 LEU 665 -10.812 0.185 -19.066 1166 H ASN 666 H ASN 666 -13.655 2.358 -14.917 1167 HA ASN 666 HA ASN 666 -12.008 0.764 -13.317 1168 1HB ASN 666 1HB ASN 666 -13.786 2.878 -12.910 1169 2HB ASN 666 2HB ASN 666 -14.654 1.540 -12.184 1170 1HD2 ASN 666 1HD2 ASN 666 -13.555 3.804 -10.857 1171 2HD2 ASN 666 2HD2 ASN 666 -12.364 3.261 -9.723 1172 H ASN 667 H ASN 667 -15.525 0.616 -14.265 1173 HA ASN 667 HA ASN 667 -16.072 -1.743 -12.948 1174 1HB ASN 667 1HB ASN 667 -18.155 -1.662 -14.070 1175 2HB ASN 667 2HB ASN 667 -17.649 0.014 -14.140 1176 1HD2 ASN 667 1HD2 ASN 667 -17.824 0.955 -16.015 1177 2HD2 ASN 667 2HD2 ASN 667 -17.756 0.213 -17.579 1178 H ALA 668 H ALA 668 -14.916 -0.985 -16.288 1179 HA ALA 668 HA ALA 668 -15.131 -3.551 -17.354 1180 1HB ALA 668 3HB ALA 668 -14.711 -1.286 -18.503 1181 2HB ALA 668 2HB ALA 668 -13.812 -2.688 -19.131 1182 3HB ALA 668 1HB ALA 668 -13.000 -1.514 -18.068 1183 H LEU 669 H LEU 669 -12.593 -1.939 -15.387 1184 HA LEU 669 HA LEU 669 -10.673 -3.968 -15.718 1185 1HB LEU 669 1HB LEU 669 -11.031 -1.520 -14.178 1186 2HB LEU 669 2HB LEU 669 -10.183 -2.757 -13.271 1187 HG LEU 669 HG LEU 669 -9.336 -1.988 -16.065 1188 1HD1 LEU 669 3HD1 LEU 669 -9.440 0.022 -14.540 1189 2HD1 LEU 669 1HD1 LEU 669 -8.202 -0.774 -13.539 1190 3HD1 LEU 669 2HD1 LEU 669 -7.841 -0.348 -15.229 1191 1HD2 LEU 669 1HD2 LEU 669 -8.572 -4.120 -14.706 1192 2HD2 LEU 669 2HD2 LEU 669 -7.422 -3.180 -15.686 1193 3HD2 LEU 669 3HD2 LEU 669 -7.486 -2.947 -13.923 1194 H GLN 670 H GLN 670 -13.235 -3.348 -13.246 1195 HA GLN 670 HA GLN 670 -12.517 -5.488 -11.631 1196 1HB GLN 670 1HB GLN 670 -15.077 -3.903 -12.008 1197 2HB GLN 670 2HB GLN 670 -15.020 -5.251 -10.889 1198 1HG GLN 670 1HG GLN 670 -12.863 -4.085 -9.935 1199 2HG GLN 670 2HG GLN 670 -13.424 -2.667 -10.800 1200 1HE2 GLN 670 1HE2 GLN 670 -13.811 -4.715 -8.088 1201 2HE2 GLN 670 2HE2 GLN 670 -15.123 -3.899 -7.306 1202 H ASN 671 H ASN 671 -15.047 -5.178 -14.219 1203 HA ASN 671 HA ASN 671 -15.987 -7.751 -13.998 1204 1HB ASN 671 1HB ASN 671 -16.897 -5.726 -15.378 1205 2HB ASN 671 2HB ASN 671 -15.776 -6.217 -16.632 1206 1HD2 ASN 671 1HD2 ASN 671 -16.812 -7.215 -18.174 1207 2HD2 ASN 671 2HD2 ASN 671 -18.028 -8.436 -18.006 1208 H LEU 672 H LEU 672 -13.135 -6.333 -15.606 1209 HA LEU 672 HA LEU 672 -12.592 -8.607 -17.235 1210 1HB LEU 672 1HB LEU 672 -11.854 -6.530 -18.032 1211 2HB LEU 672 2HB LEU 672 -11.113 -6.096 -16.504 1212 HG LEU 672 HG LEU 672 -9.879 -8.501 -17.505 1213 1HD1 LEU 672 2HD1 LEU 672 -10.815 -7.263 -19.660 1214 2HD1 LEU 672 3HD1 LEU 672 -9.353 -6.276 -19.420 1215 3HD1 LEU 672 1HD1 LEU 672 -9.213 -8.038 -19.633 1216 1HD2 LEU 672 3HD2 LEU 672 -9.121 -6.483 -15.946 1217 2HD2 LEU 672 1HD2 LEU 672 -7.955 -7.467 -16.864 1218 3HD2 LEU 672 2HD2 LEU 672 -8.462 -5.878 -17.485 1219 H ALA 673 H ALA 673 -11.289 -7.277 -14.128 1220 HA ALA 673 HA ALA 673 -9.484 -9.429 -13.776 1221 1HB ALA 673 3HB ALA 673 -10.023 -6.915 -12.616 1222 2HB ALA 673 1HB ALA 673 -10.289 -8.102 -11.317 1223 3HB ALA 673 2HB ALA 673 -8.727 -8.050 -12.169 1224 H ARG 674 H ARG 674 -12.920 -9.038 -13.388 1225 HA ARG 674 HA ARG 674 -13.236 -10.850 -11.281 1226 1HB ARG 674 1HB ARG 674 -15.037 -9.607 -13.368 1227 2HB ARG 674 2HB ARG 674 -15.656 -10.971 -12.460 1228 1HG ARG 674 1HG ARG 674 -14.368 -9.165 -10.602 1229 2HG ARG 674 2HG ARG 674 -15.442 -8.225 -11.620 1230 1HD ARG 674 1HD ARG 674 -16.797 -10.682 -10.879 1231 2HD ARG 674 2HD ARG 674 -16.146 -9.947 -9.428 1232 HE ARG 674 HE ARG 674 -17.476 -8.006 -11.159 1233 2HH1 ARG 674 1HH ARG 674 -20.305 -7.729 -9.163 1234 1HH2 ARG 674 2HH2 ARG 674 -18.009 -10.421 -8.622 1235 2HH2 ARG 674 1HH2 ARG 674 -19.489 -9.704 -8.079 1236 H THR 675 H THR 675 -12.947 -11.112 -14.826 1237 HA THR 675 HA THR 675 -13.450 -14.005 -14.630 1238 HB THR 675 HB THR 675 -13.445 -12.144 -17.065 1239 HG1 THR 675 1HG THR 675 -15.180 -11.688 -15.557 1240 1HG2 THR 675 1HG2 THR 675 -13.265 -14.889 -17.083 1241 2HG2 THR 675 2HG2 THR 675 -15.027 -14.684 -16.938 1242 3HG2 THR 675 3HG2 THR 675 -14.158 -13.963 -18.313 1243 H ILE 676 H ILE 676 -10.966 -11.702 -14.666 1244 HA ILE 676 HA ILE 676 -9.166 -13.471 -16.128 1245 HB ILE 676 HB ILE 676 -9.122 -10.602 -15.297 1246 1HG1 ILE 676 1HG1 ILE 676 -8.784 -12.158 -17.857 1247 2HG1 ILE 676 2HG1 ILE 676 -9.973 -10.931 -17.464 1248 1HG2 ILE 676 2HG2 ILE 676 -6.811 -12.392 -15.272 1249 2HG2 ILE 676 3HG2 ILE 676 -6.615 -11.011 -16.378 1250 3HG2 ILE 676 1HG2 ILE 676 -6.988 -10.730 -14.660 1251 1HD1 ILE 676 1HD1 ILE 676 -7.652 -9.501 -17.098 1252 2HD1 ILE 676 2HD1 ILE 676 -7.165 -10.618 -18.396 1253 3HD1 ILE 676 3HD1 ILE 676 -8.566 -9.545 -18.625 1254 H SER 677 H SER 677 -9.400 -11.727 -12.949 1255 HA SER 677 HA SER 677 -7.241 -12.740 -11.746 1256 1HB SER 677 1HB SER 677 -8.804 -11.109 -10.725 1257 2HB SER 677 2HB SER 677 -10.007 -12.365 -10.514 1258 HG SER 677 HG SER 677 -7.560 -13.095 -9.413 1259 H GLU 678 H GLU 678 -10.259 -14.424 -12.572 1260 HA GLU 678 HA GLU 678 -9.894 -16.594 -10.852 1261 1HB GLU 678 1HB GLU 678 -11.465 -17.715 -12.648 1262 2HB GLU 678 2HB GLU 678 -12.079 -16.412 -11.649 1263 1HG GLU 678 1HG GLU 678 -12.254 -14.961 -13.418 1264 2HG GLU 678 2HG GLU 678 -10.726 -15.462 -14.112 1265 HE2 GLU 678 HE GLU 678 -11.053 -17.975 -14.563 1266 H ALA 679 H ALA 679 -8.450 -15.657 -13.914 1267 HA ALA 679 HA ALA 679 -7.803 -17.955 -15.145 1268 1HB ALA 679 3HB ALA 679 -6.136 -15.476 -14.592 1269 2HB ALA 679 1HB ALA 679 -5.616 -16.760 -15.710 1270 3HB ALA 679 2HB ALA 679 -7.108 -15.846 -16.036 1271 H GLY 680 H GLY 680 -6.558 -16.747 -12.024 1272 1HA GLY 680 2HA GLY 680 -5.583 -17.940 -10.355 1273 2HA GLY 680 1HA GLY 680 -4.307 -18.104 -11.544 1274 H GLN 681 H GLN 681 -7.265 -19.644 -10.208 1275 HA GLN 681 HA GLN 681 -6.278 -22.153 -11.325 1276 1HB GLN 681 1HB GLN 681 -7.044 -21.408 -8.542 1277 2HB GLN 681 2HB GLN 681 -7.668 -22.951 -9.092 1278 1HG GLN 681 1HG GLN 681 -5.634 -23.905 -8.807 1279 2HG GLN 681 2HG GLN 681 -4.925 -22.783 -9.952 1280 1HE2 GLN 681 1HE2 GLN 681 -5.374 -23.638 -6.660 1281 2HE2 GLN 681 2HE2 GLN 681 -4.402 -22.410 -5.921 1282 H ALA 682 H ALA 682 -9.079 -20.137 -10.342 1283 HA ALA 682 HA ALA 682 -11.195 -21.722 -10.733 1284 1HB ALA 682 3HB ALA 682 -10.579 -18.854 -11.285 1285 2HB ALA 682 1HB ALA 682 -12.080 -19.498 -11.993 1286 3HB ALA 682 2HB ALA 682 -11.820 -19.576 -10.234 1287 H MET 683 H MET 683 -9.143 -20.255 -13.319 1288 HA MET 683 HA MET 683 -10.520 -20.789 -15.512 1289 1HB MET 683 1HB MET 683 -8.138 -19.880 -15.303 1290 2HB MET 683 2HB MET 683 -7.567 -21.525 -15.107 1291 1HG MET 683 1HG MET 683 -9.310 -21.161 -17.484 1292 2HG MET 683 2HG MET 683 -7.845 -20.202 -17.543 1293 1HE MET 683 2HE MET 683 -9.266 -22.670 -18.937 1294 2HE MET 683 3HE MET 683 -7.743 -22.692 -19.859 1295 3HE MET 683 1HE MET 683 -8.285 -24.154 -19.001 1296 H ALA 684 H ALA 684 -9.195 -23.189 -13.289 1297 HA ALA 684 HA ALA 684 -9.799 -25.320 -15.206 1298 1HB ALA 684 3HB ALA 684 -7.568 -25.400 -14.243 1299 2HB ALA 684 1HB ALA 684 -8.232 -25.269 -12.596 1300 3HB ALA 684 2HB ALA 684 -8.533 -26.732 -13.564 1301 H SER 685 H SER 685 -10.643 -23.906 -12.028 1302 HA SER 685 HA SER 685 -13.036 -25.536 -12.114 1303 1HB SER 685 1HB SER 685 -11.091 -25.339 -9.789 1304 2HB SER 685 2HB SER 685 -12.775 -25.744 -9.526 1305 HG SER 685 HG SER 685 -11.358 -27.628 -9.789 1306 H THR 686 H THR 686 -12.131 -23.753 -9.202 1307 HA THR 686 HA THR 686 -12.890 -21.183 -9.858 1308 HB THR 686 HB THR 686 -15.154 -23.111 -9.471 1309 HG1 THR 686 1HG THR 686 -14.763 -21.878 -11.432 1310 1HG2 THR 686 3HG2 THR 686 -15.156 -20.264 -8.335 1311 2HG2 THR 686 1HG2 THR 686 -16.605 -21.269 -8.577 1312 3HG2 THR 686 2HG2 THR 686 -15.373 -21.756 -7.388 1313 H GLU 687 H GLU 687 -11.475 -20.385 -8.407 1314 HA GLU 687 HA GLU 687 -12.115 -20.013 -5.855 1315 1HB GLU 687 1HB GLU 687 -11.128 -22.766 -6.210 1316 2HB GLU 687 2HB GLU 687 -10.191 -21.876 -5.026 1317 1HG GLU 687 1HG GLU 687 -11.980 -21.650 -3.560 1318 2HG GLU 687 2HG GLU 687 -13.169 -21.570 -4.845 1319 HE2 GLU 687 HE GLU 687 -14.156 -23.457 -3.266 1320 H GLY 688 H GLY 688 -10.205 -19.214 -4.497 1321 1HA GLY 688 2HA GLY 688 -7.711 -18.866 -5.955 1322 2HA GLY 688 1HA GLY 688 -8.059 -18.411 -4.299 1323 H ASN 689 H ASN 689 -10.404 -17.554 -6.799 1324 HA ASN 689 HA ASN 689 -9.287 -14.873 -6.872 1325 1HB ASN 689 1HB ASN 689 -11.173 -14.710 -8.762 1326 2HB ASN 689 2HB ASN 689 -9.636 -15.474 -9.115 1327 1HD2 ASN 689 1HD2 ASN 689 -12.802 -15.769 -9.567 1328 2HD2 ASN 689 2HD2 ASN 689 -13.008 -17.486 -9.653 1329 H VAL 690 H VAL 690 -12.478 -16.647 -6.793 1330 HA VAL 690 HA VAL 690 -13.430 -15.239 -4.567 1331 HB VAL 690 HB VAL 690 -13.583 -13.309 -5.909 1332 1HG1 VAL 690 3HG1 VAL 690 -13.802 -15.100 -8.066 1333 2HG1 VAL 690 1HG1 VAL 690 -15.320 -14.171 -8.063 1334 3HG1 VAL 690 2HG1 VAL 690 -13.758 -13.322 -8.135 1335 1HG2 VAL 690 1HG2 VAL 690 -15.827 -14.489 -4.779 1336 2HG2 VAL 690 2HG2 VAL 690 -15.675 -12.791 -5.291 1337 3HG2 VAL 690 3HG2 VAL 690 -16.387 -13.993 -6.395 1338 H THR 691 H THR 691 -14.737 -16.720 -3.636 1339 HA THR 691 HA THR 691 -16.165 -18.552 -5.449 1340 HB THR 691 HB THR 691 -15.177 -18.977 -2.579 1341 HG1 THR 691 1HG THR 691 -13.375 -18.986 -3.963 1342 1HG2 THR 691 3HG2 THR 691 -17.163 -20.402 -3.762 1343 2HG2 THR 691 1HG2 THR 691 -15.768 -21.187 -4.541 1344 3HG2 THR 691 2HG2 THR 691 -15.912 -21.187 -2.767 1345 H GLY 692 H GLY 692 -16.407 -16.186 -2.852 1346 1HA GLY 692 2HA GLY 692 -18.179 -15.324 -1.768 1347 2HA GLY 692 1HA GLY 692 -18.966 -16.884 -1.900 1348 H MET 693 H MET 693 -17.861 -14.477 -4.394 1349 HA MET 693 HA MET 693 -20.530 -13.773 -5.003 1350 1HB MET 693 1HB MET 693 -17.851 -12.862 -5.577 1351 2HB MET 693 2HB MET 693 -18.631 -13.126 -7.124 1352 1HG MET 693 1HG MET 693 -20.176 -11.426 -6.801 1353 2HG MET 693 2HG MET 693 -20.292 -11.707 -5.075 1354 1HE MET 693 2HE MET 693 -18.509 -11.528 -3.578 1355 2HE MET 693 3HE MET 693 -16.953 -10.693 -3.802 1356 3HE MET 693 1HE MET 693 -18.388 -9.777 -3.284 1357 H PHE 694 H PHE 694 -17.967 -15.767 -6.607 1358 HA PHE 694 HA PHE 694 -19.186 -16.328 -8.958 1359 1HB PHE 694 1HB PHE 694 -17.256 -17.551 -7.055 1360 2HB PHE 694 2HB PHE 694 -18.078 -18.773 -8.004 1361 HD1 PHE 694 1HD PHE 694 -16.874 -15.352 -8.899 1362 HD2 PHE 694 2HD PHE 694 -16.616 -19.525 -9.623 1363 HE1 PHE 694 1HE PHE 694 -15.305 -14.923 -10.811 1364 HE2 PHE 694 2HE PHE 694 -15.047 -19.097 -11.535 1365 HZ PHE 694 HZ PHE 694 -14.411 -16.801 -12.106 1366 H ALA 695 H ALA 695 -20.277 -18.397 -9.698 1367 HA ALA 695 HA ALA 695 -22.223 -19.497 -9.688 1368 1HB ALA 695 1HB ALA 695 -22.267 -21.144 -7.620 1369 2HB ALA 695 3HB ALA 695 -20.647 -20.473 -7.314 1370 3HB ALA 695 2HB ALA 695 -20.995 -21.289 -8.857 No H/Q in entry = 1370 Start of MODEL 17 1 H ALA 1 H ALA 1 -10.692 40.807 -15.541 2 HA ALA 1 HA ALA 1 -8.868 39.426 -13.738 3 1HB ALA 1 1HB ALA 1 -10.774 37.874 -15.388 4 2HB ALA 1 3HB ALA 1 -11.532 39.084 -14.325 5 3HB ALA 1 2HB ALA 1 -10.478 37.828 -13.633 6 H GLU 2 H GLU 2 -7.135 38.215 -14.429 7 HA GLU 2 HA GLU 2 -6.813 38.098 -17.328 8 1HB GLU 2 1HB GLU 2 -4.958 38.898 -15.142 9 2HB GLU 2 2HB GLU 2 -4.251 37.837 -16.344 10 1HG GLU 2 1HG GLU 2 -5.814 39.801 -17.754 11 2HG GLU 2 2HG GLU 2 -4.854 40.659 -16.565 12 HE2 GLU 2 HE GLU 2 -3.134 38.908 -19.691 13 H MET 3 H MET 3 -5.611 36.518 -14.271 14 HA MET 3 HA MET 3 -5.621 34.013 -15.745 15 1HB MET 3 1HB MET 3 -4.229 35.044 -13.234 16 2HB MET 3 2HB MET 3 -4.342 33.318 -13.514 17 1HG MET 3 1HG MET 3 -3.268 35.185 -15.666 18 2HG MET 3 2HG MET 3 -2.223 34.573 -14.400 19 1HE MET 3 2HE MET 3 -1.349 34.101 -17.054 20 2HE MET 3 3HE MET 3 -0.584 32.985 -15.897 21 3HE MET 3 1HE MET 3 -1.239 32.365 -17.432 22 H LYS 4 H LYS 4 -7.331 32.655 -15.461 23 HA LYS 4 HA LYS 4 -9.461 33.097 -13.866 24 1HB LYS 4 1HB LYS 4 -9.891 30.624 -14.085 25 2HB LYS 4 2HB LYS 4 -9.599 31.478 -15.587 26 1HG LYS 4 1HG LYS 4 -7.043 30.776 -15.053 27 2HG LYS 4 2HG LYS 4 -7.838 29.503 -14.148 28 1HD LYS 4 1HD LYS 4 -7.790 28.442 -16.197 29 2HD LYS 4 2HD LYS 4 -9.293 29.314 -16.420 30 1HE LYS 4 1HE LYS 4 -7.349 31.194 -17.179 31 2HE LYS 4 2HE LYS 4 -6.695 29.682 -17.777 32 H THR 5 H THR 5 -6.779 30.779 -13.040 33 HA THR 5 HA THR 5 -7.377 31.363 -10.213 34 HB THR 5 HB THR 5 -8.054 29.127 -10.403 35 HG1 THR 5 1HG THR 5 -6.074 27.893 -9.776 36 1HG2 THR 5 3HG2 THR 5 -6.164 29.109 -12.743 37 2HG2 THR 5 1HG2 THR 5 -6.341 27.578 -11.852 38 3HG2 THR 5 2HG2 THR 5 -7.768 28.353 -12.583 39 H ASP 6 H ASP 6 -4.706 29.428 -11.596 40 HA ASP 6 HA ASP 6 -2.812 31.340 -11.790 41 1HB ASP 6 1HB ASP 6 -1.778 30.415 -9.337 42 2HB ASP 6 2HB ASP 6 -2.362 32.032 -9.679 43 HD2 ASP 6 HD ASP 6 -5.042 29.514 -9.099 44 H ALA 7 H ALA 7 -1.108 30.220 -12.785 45 HA ALA 7 HA ALA 7 -1.213 27.445 -13.060 46 1HB ALA 7 1HB ALA 7 -0.191 28.739 -14.774 47 2HB ALA 7 2HB ALA 7 0.892 29.557 -13.622 48 3HB ALA 7 3HB ALA 7 1.143 27.839 -14.013 49 H ALA 8 H ALA 8 0.578 29.612 -10.826 50 HA ALA 8 HA ALA 8 2.386 27.803 -9.812 51 1HB ALA 8 1HB ALA 8 2.801 29.885 -8.982 52 2HB ALA 8 2HB ALA 8 1.077 30.327 -8.946 53 3HB ALA 8 3HB ALA 8 1.769 29.335 -7.640 54 H THR 9 H THR 9 -1.049 28.425 -8.858 55 HA THR 9 HA THR 9 -0.975 26.398 -6.833 56 HB THR 9 HB THR 9 -2.528 28.644 -7.435 57 HG1 THR 9 1HG THR 9 -3.247 26.270 -5.869 58 1HG2 THR 9 3HG2 THR 9 -4.169 26.086 -7.833 59 2HG2 THR 9 1HG2 THR 9 -4.849 27.710 -7.575 60 3HG2 THR 9 2HG2 THR 9 -3.926 27.356 -9.055 61 H LEU 10 H LEU 10 -2.300 26.656 -10.183 62 HA LEU 10 HA LEU 10 -3.526 24.179 -10.228 63 1HB LEU 10 1HB LEU 10 -2.295 25.900 -12.370 64 2HB LEU 10 2HB LEU 10 -3.084 24.379 -12.739 65 HG LEU 10 HG LEU 10 -4.290 26.921 -11.670 66 1HD1 LEU 10 1HD1 LEU 10 -4.157 26.664 -14.089 67 2HD1 LEU 10 2HD1 LEU 10 -5.006 25.104 -13.988 68 3HD1 LEU 10 3HD1 LEU 10 -5.849 26.606 -13.540 69 1HD2 LEU 10 2HD2 LEU 10 -5.489 24.147 -11.498 70 2HD2 LEU 10 3HD2 LEU 10 -5.173 25.289 -10.169 71 3HD2 LEU 10 1HD2 LEU 10 -6.432 25.652 -11.374 72 H ALA 11 H ALA 11 -0.184 25.073 -11.344 73 HA ALA 11 HA ALA 11 0.600 22.489 -11.966 74 1HB ALA 11 3HB ALA 11 2.054 25.016 -11.147 75 2HB ALA 11 1HB ALA 11 2.939 23.515 -11.508 76 3HB ALA 11 2HB ALA 11 1.926 24.275 -12.759 77 H GLN 12 H GLN 12 0.211 24.147 -8.865 78 HA GLN 12 HA GLN 12 1.902 22.542 -7.370 79 1HB GLN 12 1HB GLN 12 0.570 24.765 -6.804 80 2HB GLN 12 2HB GLN 12 -0.663 23.663 -6.227 81 1HG GLN 12 1HG GLN 12 1.990 22.852 -5.273 82 2HG GLN 12 2HG GLN 12 1.647 24.511 -4.826 83 1HE2 GLN 12 1HE2 GLN 12 1.592 21.592 -3.626 84 2HE2 GLN 12 2HE2 GLN 12 0.191 21.605 -2.608 85 H GLU 13 H GLU 13 -1.563 22.205 -8.306 86 HA GLU 13 HA GLU 13 -1.605 19.653 -6.932 87 1HB GLU 13 1HB GLU 13 -3.829 21.328 -8.175 88 2HB GLU 13 2HB GLU 13 -4.089 19.753 -7.451 89 1HG GLU 13 1HG GLU 13 -3.388 22.363 -6.126 90 2HG GLU 13 2HG GLU 13 -4.541 21.142 -5.627 91 HE2 GLU 13 HE GLU 13 -3.167 19.024 -5.642 92 H ALA 14 H ALA 14 -1.659 21.176 -10.144 93 HA ALA 14 HA ALA 14 -2.583 18.984 -11.610 94 1HB ALA 14 1HB ALA 14 -2.250 21.462 -12.277 95 2HB ALA 14 2HB ALA 14 -0.556 21.012 -12.589 96 3HB ALA 14 3HB ALA 14 -1.868 20.221 -13.495 97 H GLY 15 H GLY 15 0.780 20.083 -10.789 98 1HA GLY 15 2HA GLY 15 2.685 18.905 -10.563 99 2HA GLY 15 1HA GLY 15 2.236 18.166 -12.087 100 H ASN 16 H ASN 16 0.138 17.810 -9.241 101 HA ASN 16 HA ASN 16 1.330 15.314 -8.534 102 1HB ASN 16 1HB ASN 16 0.465 16.339 -6.613 103 2HB ASN 16 2HB ASN 16 -0.863 17.086 -7.480 104 1HD2 ASN 16 1HD2 ASN 16 -2.606 16.437 -6.432 105 2HD2 ASN 16 2HD2 ASN 16 -3.079 14.798 -6.134 106 H PHE 17 H PHE 17 -1.326 16.615 -10.484 107 HA PHE 17 HA PHE 17 -2.854 14.219 -10.564 108 1HB PHE 17 1HB PHE 17 -3.791 16.495 -10.967 109 2HB PHE 17 2HB PHE 17 -2.649 16.771 -12.268 110 HD1 PHE 17 1HD PHE 17 -3.312 16.378 -14.453 111 HD2 PHE 17 2HD PHE 17 -5.416 14.462 -11.305 112 HE1 PHE 17 1HE PHE 17 -4.981 15.494 -16.106 113 HE2 PHE 17 2HE PHE 17 -7.084 13.578 -12.958 114 HZ PHE 17 HZ PHE 17 -6.847 14.105 -15.339 115 H GLU 18 H GLU 18 -0.713 15.923 -12.963 116 HA GLU 18 HA GLU 18 -0.874 14.293 -15.033 117 1HB GLU 18 1HB GLU 18 1.448 15.769 -13.809 118 2HB GLU 18 2HB GLU 18 1.778 14.702 -15.160 119 1HG GLU 18 1HG GLU 18 -0.576 16.213 -15.832 120 2HG GLU 18 2HG GLU 18 0.598 17.347 -15.196 121 HE2 GLU 18 HE GLU 18 1.538 18.073 -17.574 122 H ARG 19 H ARG 19 0.759 13.573 -11.935 123 HA ARG 19 HA ARG 19 2.095 11.309 -12.847 124 1HB ARG 19 1HB ARG 19 2.016 12.777 -10.488 125 2HB ARG 19 2HB ARG 19 1.215 11.298 -9.999 126 1HG ARG 19 1HG ARG 19 3.125 10.018 -10.221 127 2HG ARG 19 2HG ARG 19 3.688 10.904 -11.625 128 1HD ARG 19 1HD ARG 19 5.074 12.153 -10.332 129 2HD ARG 19 2HD ARG 19 3.724 12.705 -9.360 130 HE ARG 19 HE ARG 19 4.253 10.078 -8.492 131 2HH1 ARG 19 1HH ARG 19 6.701 10.690 -6.105 132 1HH2 ARG 19 2HH2 ARG 19 6.016 13.149 -8.614 133 2HH2 ARG 19 1HH2 ARG 19 6.995 12.785 -7.232 134 H ILE 20 H ILE 20 -1.114 11.854 -11.272 135 HA ILE 20 HA ILE 20 -1.770 9.153 -10.963 136 HB ILE 20 HB ILE 20 -3.559 11.564 -11.294 137 1HG1 ILE 20 1HG1 ILE 20 -2.743 10.327 -8.672 138 2HG1 ILE 20 2HG1 ILE 20 -1.720 11.520 -9.447 139 1HG2 ILE 20 3HG2 ILE 20 -4.314 8.923 -11.344 140 2HG2 ILE 20 1HG2 ILE 20 -4.482 9.338 -9.622 141 3HG2 ILE 20 2HG2 ILE 20 -5.343 10.291 -10.854 142 1HD1 ILE 20 1HD1 ILE 20 -3.993 12.895 -9.666 143 2HD1 ILE 20 2HD1 ILE 20 -4.499 11.844 -8.321 144 3HD1 ILE 20 3HD1 ILE 20 -3.077 12.898 -8.140 145 H SER 21 H SER 21 -2.398 11.521 -13.624 146 HA SER 21 HA SER 21 -3.955 9.879 -15.158 147 1HB SER 21 1HB SER 21 -3.018 11.299 -17.101 148 2HB SER 21 2HB SER 21 -3.817 12.156 -15.798 149 HG SER 21 HG SER 21 -1.084 12.122 -16.536 150 H GLY 22 H GLY 22 -0.354 10.383 -15.266 151 1HA GLY 22 2HA GLY 22 1.311 9.079 -16.025 152 2HA GLY 22 1HA GLY 22 0.224 8.588 -17.309 153 H ASP 23 H ASP 23 0.430 8.053 -13.710 154 HA ASP 23 HA ASP 23 1.126 5.444 -13.806 155 1HB ASP 23 1HB ASP 23 0.803 7.051 -11.786 156 2HB ASP 23 2HB ASP 23 -0.878 6.554 -11.798 157 HD2 ASP 23 HD ASP 23 0.484 4.353 -9.413 158 H LEU 24 H LEU 24 -2.115 6.999 -14.060 159 HA LEU 24 HA LEU 24 -3.693 4.735 -13.807 160 1HB LEU 24 1HB LEU 24 -3.963 7.481 -14.796 161 2HB LEU 24 2HB LEU 24 -5.045 6.345 -15.576 162 HG LEU 24 HG LEU 24 -4.823 6.615 -12.570 163 1HD1 LEU 24 1HD1 LEU 24 -5.938 8.483 -14.417 164 2HD1 LEU 24 2HD1 LEU 24 -7.269 7.709 -13.524 165 3HD1 LEU 24 3HD1 LEU 24 -5.955 8.518 -12.637 166 1HD2 LEU 24 1HD2 LEU 24 -6.083 4.705 -14.231 167 2HD2 LEU 24 2HD2 LEU 24 -6.213 4.892 -12.465 168 3HD2 LEU 24 3HD2 LEU 24 -7.373 5.716 -13.536 169 H LYS 25 H LYS 25 -2.074 6.181 -16.693 170 HA LYS 25 HA LYS 25 -3.159 4.295 -18.491 171 1HB LYS 25 1HB LYS 25 -1.219 6.512 -18.544 172 2HB LYS 25 2HB LYS 25 -0.857 5.225 -19.677 173 1HG LYS 25 1HG LYS 25 -2.316 6.578 -20.932 174 2HG LYS 25 2HG LYS 25 -3.406 5.356 -20.308 175 1HD LYS 25 1HD LYS 25 -4.572 7.335 -19.808 176 2HD LYS 25 2HD LYS 25 -3.755 7.011 -18.292 177 1HE LYS 25 1HE LYS 25 -2.599 8.960 -18.426 178 2HE LYS 25 2HE LYS 25 -1.976 8.539 -20.009 179 H THR 26 H THR 26 -0.113 4.495 -16.575 180 HA THR 26 HA THR 26 1.219 2.348 -17.676 181 HB THR 26 HB THR 26 1.123 3.744 -14.993 182 HG1 THR 26 1HG THR 26 3.157 3.034 -16.988 183 1HG2 THR 26 2HG2 THR 26 2.074 0.992 -15.412 184 2HG2 THR 26 3HG2 THR 26 3.418 2.088 -15.010 185 3HG2 THR 26 1HG2 THR 26 2.028 1.942 -13.908 186 H GLN 27 H GLN 27 -1.229 2.332 -15.012 187 HA GLN 27 HA GLN 27 -1.050 -0.426 -14.652 188 1HB GLN 27 1HB GLN 27 -3.405 1.414 -14.041 189 2HB GLN 27 2HB GLN 27 -3.123 -0.165 -13.335 190 1HG GLN 27 1HG GLN 27 -1.061 2.063 -13.106 191 2HG GLN 27 2HG GLN 27 -2.384 1.924 -11.966 192 1HE2 GLN 27 1HE2 GLN 27 0.738 1.078 -12.617 193 2HE2 GLN 27 2HE2 GLN 27 0.940 -0.283 -11.565 194 H ILE 28 H ILE 28 -3.068 1.672 -16.754 195 HA ILE 28 HA ILE 28 -4.901 -0.259 -17.556 196 HB ILE 28 HB ILE 28 -3.906 2.341 -18.609 197 1HG1 ILE 28 1HG1 ILE 28 -6.747 1.439 -18.137 198 2HG1 ILE 28 2HG1 ILE 28 -5.720 1.954 -16.814 199 1HG2 ILE 28 3HG2 ILE 28 -5.425 0.299 -20.220 200 2HG2 ILE 28 1HG2 ILE 28 -5.637 2.045 -20.495 201 3HG2 ILE 28 2HG2 ILE 28 -4.031 1.302 -20.692 202 1HD1 ILE 28 3HD1 ILE 28 -5.264 3.995 -18.589 203 2HD1 ILE 28 1HD1 ILE 28 -6.939 3.562 -19.006 204 3HD1 ILE 28 2HD1 ILE 28 -6.531 4.035 -17.339 205 H ASP 29 H ASP 29 -1.848 0.842 -19.197 206 HA ASP 29 HA ASP 29 -1.936 -0.940 -21.241 207 1HB ASP 29 1HB ASP 29 -0.007 0.823 -20.018 208 2HB ASP 29 2HB ASP 29 0.801 -0.699 -20.335 209 HD2 ASP 29 HD ASP 29 0.244 2.141 -21.584 210 H GLN 30 H GLN 30 -0.677 -1.280 -17.872 211 HA GLN 30 HA GLN 30 0.622 -3.667 -18.143 212 1HB GLN 30 1HB GLN 30 -0.608 -2.120 -15.919 213 2HB GLN 30 2HB GLN 30 -0.409 -3.830 -15.591 214 1HG GLN 30 1HG GLN 30 1.588 -2.417 -14.932 215 2HG GLN 30 2HG GLN 30 1.976 -3.732 -16.023 216 1HE2 GLN 30 1HE2 GLN 30 3.031 -0.916 -15.414 217 2HE2 GLN 30 2HE2 GLN 30 3.284 -0.193 -16.968 218 H VAL 31 H VAL 31 -2.870 -2.993 -17.520 219 HA VAL 31 HA VAL 31 -3.550 -5.729 -17.219 220 HB VAL 31 HB VAL 31 -5.076 -3.173 -17.674 221 1HG1 VAL 31 2HG1 VAL 31 -5.995 -5.845 -18.242 222 2HG1 VAL 31 3HG1 VAL 31 -6.883 -5.189 -16.846 223 3HG1 VAL 31 1HG1 VAL 31 -6.864 -4.299 -18.387 224 1HG2 VAL 31 1HG2 VAL 31 -3.925 -4.143 -15.419 225 2HG2 VAL 31 2HG2 VAL 31 -5.386 -3.127 -15.429 226 3HG2 VAL 31 3HG2 VAL 31 -5.533 -4.896 -15.302 227 H GLU 32 H GLU 32 -3.950 -3.324 -19.913 228 HA GLU 32 HA GLU 32 -5.147 -4.917 -21.710 229 1HB GLU 32 1HB GLU 32 -3.315 -2.575 -21.847 230 2HB GLU 32 2HB GLU 32 -3.418 -3.506 -23.329 231 1HG GLU 32 1HG GLU 32 -6.032 -3.399 -22.911 232 2HG GLU 32 2HG GLU 32 -5.637 -2.064 -21.848 233 HE2 GLU 32 HE GLU 32 -6.228 -0.351 -23.122 234 H SER 33 H SER 33 -1.639 -4.786 -20.893 235 HA SER 33 HA SER 33 -0.943 -6.614 -22.927 236 1HB SER 33 1HB SER 33 0.398 -5.009 -20.909 237 2HB SER 33 2HB SER 33 1.040 -6.639 -20.872 238 HG SER 33 HG SER 33 1.967 -4.937 -22.456 239 H THR 34 H THR 34 -1.174 -6.825 -19.299 240 HA THR 34 HA THR 34 -0.611 -9.522 -19.063 241 HB THR 34 HB THR 34 -2.013 -7.384 -17.477 242 HG1 THR 34 1HG THR 34 0.093 -7.630 -16.822 243 1HG2 THR 34 2HG2 THR 34 -3.416 -9.533 -17.185 244 2HG2 THR 34 3HG2 THR 34 -1.934 -10.302 -16.567 245 3HG2 THR 34 1HG2 THR 34 -2.644 -8.917 -15.704 246 H ALA 35 H ALA 35 -3.799 -7.909 -19.607 247 HA ALA 35 HA ALA 35 -5.380 -10.145 -19.440 248 1HB ALA 35 3HB ALA 35 -5.902 -8.082 -21.563 249 2HB ALA 35 2HB ALA 35 -5.844 -7.561 -19.862 250 3HB ALA 35 1HB ALA 35 -7.017 -8.798 -20.375 251 H GLY 36 H GLY 36 -3.147 -9.090 -22.006 252 1HA GLY 36 2HA GLY 36 -2.304 -10.245 -23.751 253 2HA GLY 36 1HA GLY 36 -3.985 -10.453 -24.202 254 H SER 37 H SER 37 -2.053 -11.791 -21.428 255 HA SER 37 HA SER 37 -1.856 -14.330 -22.548 256 1HB SER 37 1HB SER 37 -1.860 -13.922 -19.558 257 2HB SER 37 2HB SER 37 -0.823 -14.948 -20.529 258 HG SER 37 HG SER 37 0.596 -13.358 -20.586 259 H LEU 38 H LEU 38 -4.334 -12.678 -20.601 260 HA LEU 38 HA LEU 38 -5.699 -15.020 -19.794 261 1HB LEU 38 1HB LEU 38 -6.259 -12.086 -19.831 262 2HB LEU 38 2HB LEU 38 -7.589 -13.197 -19.570 263 HG LEU 38 HG LEU 38 -7.019 -12.841 -17.407 264 1HD1 LEU 38 1HD1 LEU 38 -6.569 -15.275 -18.025 265 2HD1 LEU 38 2HD1 LEU 38 -4.840 -14.869 -17.908 266 3HD1 LEU 38 3HD1 LEU 38 -5.895 -14.688 -16.486 267 1HD2 LEU 38 2HD2 LEU 38 -4.188 -12.358 -18.351 268 2HD2 LEU 38 3HD2 LEU 38 -5.357 -11.179 -17.709 269 3HD2 LEU 38 1HD2 LEU 38 -4.653 -12.410 -16.633 270 H GLN 39 H GLN 39 -6.667 -12.476 -22.208 271 HA GLN 39 HA GLN 39 -8.670 -13.979 -23.313 272 1HB GLN 39 1HB GLN 39 -7.129 -12.127 -25.103 273 2HB GLN 39 2HB GLN 39 -8.860 -12.261 -24.867 274 1HG GLN 39 1HG GLN 39 -6.822 -10.853 -23.117 275 2HG GLN 39 2HG GLN 39 -8.292 -10.204 -23.816 276 1HE2 GLN 39 1HE2 GLN 39 -7.085 -10.648 -21.011 277 2HE2 GLN 39 2HE2 GLN 39 -8.397 -11.270 -20.068 278 H GLY 40 H GLY 40 -5.167 -14.120 -23.771 279 1HA GLY 40 2HA GLY 40 -3.873 -15.261 -25.252 280 2HA GLY 40 1HA GLY 40 -5.280 -15.597 -26.242 281 H GLN 41 H GLN 41 -6.286 -16.416 -23.180 282 HA GLN 41 HA GLN 41 -5.911 -19.183 -23.755 283 1HB GLN 41 1HB GLN 41 -4.021 -19.380 -22.502 284 2HB GLN 41 2HB GLN 41 -4.237 -17.809 -21.757 285 1HG GLN 41 1HG GLN 41 -6.032 -20.118 -20.952 286 2HG GLN 41 2HG GLN 41 -4.420 -19.992 -20.277 287 1HE2 GLN 41 1HE2 GLN 41 -6.430 -19.899 -18.566 288 2HE2 GLN 41 2HE2 GLN 41 -6.703 -18.310 -17.933 289 H TRP 42 H TRP 42 -7.903 -20.055 -23.402 290 HA TRP 42 HA TRP 42 -9.263 -19.622 -20.946 291 1HB TRP 42 1HB TRP 42 -10.312 -18.249 -23.419 292 2HB TRP 42 2HB TRP 42 -11.340 -18.684 -22.068 293 HD1 TRP 42 HD TRP 42 -9.450 -15.797 -23.249 294 HE1 TRP 42 1HE TRP 42 -8.936 -13.996 -21.389 295 HE3 TRP 42 3HE TRP 42 -10.540 -18.803 -19.296 296 HZ2 TRP 42 2HZ TRP 42 -9.041 -14.031 -18.537 297 HZ3 TRP 42 3HZ TRP 42 -10.308 -17.842 -17.007 298 HH2 TRP 42 HH TRP 42 -9.588 -15.543 -16.595 299 H ARG 43 H ARG 43 -11.458 -20.867 -21.075 300 HA ARG 43 HA ARG 43 -10.919 -23.203 -22.683 301 1HB ARG 43 1HB ARG 43 -12.804 -22.704 -20.329 302 2HB ARG 43 2HB ARG 43 -12.754 -24.225 -21.198 303 1HG ARG 43 1HG ARG 43 -10.038 -23.580 -20.585 304 2HG ARG 43 2HG ARG 43 -10.953 -23.242 -19.129 305 1HD ARG 43 1HD ARG 43 -12.081 -25.607 -19.641 306 2HD ARG 43 2HD ARG 43 -10.639 -25.871 -20.600 307 HE ARG 43 HE ARG 43 -10.783 -25.665 -17.669 308 2HH1 ARG 43 1HH ARG 43 -7.388 -26.254 -17.233 309 1HH2 ARG 43 2HH2 ARG 43 -8.661 -25.554 -20.504 310 2HH2 ARG 43 1HH2 ARG 43 -7.228 -25.914 -19.600 311 H GLY 44 H GLY 44 -13.513 -20.803 -21.909 312 1HA GLY 44 2HA GLY 44 -15.555 -21.844 -23.487 313 2HA GLY 44 1HA GLY 44 -14.566 -20.845 -24.533 314 H ALA 45 H ALA 45 -16.849 -20.902 -21.851 315 HA ALA 45 HA ALA 45 -17.817 -18.385 -22.282 316 1HB ALA 45 2HB ALA 45 -18.772 -20.302 -20.892 317 2HB ALA 45 3HB ALA 45 -17.710 -19.755 -19.573 318 3HB ALA 45 1HB ALA 45 -18.972 -18.672 -20.205 319 H ALA 46 H ALA 46 -15.387 -19.411 -19.780 320 HA ALA 46 HA ALA 46 -14.928 -16.948 -18.675 321 1HB ALA 46 3HB ALA 46 -12.478 -18.506 -18.982 322 2HB ALA 46 2HB ALA 46 -13.858 -19.540 -18.540 323 3HB ALA 46 1HB ALA 46 -13.421 -18.153 -17.514 324 H GLY 47 H GLY 47 -14.052 -18.192 -21.858 325 1HA GLY 47 2HA GLY 47 -12.810 -17.335 -23.539 326 2HA GLY 47 1HA GLY 47 -11.950 -16.336 -22.384 327 H THR 48 H THR 48 -15.237 -16.623 -23.915 328 HA THR 48 HA THR 48 -15.206 -14.084 -25.032 329 HB THR 48 HB THR 48 -17.738 -14.522 -25.126 330 HG1 THR 48 1HG THR 48 -18.116 -16.820 -24.270 331 1HG2 THR 48 3HG2 THR 48 -15.916 -16.889 -25.813 332 2HG2 THR 48 1HG2 THR 48 -17.570 -16.654 -26.428 333 3HG2 THR 48 2HG2 THR 48 -16.277 -15.520 -26.891 334 H ALA 49 H ALA 49 -15.887 -15.118 -21.720 335 HA ALA 49 HA ALA 49 -17.261 -12.758 -20.976 336 1HB ALA 49 2HB ALA 49 -15.851 -14.998 -19.497 337 2HB ALA 49 3HB ALA 49 -16.587 -13.623 -18.640 338 3HB ALA 49 1HB ALA 49 -17.598 -14.691 -19.643 339 H ALA 50 H ALA 50 -13.841 -13.908 -20.548 340 HA ALA 50 HA ALA 50 -13.014 -11.431 -19.433 341 1HB ALA 50 2HB ALA 50 -10.702 -12.553 -20.083 342 2HB ALA 50 1HB ALA 50 -11.723 -13.982 -20.374 343 3HB ALA 50 3HB ALA 50 -11.695 -13.222 -18.765 344 H GLN 51 H GLN 51 -12.415 -13.051 -22.637 345 HA GLN 51 HA GLN 51 -11.009 -11.104 -23.820 346 1HB GLN 51 1HB GLN 51 -11.297 -13.069 -25.073 347 2HB GLN 51 2HB GLN 51 -13.036 -13.085 -24.855 348 1HG GLN 51 1HG GLN 51 -11.922 -10.717 -26.318 349 2HG GLN 51 2HG GLN 51 -11.813 -12.253 -27.154 350 1HE2 GLN 51 1HE2 GLN 51 -13.783 -9.655 -26.244 351 2HE2 GLN 51 2HE2 GLN 51 -15.314 -10.233 -26.810 352 H ALA 52 H ALA 52 -14.592 -11.265 -23.432 353 HA ALA 52 HA ALA 52 -15.114 -8.958 -24.967 354 1HB ALA 52 2HB ALA 52 -16.813 -10.649 -24.543 355 2HB ALA 52 1HB ALA 52 -17.343 -9.105 -23.833 356 3HB ALA 52 3HB ALA 52 -16.687 -10.387 -22.787 357 H ALA 53 H ALA 53 -14.840 -9.553 -21.394 358 HA ALA 53 HA ALA 53 -15.313 -6.974 -20.565 359 1HB ALA 53 3HB ALA 53 -13.290 -8.857 -19.309 360 2HB ALA 53 2HB ALA 53 -15.046 -9.138 -19.216 361 3HB ALA 53 1HB ALA 53 -14.340 -7.668 -18.502 362 H VAL 54 H VAL 54 -12.499 -8.390 -22.176 363 HA VAL 54 HA VAL 54 -10.732 -6.267 -21.450 364 HB VAL 54 HB VAL 54 -10.462 -8.236 -23.720 365 1HG1 VAL 54 1HG1 VAL 54 -8.825 -6.373 -23.610 366 2HG1 VAL 54 2HG1 VAL 54 -8.372 -6.897 -21.971 367 3HG1 VAL 54 3HG1 VAL 54 -8.074 -7.967 -23.362 368 1HG2 VAL 54 2HG2 VAL 54 -10.730 -8.816 -20.921 369 2HG2 VAL 54 3HG2 VAL 54 -10.425 -9.932 -22.274 370 3HG2 VAL 54 1HG2 VAL 54 -9.060 -9.164 -21.428 371 H VAL 55 H VAL 55 -12.422 -7.257 -24.514 372 HA VAL 55 HA VAL 55 -11.651 -5.177 -26.087 373 HB VAL 55 HB VAL 55 -14.190 -6.778 -25.899 374 1HG1 VAL 55 1HG1 VAL 55 -13.835 -4.279 -27.320 375 2HG1 VAL 55 2HG1 VAL 55 -14.099 -5.619 -28.462 376 3HG1 VAL 55 3HG1 VAL 55 -15.283 -5.304 -27.171 377 1HG2 VAL 55 3HG2 VAL 55 -11.719 -7.473 -26.781 378 2HG2 VAL 55 1HG2 VAL 55 -13.232 -8.180 -27.397 379 3HG2 VAL 55 2HG2 VAL 55 -12.438 -6.860 -28.290 380 H ARG 56 H ARG 56 -14.497 -5.284 -23.837 381 HA ARG 56 HA ARG 56 -15.357 -2.739 -24.389 382 1HB ARG 56 1HB ARG 56 -15.570 -4.471 -21.885 383 2HB ARG 56 2HB ARG 56 -16.366 -2.913 -21.994 384 1HG ARG 56 1HG ARG 56 -17.259 -3.919 -24.323 385 2HG ARG 56 2HG ARG 56 -16.931 -5.448 -23.531 386 1HD ARG 56 1HD ARG 56 -18.803 -5.260 -22.256 387 2HD ARG 56 2HD ARG 56 -18.300 -3.691 -21.660 388 HE ARG 56 HE ARG 56 -20.103 -4.210 -23.939 389 2HH1 ARG 56 1HH ARG 56 -20.805 -0.840 -24.404 390 1HH2 ARG 56 2HH2 ARG 56 -18.147 -1.811 -22.213 391 2HH2 ARG 56 1HH2 ARG 56 -18.999 -0.457 -22.877 392 H PHE 57 H PHE 57 -13.165 -3.960 -21.759 393 HA PHE 57 HA PHE 57 -12.731 -1.518 -20.527 394 1HB PHE 57 1HB PHE 57 -11.919 -3.393 -19.342 395 2HB PHE 57 2HB PHE 57 -11.435 -4.225 -20.807 396 HD1 PHE 57 1HD PHE 57 -9.200 -4.146 -21.567 397 HD2 PHE 57 2HD PHE 57 -10.444 -1.550 -18.449 398 HE1 PHE 57 1HE PHE 57 -6.808 -3.521 -21.132 399 HE2 PHE 57 2HE PHE 57 -8.052 -0.926 -18.014 400 HZ PHE 57 HZ PHE 57 -6.263 -1.919 -19.361 401 H GLN 58 H GLN 58 -11.017 -3.121 -23.274 402 HA GLN 58 HA GLN 58 -8.918 -1.361 -23.424 403 1HB GLN 58 1HB GLN 58 -10.331 -2.911 -25.638 404 2HB GLN 58 2HB GLN 58 -8.782 -2.116 -25.838 405 1HG GLN 58 1HG GLN 58 -8.410 -3.603 -23.496 406 2HG GLN 58 2HG GLN 58 -9.426 -4.655 -24.461 407 1HE2 GLN 58 1HE2 GLN 58 -6.942 -2.274 -25.363 408 2HE2 GLN 58 2HE2 GLN 58 -5.901 -3.356 -26.228 409 H GLU 59 H GLU 59 -12.036 -1.329 -25.303 410 HA GLU 59 HA GLU 59 -11.523 1.041 -26.601 411 1HB GLU 59 1HB GLU 59 -14.066 -0.435 -25.868 412 2HB GLU 59 2HB GLU 59 -14.153 1.111 -26.689 413 1HG GLU 59 1HG GLU 59 -12.321 -1.041 -27.780 414 2HG GLU 59 2HG GLU 59 -14.043 -1.145 -28.091 415 HE2 GLU 59 HE GLU 59 -11.509 -0.267 -29.565 416 H ALA 60 H ALA 60 -12.535 0.377 -23.290 417 HA ALA 60 HA ALA 60 -13.556 3.016 -22.828 418 1HB ALA 60 1HB ALA 60 -12.984 0.557 -21.163 419 2HB ALA 60 3HB ALA 60 -14.544 1.346 -21.502 420 3HB ALA 60 2HB ALA 60 -13.384 2.109 -20.388 421 H ALA 61 H ALA 61 -10.450 1.317 -22.683 422 HA ALA 61 HA ALA 61 -9.114 2.980 -20.906 423 1HB ALA 61 3HB ALA 61 -8.540 0.735 -22.369 424 2HB ALA 61 1HB ALA 61 -7.581 1.961 -23.232 425 3HB ALA 61 2HB ALA 61 -7.328 1.698 -21.490 426 H ASN 62 H ASN 62 -9.316 3.135 -24.534 427 HA ASN 62 HA ASN 62 -7.820 5.352 -24.887 428 1HB ASN 62 1HB ASN 62 -10.125 5.540 -26.637 429 2HB ASN 62 2HB ASN 62 -8.510 4.990 -27.034 430 1HD2 ASN 62 1HD2 ASN 62 -8.059 2.748 -25.821 431 2HD2 ASN 62 2HD2 ASN 62 -9.217 1.509 -26.173 432 H LYS 63 H LYS 63 -11.362 5.062 -24.148 433 HA LYS 63 HA LYS 63 -12.003 7.753 -24.306 434 1HB LYS 63 1HB LYS 63 -13.181 5.433 -22.773 435 2HB LYS 63 2HB LYS 63 -13.872 7.040 -22.685 436 1HG LYS 63 1HG LYS 63 -14.065 7.073 -25.195 437 2HG LYS 63 2HG LYS 63 -13.425 5.443 -25.251 438 1HD LYS 63 1HD LYS 63 -15.843 5.276 -25.359 439 2HD LYS 63 2HD LYS 63 -15.347 4.685 -23.785 440 1HE LYS 63 1HE LYS 63 -16.656 6.237 -22.776 441 2HE LYS 63 2HE LYS 63 -15.734 7.523 -23.528 442 H GLN 64 H GLN 64 -10.521 5.813 -21.682 443 HA GLN 64 HA GLN 64 -10.738 7.909 -19.803 444 1HB GLN 64 1HB GLN 64 -9.953 5.152 -19.820 445 2HB GLN 64 2HB GLN 64 -8.614 6.058 -19.143 446 1HG GLN 64 1HG GLN 64 -11.263 6.943 -18.136 447 2HG GLN 64 2HG GLN 64 -10.896 5.273 -17.752 448 1HE2 GLN 64 1HE2 GLN 64 -10.287 8.555 -17.087 449 2HE2 GLN 64 2HE2 GLN 64 -9.067 8.380 -15.870 450 H LYS 65 H LYS 65 -8.339 6.856 -22.223 451 HA LYS 65 HA LYS 65 -6.213 8.421 -21.205 452 1HB LYS 65 1HB LYS 65 -6.770 6.792 -23.628 453 2HB LYS 65 2HB LYS 65 -5.565 8.051 -23.806 454 1HG LYS 65 1HG LYS 65 -4.443 6.009 -23.079 455 2HG LYS 65 2HG LYS 65 -4.373 7.173 -21.771 456 1HD LYS 65 1HD LYS 65 -5.287 5.582 -20.434 457 2HD LYS 65 2HD LYS 65 -6.792 5.824 -21.300 458 1HE LYS 65 1HE LYS 65 -6.431 3.502 -21.539 459 2HE LYS 65 2HE LYS 65 -5.829 4.138 -23.057 460 H GLN 66 H GLN 66 -8.861 8.950 -23.576 461 HA GLN 66 HA GLN 66 -7.865 11.390 -24.491 462 1HB GLN 66 1HB GLN 66 -9.579 9.987 -25.666 463 2HB GLN 66 2HB GLN 66 -10.748 10.393 -24.426 464 1HG GLN 66 1HG GLN 66 -11.200 11.953 -26.158 465 2HG GLN 66 2HG GLN 66 -10.267 12.879 -24.999 466 1HE2 GLN 66 1HE2 GLN 66 -10.583 13.415 -27.774 467 2HE2 GLN 66 2HE2 GLN 66 -9.028 13.356 -28.534 468 H GLU 67 H GLU 67 -10.401 10.560 -22.026 469 HA GLU 67 HA GLU 67 -10.894 13.218 -21.356 470 1HB GLU 67 1HB GLU 67 -12.625 12.013 -20.510 471 2HB GLU 67 2HB GLU 67 -11.673 10.545 -20.409 472 1HG GLU 67 1HG GLU 67 -11.282 12.819 -18.424 473 2HG GLU 67 2HG GLU 67 -12.521 11.604 -18.181 474 HE2 GLU 67 HE GLU 67 -8.955 11.195 -17.063 475 H LEU 68 H LEU 68 -8.358 10.940 -20.479 476 HA LEU 68 HA LEU 68 -7.617 12.245 -18.062 477 1HB LEU 68 1HB LEU 68 -6.526 10.081 -19.797 478 2HB LEU 68 2HB LEU 68 -5.436 10.862 -18.669 479 HG LEU 68 HG LEU 68 -8.068 9.609 -17.850 480 1HD1 LEU 68 1HD1 LEU 68 -6.216 8.082 -18.903 481 2HD1 LEU 68 2HD1 LEU 68 -5.424 8.301 -17.324 482 3HD1 LEU 68 3HD1 LEU 68 -7.055 7.593 -17.411 483 1HD2 LEU 68 1HD2 LEU 68 -6.536 11.411 -16.484 484 2HD2 LEU 68 2HD2 LEU 68 -7.619 10.212 -15.738 485 3HD2 LEU 68 3HD2 LEU 68 -5.881 9.863 -15.898 486 H ASP 69 H ASP 69 -6.502 12.327 -21.497 487 HA ASP 69 HA ASP 69 -4.442 14.148 -20.934 488 1HB ASP 69 1HB ASP 69 -5.157 12.562 -23.077 489 2HB ASP 69 2HB ASP 69 -5.643 14.139 -23.668 490 HD2 ASP 69 HD ASP 69 -2.827 12.293 -24.018 491 H GLU 70 H GLU 70 -7.781 14.362 -22.355 492 HA GLU 70 HA GLU 70 -7.826 16.972 -23.034 493 1HB GLU 70 1HB GLU 70 -10.124 16.716 -23.213 494 2HB GLU 70 2HB GLU 70 -9.642 15.033 -23.136 495 1HG GLU 70 1HG GLU 70 -10.083 14.995 -20.688 496 2HG GLU 70 2HG GLU 70 -10.506 16.695 -20.722 497 HE2 GLU 70 HE GLU 70 -13.497 16.324 -21.085 498 H ILE 71 H ILE 71 -8.341 15.512 -19.775 499 HA ILE 71 HA ILE 71 -8.923 18.038 -18.577 500 HB ILE 71 HB ILE 71 -8.527 15.228 -17.634 501 1HG1 ILE 71 1HG1 ILE 71 -10.806 17.069 -16.961 502 2HG1 ILE 71 2HG1 ILE 71 -10.713 16.353 -18.557 503 1HG2 ILE 71 1HG2 ILE 71 -7.924 17.621 -16.082 504 2HG2 ILE 71 2HG2 ILE 71 -9.216 16.639 -15.351 505 3HG2 ILE 71 3HG2 ILE 71 -7.634 15.905 -15.709 506 1HD1 ILE 71 3HD1 ILE 71 -10.319 14.090 -17.262 507 2HD1 ILE 71 1HD1 ILE 71 -11.008 14.973 -15.879 508 3HD1 ILE 71 2HD1 ILE 71 -11.966 14.757 -17.363 509 H SER 72 H SER 72 -6.099 15.758 -18.562 510 HA SER 72 HA SER 72 -4.500 17.347 -16.987 511 1HB SER 72 1HB SER 72 -2.769 15.862 -17.537 512 2HB SER 72 2HB SER 72 -4.198 14.891 -17.834 513 HG SER 72 HG SER 72 -2.283 15.864 -19.638 514 H THR 73 H THR 73 -5.601 17.771 -20.255 515 HA THR 73 HA THR 73 -3.371 19.523 -20.948 516 HB THR 73 HB THR 73 -5.781 18.376 -22.443 517 HG1 THR 73 1HG THR 73 -4.166 16.954 -22.986 518 1HG2 THR 73 3HG2 THR 73 -4.517 20.807 -23.076 519 2HG2 THR 73 1HG2 THR 73 -3.606 19.605 -24.023 520 3HG2 THR 73 2HG2 THR 73 -5.368 19.753 -24.231 521 H ASN 74 H ASN 74 -6.776 19.607 -19.932 522 HA ASN 74 HA ASN 74 -7.496 22.068 -20.729 523 1HB ASN 74 1HB ASN 74 -8.214 20.226 -18.552 524 2HB ASN 74 2HB ASN 74 -8.395 21.890 -18.031 525 1HD2 ASN 74 1HD2 ASN 74 -9.810 19.332 -19.613 526 2HD2 ASN 74 2HD2 ASN 74 -11.099 20.139 -20.442 527 H ILE 75 H ILE 75 -5.812 21.166 -17.620 528 HA ILE 75 HA ILE 75 -5.478 23.755 -16.678 529 HB ILE 75 HB ILE 75 -3.631 21.428 -16.175 530 1HG1 ILE 75 1HG1 ILE 75 -5.558 21.427 -14.167 531 2HG1 ILE 75 2HG1 ILE 75 -6.492 21.676 -15.628 532 1HG2 ILE 75 1HG2 ILE 75 -3.495 23.998 -15.257 533 2HG2 ILE 75 2HG2 ILE 75 -4.441 23.204 -13.975 534 3HG2 ILE 75 3HG2 ILE 75 -2.838 22.572 -14.420 535 1HD1 ILE 75 3HD1 ILE 75 -5.044 19.728 -16.631 536 2HD1 ILE 75 1HD1 ILE 75 -4.659 19.366 -14.931 537 3HD1 ILE 75 2HD1 ILE 75 -6.349 19.323 -15.490 538 H ARG 76 H ARG 76 -3.378 21.698 -18.778 539 HA ARG 76 HA ARG 76 -1.205 23.292 -18.859 540 1HB ARG 76 1HB ARG 76 -2.323 21.137 -20.432 541 2HB ARG 76 2HB ARG 76 -1.694 22.335 -21.544 542 1HG ARG 76 1HG ARG 76 0.470 21.844 -21.019 543 2HG ARG 76 2HG ARG 76 0.150 21.894 -19.296 544 1HD ARG 76 1HD ARG 76 0.344 19.630 -19.269 545 2HD ARG 76 2HD ARG 76 -1.159 19.545 -20.166 546 HE ARG 76 HE ARG 76 1.121 20.075 -21.905 547 2HH1 ARG 76 1HH ARG 76 1.304 16.843 -23.165 548 1HH2 ARG 76 2HH2 ARG 76 -0.659 17.499 -20.245 549 2HH2 ARG 76 1HH2 ARG 76 -0.143 16.264 -21.344 550 H GLN 77 H GLN 77 -4.277 23.556 -20.735 551 HA GLN 77 HA GLN 77 -3.302 25.751 -22.250 552 1HB GLN 77 1HB GLN 77 -6.132 24.663 -21.908 553 2HB GLN 77 2HB GLN 77 -5.654 25.854 -23.101 554 1HG GLN 77 1HG GLN 77 -3.876 23.525 -23.196 555 2HG GLN 77 2HG GLN 77 -5.549 23.032 -23.367 556 1HE2 GLN 77 1HE2 GLN 77 -2.865 24.040 -24.970 557 2HE2 GLN 77 2HE2 GLN 77 -3.554 24.644 -26.440 558 H ALA 78 H ALA 78 -4.626 25.304 -19.084 559 HA ALA 78 HA ALA 78 -6.059 27.692 -18.796 560 1HB ALA 78 1HB ALA 78 -4.498 26.306 -16.600 561 2HB ALA 78 2HB ALA 78 -6.058 27.157 -16.492 562 3HB ALA 78 3HB ALA 78 -5.960 25.577 -17.307 563 H GLY 79 H GLY 79 -2.644 26.987 -19.083 564 1HA GLY 79 2HA GLY 79 -2.050 29.791 -18.350 565 2HA GLY 79 1HA GLY 79 -1.265 28.900 -19.639 566 H VAL 80 H VAL 80 -1.473 26.399 -17.702 567 HA VAL 80 HA VAL 80 0.579 27.182 -15.788 568 HB VAL 80 HB VAL 80 -0.693 24.472 -16.024 569 1HG1 VAL 80 1HG1 VAL 80 1.198 25.596 -14.300 570 2HG1 VAL 80 2HG1 VAL 80 -0.316 25.593 -13.363 571 3HG1 VAL 80 3HG1 VAL 80 0.302 24.077 -14.060 572 1HG2 VAL 80 2HG2 VAL 80 -1.939 26.996 -14.924 573 2HG2 VAL 80 3HG2 VAL 80 -2.638 25.795 -16.037 574 3HG2 VAL 80 1HG2 VAL 80 -2.396 25.384 -14.322 575 H GLN 81 H GLN 81 2.408 27.453 -17.135 576 HA GLN 81 HA GLN 81 3.440 24.915 -18.075 577 1HB GLN 81 1HB GLN 81 3.887 25.618 -20.251 578 2HB GLN 81 2HB GLN 81 2.359 26.423 -19.955 579 1HG GLN 81 1HG GLN 81 3.465 28.317 -20.600 580 2HG GLN 81 2HG GLN 81 4.110 28.307 -18.971 581 1HE2 GLN 81 1HE2 GLN 81 5.535 29.549 -20.829 582 2HE2 GLN 81 2HE2 GLN 81 6.962 28.673 -21.273 583 H TYR 82 H TYR 82 3.758 27.250 -15.912 584 HA TYR 82 HA TYR 82 6.651 27.052 -15.903 585 1HB TYR 82 1HB TYR 82 6.842 29.533 -15.722 586 2HB TYR 82 2HB TYR 82 5.983 29.149 -17.200 587 HD1 TYR 82 1HD TYR 82 3.371 29.168 -17.076 588 HD2 TYR 82 2HD TYR 82 5.911 31.033 -14.181 589 HE1 TYR 82 1HE TYR 82 1.447 30.657 -16.336 590 HE2 TYR 82 2HE TYR 82 3.978 32.514 -13.451 591 HH TYR 82 HH TYR 82 0.754 31.921 -14.507 592 H SER 83 H SER 83 6.189 25.677 -14.049 593 HA SER 83 HA SER 83 5.728 27.309 -11.709 594 1HB SER 83 1HB SER 83 3.561 26.467 -11.772 595 2HB SER 83 2HB SER 83 4.032 25.000 -12.606 596 HG SER 83 HG SER 83 3.803 25.487 -9.883 597 H ARG 84 H ARG 84 6.304 23.895 -12.846 598 HA ARG 84 HA ARG 84 8.091 23.522 -10.638 599 1HB ARG 84 1HB ARG 84 6.384 21.793 -11.709 600 2HB ARG 84 2HB ARG 84 7.660 21.514 -12.877 601 1HG ARG 84 1HG ARG 84 9.197 21.260 -10.720 602 2HG ARG 84 2HG ARG 84 7.675 20.981 -9.896 603 1HD ARG 84 1HD ARG 84 7.238 18.987 -11.068 604 2HD ARG 84 2HD ARG 84 8.202 19.460 -12.453 605 HE ARG 84 HE ARG 84 10.068 19.283 -10.406 606 2HH1 ARG 84 1HH ARG 84 10.685 15.869 -10.235 607 1HH2 ARG 84 2HH2 ARG 84 7.652 17.052 -11.724 608 2HH2 ARG 84 1HH2 ARG 84 8.562 15.634 -11.322 609 H ALA 85 H ALA 85 8.584 25.371 -13.101 610 HA ALA 85 HA ALA 85 10.725 24.118 -14.516 611 1HB ALA 85 1HB ALA 85 9.154 26.585 -14.602 612 2HB ALA 85 2HB ALA 85 10.884 26.886 -14.892 613 3HB ALA 85 3HB ALA 85 9.998 25.729 -15.914 614 H ASP 86 H ASP 86 11.513 23.543 -12.076 615 HA ASP 86 HA ASP 86 13.092 25.723 -11.054 616 1HB ASP 86 1HB ASP 86 11.762 23.568 -9.881 617 2HB ASP 86 2HB ASP 86 13.430 23.032 -9.849 618 HD2 ASP 86 HD ASP 86 14.470 25.462 -7.633 619 H GLU 87 H GLU 87 13.832 24.781 -13.678 620 HA GLU 87 HA GLU 87 15.508 22.774 -13.996 621 1HB GLU 87 1HB GLU 87 14.891 24.606 -15.661 622 2HB GLU 87 2HB GLU 87 16.170 25.585 -14.970 623 1HG GLU 87 1HG GLU 87 17.839 23.812 -15.524 624 2HG GLU 87 2HG GLU 87 16.564 22.812 -16.193 625 HE2 GLU 87 HE GLU 87 18.386 24.556 -18.679 626 H GLU 88 H GLU 88 16.276 25.858 -12.304 627 HA GLU 88 HA GLU 88 18.981 25.432 -12.029 628 1HB GLU 88 1HB GLU 88 17.485 27.513 -11.485 629 2HB GLU 88 2HB GLU 88 17.303 26.792 -9.899 630 1HG GLU 88 1HG GLU 88 19.247 27.855 -9.369 631 2HG GLU 88 2HG GLU 88 20.044 26.590 -10.283 632 HE2 GLU 88 HE GLU 88 21.236 28.971 -10.253 633 H GLN 89 H GLN 89 16.220 24.503 -9.875 634 HA GLN 89 HA GLN 89 18.054 23.136 -8.141 635 1HB GLN 89 1HB GLN 89 16.112 24.425 -7.237 636 2HB GLN 89 2HB GLN 89 15.010 23.334 -8.052 637 1HG GLN 89 1HG GLN 89 15.276 21.692 -6.480 638 2HG GLN 89 2HG GLN 89 17.015 21.902 -6.418 639 1HE2 GLN 89 1HE2 GLN 89 17.535 22.174 -4.381 640 2HE2 GLN 89 2HE2 GLN 89 16.834 23.300 -3.267 641 H GLN 90 H GLN 90 17.695 22.276 -11.004 642 HA GLN 90 HA GLN 90 16.106 20.229 -11.486 643 1HB GLN 90 1HB GLN 90 18.739 21.070 -12.374 644 2HB GLN 90 2HB GLN 90 18.674 19.319 -12.344 645 1HG GLN 90 1HG GLN 90 16.416 19.520 -13.595 646 2HG GLN 90 2HG GLN 90 16.805 21.213 -13.831 647 1HE2 GLN 90 1HE2 GLN 90 16.427 19.593 -15.965 648 2HE2 GLN 90 2HE2 GLN 90 17.908 19.308 -16.817 649 H GLN 91 H GLN 91 19.466 19.416 -10.388 650 HA GLN 91 HA GLN 91 18.277 17.175 -8.972 651 1HB GLN 91 1HB GLN 91 20.718 17.560 -10.551 652 2HB GLN 91 2HB GLN 91 21.081 16.860 -8.986 653 1HG GLN 91 1HG GLN 91 20.626 14.965 -10.330 654 2HG GLN 91 2HG GLN 91 19.122 15.207 -9.462 655 1HE2 GLN 91 1HE2 GLN 91 20.357 14.486 -12.359 656 2HE2 GLN 91 2HE2 GLN 91 19.136 15.080 -13.434 657 H ALA 92 H ALA 92 21.447 18.827 -8.446 658 HA ALA 92 HA ALA 92 20.507 19.552 -5.760 659 1HB ALA 92 2HB ALA 92 22.541 18.732 -4.794 660 2HB ALA 92 1HB ALA 92 23.266 18.448 -6.395 661 3HB ALA 92 3HB ALA 92 21.918 17.429 -5.835 662 H LEU 93 H LEU 93 21.159 20.773 -8.646 663 HA LEU 93 HA LEU 93 23.284 22.583 -8.054 664 1HB LEU 93 1HB LEU 93 22.446 21.624 -10.321 665 2HB LEU 93 2HB LEU 93 21.277 22.927 -10.256 666 HG LEU 93 HG LEU 93 23.456 24.396 -9.820 667 1HD1 LEU 93 3HD1 LEU 93 25.002 22.507 -9.751 668 2HD1 LEU 93 1HD1 LEU 93 24.530 22.044 -11.403 669 3HD1 LEU 93 2HD1 LEU 93 25.369 23.588 -11.117 670 1HD2 LEU 93 1HD2 LEU 93 21.779 24.587 -11.667 671 2HD2 LEU 93 2HD2 LEU 93 23.447 24.997 -12.135 672 3HD2 LEU 93 3HD2 LEU 93 22.753 23.425 -12.600 673 H SER 94 H SER 94 21.951 22.942 -5.850 674 HA SER 94 HA SER 94 20.493 25.414 -6.337 675 1HB SER 94 1HB SER 94 19.217 23.146 -5.514 676 2HB SER 94 2HB SER 94 19.699 23.785 -3.955 677 HG SER 94 HG SER 94 18.760 25.918 -5.079 678 H SER 95 H SER 95 21.602 23.444 -3.478 679 HA SER 95 HA SER 95 22.637 25.849 -2.314 680 1HB SER 95 1HB SER 95 21.599 23.388 -1.342 681 2HB SER 95 2HB SER 95 23.281 23.409 -0.850 682 HG SER 95 HG SER 95 21.882 24.431 0.726 683 H GLN 96 H GLN 96 23.852 22.590 -3.359 684 HA GLN 96 HA GLN 96 26.550 23.574 -3.061 685 1HB GLN 96 1HB GLN 96 25.666 21.226 -2.317 686 2HB GLN 96 2HB GLN 96 25.766 20.801 -4.014 687 1HG GLN 96 1HG GLN 96 28.219 21.802 -3.846 688 2HG GLN 96 2HG GLN 96 28.008 21.565 -2.123 689 1HE2 GLN 96 1HE2 GLN 96 27.497 19.456 -1.326 690 2HE2 GLN 96 2HE2 GLN 96 28.014 18.034 -2.168 691 H MET 97 H MET 97 24.674 24.626 -5.158 692 HA MET 97 HA MET 97 24.968 23.580 -7.605 693 1HB MET 97 1HB MET 97 25.002 26.110 -8.337 694 2HB MET 97 2HB MET 97 23.639 25.556 -7.385 695 1HG MET 97 1HG MET 97 24.269 26.766 -5.514 696 2HG MET 97 2HG MET 97 25.981 26.515 -5.793 697 1HE MET 97 2HE MET 97 24.372 29.070 -4.878 698 2HE MET 97 3HE MET 97 26.129 29.306 -5.047 699 3HE MET 97 1HE MET 97 24.999 30.442 -5.822 700 H GLY 98 H GLY 98 26.824 22.704 -8.458 701 1HA GLY 98 2HA GLY 98 29.415 23.287 -7.868 702 2HA GLY 98 1HA GLY 98 29.003 24.471 -9.092 703 H PHE 99 H PHE 99 30.161 21.328 -8.564 704 HA PHE 99 HA PHE 99 30.073 20.782 -11.377 705 1HB PHE 99 1HB PHE 99 31.754 20.276 -9.183 706 2HB PHE 99 2HB PHE 99 30.981 18.718 -9.397 707 HD1 PHE 99 1HD PHE 99 33.210 21.193 -10.928 708 HD2 PHE 99 2HD PHE 99 31.434 17.362 -11.346 709 HE1 PHE 99 1HE PHE 99 34.821 20.648 -12.774 710 HE2 PHE 99 2HE PHE 99 33.045 16.816 -13.191 711 HZ PHE 99 HZ PHE 99 34.719 18.466 -13.883 712 H MET 601 H MET 601 5.171 -19.829 -19.335 713 HA MET 601 HA MET 601 6.802 -20.652 -20.534 714 1HB MET 601 1HB MET 601 8.179 -22.396 -19.357 715 2HB MET 601 2HB MET 601 7.624 -21.166 -18.240 716 1HG MET 601 1HG MET 601 5.612 -22.735 -17.748 717 2HG MET 601 2HG MET 601 6.499 -23.975 -18.613 718 1HE MET 601 1HE MET 601 5.411 -22.938 -15.701 719 2HE MET 601 2HE MET 601 6.013 -24.536 -15.198 720 3HE MET 601 3HE MET 601 6.630 -23.064 -14.410 721 H THR 602 H THR 602 4.425 -23.149 -19.548 722 HA THR 602 HA THR 602 5.045 -25.279 -21.060 723 HB THR 602 HB THR 602 2.365 -23.900 -20.546 724 HG1 THR 602 1HG THR 602 2.729 -25.005 -18.662 725 1HG2 THR 602 1HG2 THR 602 2.425 -25.663 -22.520 726 2HG2 THR 602 2HG2 THR 602 2.720 -26.843 -21.221 727 3HG2 THR 602 3HG2 THR 602 1.226 -25.876 -21.221 728 H GLU 603 H GLU 603 3.426 -22.294 -22.308 729 HA GLU 603 HA GLU 603 4.479 -23.047 -24.901 730 1HB GLU 603 1HB GLU 603 1.574 -22.386 -24.288 731 2HB GLU 603 2HB GLU 603 2.237 -22.240 -25.903 732 1HG GLU 603 1HG GLU 603 3.124 -24.751 -25.280 733 2HG GLU 603 2HG GLU 603 1.676 -24.705 -24.295 734 HE2 GLU 603 HE GLU 603 2.586 -25.169 -27.634 735 H GLN 604 H GLN 604 5.647 -21.357 -25.699 736 HA GLN 604 HA GLN 604 5.949 -19.004 -24.425 737 1HB GLN 604 1HB GLN 604 6.886 -20.192 -26.802 738 2HB GLN 604 2HB GLN 604 6.210 -18.664 -27.329 739 1HG GLN 604 1HG GLN 604 7.814 -18.442 -24.843 740 2HG GLN 604 2HG GLN 604 8.741 -19.010 -26.217 741 1HE2 GLN 604 1HE2 GLN 604 7.245 -16.372 -24.682 742 2HE2 GLN 604 2HE2 GLN 604 7.547 -15.141 -25.863 743 H GLN 605 H GLN 605 3.489 -19.901 -26.871 744 HA GLN 605 HA GLN 605 2.584 -17.426 -27.537 745 1HB GLN 605 1HB GLN 605 0.966 -19.980 -27.128 746 2HB GLN 605 2HB GLN 605 0.399 -18.574 -28.007 747 1HG GLN 605 1HG GLN 605 2.878 -19.041 -29.193 748 2HG GLN 605 2HG GLN 605 2.327 -20.667 -28.843 749 1HE2 GLN 605 1HE2 GLN 605 1.990 -17.889 -30.792 750 2HE2 GLN 605 2HE2 GLN 605 0.702 -18.418 -31.821 751 H TRP 606 H TRP 606 1.813 -19.435 -24.647 752 HA TRP 606 HA TRP 606 0.845 -17.023 -23.342 753 1HB TRP 606 1HB TRP 606 -1.197 -17.998 -22.590 754 2HB TRP 606 2HB TRP 606 -1.154 -18.048 -24.341 755 HD1 TRP 606 HD TRP 606 -0.792 -20.558 -25.467 756 HE1 TRP 606 1HE TRP 606 -1.352 -23.002 -24.645 757 HE3 TRP 606 3HE TRP 606 -1.280 -19.356 -20.550 758 HZ2 TRP 606 2HZ TRP 606 -1.924 -24.133 -22.088 759 HZ3 TRP 606 3HZ TRP 606 -1.841 -21.189 -18.957 760 HH2 TRP 606 HH TRP 606 -2.160 -23.510 -19.655 761 H ASN 607 H ASN 607 2.841 -17.170 -22.153 762 HA ASN 607 HA ASN 607 3.856 -19.444 -21.064 763 1HB ASN 607 1HB ASN 607 4.734 -17.730 -19.233 764 2HB ASN 607 2HB ASN 607 5.270 -17.564 -20.893 765 1HD2 ASN 607 1HD2 ASN 607 5.412 -15.515 -21.380 766 2HD2 ASN 607 2HD2 ASN 607 4.249 -14.274 -21.052 767 H PHE 608 H PHE 608 3.036 -20.821 -19.477 768 HA PHE 608 HA PHE 608 0.637 -20.227 -18.150 769 1HB PHE 608 1HB PHE 608 1.398 -22.522 -18.684 770 2HB PHE 608 2HB PHE 608 2.899 -22.278 -17.814 771 HD1 PHE 608 1HD PHE 608 3.068 -23.239 -15.730 772 HD2 PHE 608 2HD PHE 608 -0.777 -22.133 -17.145 773 HE1 PHE 608 1HE PHE 608 2.028 -24.211 -13.663 774 HE2 PHE 608 2HE PHE 608 -1.817 -23.106 -15.078 775 HZ PHE 608 HZ PHE 608 -0.402 -24.133 -13.362 776 H ALA 609 H ALA 609 3.991 -19.498 -17.446 777 HA ALA 609 HA ALA 609 3.572 -19.263 -14.610 778 1HB ALA 609 2HB ALA 609 5.941 -18.007 -15.137 779 2HB ALA 609 1HB ALA 609 5.806 -19.071 -16.558 780 3HB ALA 609 3HB ALA 609 5.772 -19.766 -14.920 781 H GLY 610 H GLY 610 2.955 -17.384 -17.451 782 1HA GLY 610 2HA GLY 610 2.890 -15.056 -17.703 783 2HA GLY 610 1HA GLY 610 3.046 -14.850 -15.969 784 H ILE 611 H ILE 611 0.805 -16.486 -18.329 785 HA ILE 611 HA ILE 611 -1.401 -14.991 -17.846 786 HB ILE 611 HB ILE 611 -1.143 -16.678 -19.603 787 1HG1 ILE 611 1HG1 ILE 611 -3.400 -15.752 -18.659 788 2HG1 ILE 611 2HG1 ILE 611 -3.397 -17.039 -19.848 789 1HG2 ILE 611 2HG2 ILE 611 -1.010 -18.499 -17.283 790 2HG2 ILE 611 3HG2 ILE 611 -2.019 -19.060 -18.638 791 3HG2 ILE 611 1HG2 ILE 611 -0.309 -18.648 -18.912 792 1HD1 ILE 611 1HD1 ILE 611 -3.361 -17.703 -16.888 793 2HD1 ILE 611 2HD1 ILE 611 -4.888 -17.315 -17.715 794 3HD1 ILE 611 3HD1 ILE 611 -3.916 -18.707 -18.249 795 H GLU 612 H GLU 612 0.149 -17.321 -15.717 796 HA GLU 612 HA GLU 612 -2.097 -17.833 -14.128 797 1HB GLU 612 1HB GLU 612 -0.295 -19.380 -13.976 798 2HB GLU 612 2HB GLU 612 0.895 -18.117 -13.732 799 1HG GLU 612 1HG GLU 612 -0.161 -17.586 -11.506 800 2HG GLU 612 2HG GLU 612 -1.294 -18.901 -11.749 801 HE2 GLU 612 HE GLU 612 -0.463 -20.967 -11.706 802 H ALA 613 H ALA 613 0.766 -15.635 -13.668 803 HA ALA 613 HA ALA 613 -0.495 -14.392 -11.405 804 1HB ALA 613 3HB ALA 613 2.106 -14.779 -12.267 805 2HB ALA 613 1HB ALA 613 1.831 -13.059 -12.636 806 3HB ALA 613 2HB ALA 613 1.604 -13.661 -10.976 807 H ALA 614 H ALA 614 -0.621 -14.108 -14.849 808 HA ALA 614 HA ALA 614 -0.817 -11.442 -15.332 809 1HB ALA 614 3HB ALA 614 -2.435 -13.772 -16.430 810 2HB ALA 614 1HB ALA 614 -2.433 -12.142 -17.143 811 3HB ALA 614 2HB ALA 614 -0.929 -13.093 -17.092 812 H ALA 615 H ALA 615 -3.457 -13.651 -14.174 813 HA ALA 615 HA ALA 615 -5.439 -11.728 -14.023 814 1HB ALA 615 2HB ALA 615 -6.588 -13.550 -13.387 815 2HB ALA 615 3HB ALA 615 -5.056 -14.457 -13.362 816 3HB ALA 615 1HB ALA 615 -5.647 -13.667 -11.881 817 H SER 616 H SER 616 -3.103 -12.857 -11.482 818 HA SER 616 HA SER 616 -3.999 -11.247 -9.478 819 1HB SER 616 1HB SER 616 -1.837 -12.992 -9.912 820 2HB SER 616 2HB SER 616 -1.066 -11.469 -9.514 821 HG SER 616 HG SER 616 -2.848 -11.507 -7.687 822 H ALA 617 H ALA 617 -2.050 -10.479 -12.345 823 HA ALA 617 HA ALA 617 -1.080 -7.991 -11.374 824 1HB ALA 617 1HB ALA 617 -0.583 -9.701 -13.526 825 2HB ALA 617 3HB ALA 617 0.145 -8.098 -13.265 826 3HB ALA 617 2HB ALA 617 -1.306 -8.262 -14.283 827 H ILE 618 H ILE 618 -3.936 -9.114 -13.246 828 HA ILE 618 HA ILE 618 -4.837 -6.580 -13.999 829 HB ILE 618 HB ILE 618 -6.316 -9.171 -13.535 830 1HG1 ILE 618 1HG1 ILE 618 -4.516 -9.303 -15.209 831 2HG1 ILE 618 2HG1 ILE 618 -6.105 -9.504 -15.920 832 1HG2 ILE 618 2HG2 ILE 618 -7.794 -7.163 -13.452 833 2HG2 ILE 618 3HG2 ILE 618 -7.252 -6.752 -15.097 834 3HG2 ILE 618 1HG2 ILE 618 -8.138 -8.268 -14.805 835 1HD1 ILE 618 3HD1 ILE 618 -4.501 -6.905 -15.901 836 2HD1 ILE 618 1HD1 ILE 618 -4.701 -7.993 -17.295 837 3HD1 ILE 618 2HD1 ILE 618 -6.107 -7.122 -16.637 838 H GLN 619 H GLN 619 -5.511 -8.627 -11.094 839 HA GLN 619 HA GLN 619 -7.406 -7.009 -9.977 840 1HB GLN 619 1HB GLN 619 -5.598 -9.157 -9.089 841 2HB GLN 619 2HB GLN 619 -5.960 -8.027 -7.799 842 1HG GLN 619 1HG GLN 619 -8.118 -9.271 -9.562 843 2HG GLN 619 2HG GLN 619 -7.593 -9.990 -8.052 844 1HE2 GLN 619 1HE2 GLN 619 -10.086 -8.554 -9.157 845 2HE2 GLN 619 2HE2 GLN 619 -10.545 -7.452 -7.902 846 H GLY 620 H GLY 620 -3.847 -7.064 -9.191 847 1HA GLY 620 2HA GLY 620 -2.462 -5.444 -8.481 848 2HA GLY 620 1HA GLY 620 -3.806 -4.859 -7.520 849 H ASN 621 H ASN 621 -3.784 -5.071 -11.110 850 HA ASN 621 HA ASN 621 -3.083 -2.363 -11.435 851 1HB ASN 621 1HB ASN 621 -4.112 -4.585 -13.219 852 2HB ASN 621 2HB ASN 621 -4.173 -2.944 -13.830 853 1HD2 ASN 621 1HD2 ASN 621 -2.014 -1.709 -13.005 854 2HD2 ASN 621 2HD2 ASN 621 -0.547 -2.469 -13.525 855 H VAL 622 H VAL 622 -6.072 -4.278 -11.071 856 HA VAL 622 HA VAL 622 -7.860 -2.336 -12.065 857 HB VAL 622 HB VAL 622 -8.099 -4.763 -10.299 858 1HG1 VAL 622 2HG1 VAL 622 -10.223 -2.744 -11.020 859 2HG1 VAL 622 3HG1 VAL 622 -10.633 -4.452 -10.735 860 3HG1 VAL 622 1HG1 VAL 622 -9.869 -3.494 -9.445 861 1HG2 VAL 622 3HG2 VAL 622 -7.770 -4.590 -12.978 862 2HG2 VAL 622 1HG2 VAL 622 -8.679 -5.895 -12.179 863 3HG2 VAL 622 2HG2 VAL 622 -9.546 -4.508 -12.881 864 H THR 623 H THR 623 -6.921 -3.298 -8.686 865 HA THR 623 HA THR 623 -8.392 -1.290 -7.424 866 HB THR 623 HB THR 623 -6.854 -1.862 -5.507 867 HG1 THR 623 1HG THR 623 -5.008 -3.107 -6.055 868 1HG2 THR 623 2HG2 THR 623 -8.709 -3.506 -6.250 869 2HG2 THR 623 3HG2 THR 623 -7.436 -4.384 -7.131 870 3HG2 THR 623 1HG2 THR 623 -7.348 -4.229 -5.360 871 H SER 624 H SER 624 -5.124 -1.264 -8.885 872 HA SER 624 HA SER 624 -4.195 1.034 -7.778 873 1HB SER 624 1HB SER 624 -3.746 -0.445 -10.333 874 2HB SER 624 2HB SER 624 -3.208 1.223 -10.330 875 HG SER 624 HG SER 624 -2.095 0.651 -8.227 876 H ILE 625 H ILE 625 -6.224 0.620 -10.761 877 HA ILE 625 HA ILE 625 -6.398 3.410 -11.234 878 HB ILE 625 HB ILE 625 -7.487 0.914 -12.377 879 1HG1 ILE 625 1HG1 ILE 625 -6.970 2.962 -14.288 880 2HG1 ILE 625 2HG1 ILE 625 -5.691 3.035 -13.092 881 1HG2 ILE 625 1HG2 ILE 625 -8.959 3.545 -12.559 882 2HG2 ILE 625 2HG2 ILE 625 -9.096 2.274 -13.797 883 3HG2 ILE 625 3HG2 ILE 625 -9.594 1.941 -12.121 884 1HD1 ILE 625 2HD1 ILE 625 -6.593 0.477 -14.495 885 2HD1 ILE 625 3HD1 ILE 625 -5.172 1.445 -14.956 886 3HD1 ILE 625 1HD1 ILE 625 -5.221 0.634 -13.372 887 H HIS 626 H HIS 626 -8.160 1.057 -9.255 888 HA HIS 626 HA HIS 626 -10.530 2.462 -8.966 889 1HB HIS 626 1HB HIS 626 -9.944 0.075 -8.273 890 2HB HIS 626 2HB HIS 626 -9.224 0.765 -6.832 891 HD1 HIS 626 1HD HIS 626 -11.126 -0.673 -5.559 892 HD2 HIS 626 2HD HIS 626 -12.478 2.580 -7.837 893 HE1 HIS 626 1HE HIS 626 -13.510 -0.199 -4.783 894 H SER 627 H SER 627 -7.457 2.574 -7.051 895 HA SER 627 HA SER 627 -8.514 4.654 -5.420 896 1HB SER 627 1HB SER 627 -6.025 3.022 -5.553 897 2HB SER 627 2HB SER 627 -5.807 4.639 -4.914 898 HG SER 627 HG SER 627 -6.931 4.142 -3.134 899 H LEU 628 H LEU 628 -6.101 4.306 -8.091 900 HA LEU 628 HA LEU 628 -5.006 6.774 -8.148 901 1HB LEU 628 1HB LEU 628 -5.617 4.679 -10.126 902 2HB LEU 628 2HB LEU 628 -5.361 6.275 -10.804 903 HG LEU 628 HG LEU 628 -3.378 5.120 -8.854 904 1HD1 LEU 628 2HD1 LEU 628 -3.836 4.294 -11.685 905 2HD1 LEU 628 3HD1 LEU 628 -2.158 4.487 -11.124 906 3HD1 LEU 628 1HD1 LEU 628 -3.250 3.355 -10.291 907 1HD2 LEU 628 3HD2 LEU 628 -3.267 7.521 -9.484 908 2HD2 LEU 628 1HD2 LEU 628 -1.818 6.594 -9.942 909 3HD2 LEU 628 2HD2 LEU 628 -3.022 7.030 -11.178 910 H LEU 629 H LEU 629 -8.123 5.816 -9.751 911 HA LEU 629 HA LEU 629 -8.766 8.289 -10.751 912 1HB LEU 629 1HB LEU 629 -10.036 5.757 -10.305 913 2HB LEU 629 2HB LEU 629 -11.152 7.040 -9.879 914 HG LEU 629 HG LEU 629 -11.316 6.226 -12.239 915 1HD1 LEU 629 2HD1 LEU 629 -10.975 9.057 -11.416 916 2HD1 LEU 629 3HD1 LEU 629 -11.021 8.732 -13.165 917 3HD1 LEU 629 1HD1 LEU 629 -12.375 8.221 -12.129 918 1HD2 LEU 629 3HD2 LEU 629 -8.482 6.758 -12.193 919 2HD2 LEU 629 1HD2 LEU 629 -9.464 5.925 -13.422 920 3HD2 LEU 629 2HD2 LEU 629 -9.268 7.693 -13.487 921 H ASP 630 H ASP 630 -9.358 6.923 -7.462 922 HA ASP 630 HA ASP 630 -10.837 9.088 -6.567 923 1HB ASP 630 1HB ASP 630 -9.346 6.795 -5.359 924 2HB ASP 630 2HB ASP 630 -9.609 8.155 -4.285 925 HD2 ASP 630 HD ASP 630 -11.672 6.328 -3.210 926 H GLU 631 H GLU 631 -7.375 8.484 -7.021 927 HA GLU 631 HA GLU 631 -6.521 10.511 -5.240 928 1HB GLU 631 1HB GLU 631 -5.308 8.490 -6.980 929 2HB GLU 631 2HB GLU 631 -4.447 10.012 -7.092 930 1HG GLU 631 1HG GLU 631 -4.052 10.080 -4.704 931 2HG GLU 631 2HG GLU 631 -5.197 8.787 -4.405 932 HE2 GLU 631 HE GLU 631 -2.713 6.555 -4.422 933 H GLY 632 H GLY 632 -6.856 10.194 -8.835 934 1HA GLY 632 2HA GLY 632 -6.829 11.739 -10.474 935 2HA GLY 632 1HA GLY 632 -5.946 12.817 -9.412 936 H LYS 633 H LYS 633 -9.143 11.355 -8.659 937 HA LYS 633 HA LYS 633 -10.769 13.381 -9.568 938 1HB LYS 633 1HB LYS 633 -11.428 11.102 -8.711 939 2HB LYS 633 2HB LYS 633 -11.218 11.710 -7.081 940 1HG LYS 633 1HG LYS 633 -13.563 11.951 -7.636 941 2HG LYS 633 2HG LYS 633 -12.871 13.560 -7.612 942 1HD LYS 633 1HD LYS 633 -12.462 12.770 -10.261 943 2HD LYS 633 2HD LYS 633 -14.007 12.035 -9.882 944 1HE LYS 633 1HE LYS 633 -14.726 14.335 -8.944 945 2HE LYS 633 2HE LYS 633 -13.268 14.986 -9.665 946 H GLN 634 H GLN 634 -8.725 13.175 -6.652 947 HA GLN 634 HA GLN 634 -9.900 15.344 -5.349 948 1HB GLN 634 1HB GLN 634 -7.018 14.389 -5.092 949 2HB GLN 634 2HB GLN 634 -7.942 15.272 -3.893 950 1HG GLN 634 1HG GLN 634 -9.395 12.871 -4.708 951 2HG GLN 634 2HG GLN 634 -7.771 12.447 -4.202 952 1HE2 GLN 634 1HE2 GLN 634 -9.798 11.534 -2.741 953 2HE2 GLN 634 2HE2 GLN 634 -9.930 12.339 -1.213 954 H SER 635 H SER 635 -7.490 15.040 -7.935 955 HA SER 635 HA SER 635 -6.533 17.687 -7.629 956 1HB SER 635 1HB SER 635 -5.802 15.355 -9.091 957 2HB SER 635 2HB SER 635 -6.117 16.590 -10.294 958 HG SER 635 HG SER 635 -3.948 16.322 -8.675 959 H LEU 636 H LEU 636 -9.094 16.016 -9.465 960 HA LEU 636 HA LEU 636 -9.624 17.772 -11.465 961 1HB LEU 636 1HB LEU 636 -11.051 15.733 -9.972 962 2HB LEU 636 2HB LEU 636 -12.126 17.017 -10.487 963 HG LEU 636 HG LEU 636 -11.868 15.012 -12.033 964 1HD1 LEU 636 1HD1 LEU 636 -12.650 17.482 -12.553 965 2HD1 LEU 636 2HD1 LEU 636 -11.181 17.489 -13.558 966 3HD1 LEU 636 3HD1 LEU 636 -12.451 16.276 -13.847 967 1HD2 LEU 636 2HD2 LEU 636 -9.190 15.403 -11.729 968 2HD2 LEU 636 3HD2 LEU 636 -9.942 14.498 -13.064 969 3HD2 LEU 636 1HD2 LEU 636 -9.484 16.203 -13.291 970 H THR 637 H THR 637 -10.876 17.946 -8.061 971 HA THR 637 HA THR 637 -12.174 20.421 -8.464 972 HB THR 637 HB THR 637 -12.934 19.075 -6.650 973 HG1 THR 637 1HG THR 637 -12.291 20.468 -4.821 974 1HG2 THR 637 2HG2 THR 637 -9.971 18.816 -5.965 975 2HG2 THR 637 3HG2 THR 637 -11.239 18.489 -4.760 976 3HG2 THR 637 1HG2 THR 637 -11.148 17.510 -6.244 977 H LYS 638 H LYS 638 -8.821 19.533 -7.908 978 HA LYS 638 HA LYS 638 -8.110 22.144 -6.951 979 1HB LYS 638 1HB LYS 638 -6.351 19.856 -7.883 980 2HB LYS 638 2HB LYS 638 -5.829 21.275 -6.998 981 1HG LYS 638 1HG LYS 638 -6.970 20.619 -5.012 982 2HG LYS 638 2HG LYS 638 -8.030 19.517 -5.869 983 1HD LYS 638 1HD LYS 638 -6.579 17.801 -5.572 984 2HD LYS 638 2HD LYS 638 -5.286 18.704 -6.337 985 1HE LYS 638 1HE LYS 638 -4.594 19.698 -4.259 986 2HE LYS 638 2HE LYS 638 -6.087 19.258 -3.453 987 H LEU 639 H LEU 639 -8.251 20.375 -10.045 988 HA LEU 639 HA LEU 639 -6.902 22.562 -11.393 989 1HB LEU 639 1HB LEU 639 -7.949 19.887 -12.317 990 2HB LEU 639 2HB LEU 639 -7.263 21.083 -13.399 991 HG LEU 639 HG LEU 639 -5.413 19.814 -13.056 992 1HD1 LEU 639 3HD1 LEU 639 -4.871 22.070 -12.259 993 2HD1 LEU 639 1HD1 LEU 639 -5.283 21.582 -10.597 994 3HD1 LEU 639 2HD1 LEU 639 -3.905 20.825 -11.431 995 1HD2 LEU 639 2HD2 LEU 639 -6.860 18.431 -11.308 996 2HD2 LEU 639 3HD2 LEU 639 -5.096 18.238 -11.441 997 3HD2 LEU 639 1HD2 LEU 639 -5.786 19.251 -10.150 998 H ALA 640 H ALA 640 -10.041 21.724 -10.329 999 HA ALA 640 HA ALA 640 -11.728 22.381 -12.342 1000 1HB ALA 640 3HB ALA 640 -11.856 22.008 -9.579 1001 2HB ALA 640 1HB ALA 640 -12.479 23.658 -9.813 1002 3HB ALA 640 2HB ALA 640 -13.236 22.292 -10.667 1003 H ALA 641 H ALA 641 -9.920 24.640 -10.168 1004 HA ALA 641 HA ALA 641 -11.010 27.000 -11.066 1005 1HB ALA 641 1HB ALA 641 -8.994 26.182 -9.333 1006 2HB ALA 641 3HB ALA 641 -9.462 27.866 -9.668 1007 3HB ALA 641 2HB ALA 641 -8.117 27.121 -10.564 1008 H ALA 642 H ALA 642 -8.672 24.800 -12.596 1009 HA ALA 642 HA ALA 642 -7.609 26.567 -14.465 1010 1HB ALA 642 1HB ALA 642 -7.022 24.092 -13.773 1011 2HB ALA 642 2HB ALA 642 -8.140 23.666 -15.091 1012 3HB ALA 642 3HB ALA 642 -6.697 24.652 -15.431 1013 H TRP 643 H TRP 643 -10.747 24.935 -14.229 1014 HA TRP 643 HA TRP 643 -11.388 25.518 -16.989 1015 1HB TRP 643 1HB TRP 643 -12.807 24.145 -14.721 1016 2HB TRP 643 2HB TRP 643 -13.665 24.612 -16.175 1017 HD1 TRP 643 HD TRP 643 -13.213 23.130 -18.377 1018 HE1 TRP 643 1HE TRP 643 -11.993 20.850 -18.903 1019 HE3 TRP 643 3HE TRP 643 -10.746 22.820 -13.941 1020 HZ2 TRP 643 2HZ TRP 643 -10.175 19.209 -17.438 1021 HZ3 TRP 643 3HZ TRP 643 -9.269 20.847 -13.569 1022 HH2 TRP 643 HH TRP 643 -8.964 19.080 -15.230 1023 H GLY 644 H GLY 644 -11.238 27.153 -13.993 1024 1HA GLY 644 2HA GLY 644 -13.303 29.084 -14.870 1025 2HA GLY 644 1HA GLY 644 -11.736 29.556 -14.244 1026 H GLY 645 H GLY 645 -12.469 26.768 -12.564 1027 1HA GLY 645 2HA GLY 645 -14.229 28.021 -10.593 1028 2HA GLY 645 1HA GLY 645 -12.600 27.627 -10.081 1029 H SER 646 H SER 646 -14.347 26.312 -8.623 1030 HA SER 646 HA SER 646 -14.465 23.677 -9.867 1031 1HB SER 646 1HB SER 646 -14.652 23.280 -7.105 1032 2HB SER 646 2HB SER 646 -13.226 23.024 -8.091 1033 HG SER 646 HG SER 646 -13.810 25.089 -6.275 1034 H GLY 647 H GLY 647 -16.603 24.731 -10.713 1035 1HA GLY 647 2HA GLY 647 -18.717 25.271 -8.920 1036 2HA GLY 647 1HA GLY 647 -18.781 23.587 -9.403 1037 H SER 648 H SER 648 -17.473 26.228 -11.454 1038 HA SER 648 HA SER 648 -19.695 26.952 -12.799 1039 1HB SER 648 1HB SER 648 -16.791 26.943 -13.311 1040 2HB SER 648 2HB SER 648 -17.727 26.872 -14.791 1041 HG SER 648 HG SER 648 -17.195 29.075 -13.811 1042 H GLU 649 H GLU 649 -20.773 26.237 -14.745 1043 HA GLU 649 HA GLU 649 -21.238 23.583 -14.927 1044 1HB GLU 649 1HB GLU 649 -22.206 24.099 -17.193 1045 2HB GLU 649 2HB GLU 649 -22.730 25.204 -15.937 1046 1HG GLU 649 1HG GLU 649 -20.405 26.431 -16.882 1047 2HG GLU 649 2HG GLU 649 -21.081 25.733 -18.341 1048 HE2 GLU 649 HE GLU 649 -22.013 28.900 -18.127 1049 H ALA 650 H ALA 650 -18.641 25.501 -16.433 1050 HA ALA 650 HA ALA 650 -17.850 23.752 -18.419 1051 1HB ALA 650 2HB ALA 650 -16.790 26.050 -16.951 1052 2HB ALA 650 1HB ALA 650 -16.562 25.586 -18.654 1053 3HB ALA 650 3HB ALA 650 -15.510 24.896 -17.395 1054 H TYR 651 H TYR 651 -16.161 24.110 -15.221 1055 HA TYR 651 HA TYR 651 -14.740 21.771 -15.375 1056 1HB TYR 651 1HB TYR 651 -14.224 23.318 -13.618 1057 2HB TYR 651 2HB TYR 651 -15.913 23.594 -13.244 1058 HD1 TYR 651 1HD TYR 651 -16.748 22.714 -11.265 1059 HD2 TYR 651 2HD TYR 651 -13.394 20.810 -13.117 1060 HE1 TYR 651 1HE TYR 651 -16.571 21.104 -9.305 1061 HE2 TYR 651 2HE TYR 651 -13.228 19.207 -11.151 1062 HH TYR 651 HH TYR 651 -14.881 19.740 -8.246 1063 H GLN 652 H GLN 652 -18.154 22.289 -14.497 1064 HA GLN 652 HA GLN 652 -18.562 19.910 -13.165 1065 1HB GLN 652 1HB GLN 652 -20.365 21.754 -14.759 1066 2HB GLN 652 2HB GLN 652 -21.003 20.273 -14.072 1067 1HG GLN 652 1HG GLN 652 -19.443 21.546 -12.020 1068 2HG GLN 652 2HG GLN 652 -20.448 22.787 -12.743 1069 1HE2 GLN 652 1HE2 GLN 652 -20.645 21.720 -10.111 1070 2HE2 GLN 652 2HE2 GLN 652 -22.203 20.987 -9.923 1071 H GLY 653 H GLY 653 -19.058 20.736 -16.671 1072 1HA GLY 653 2HA GLY 653 -19.120 19.443 -18.506 1073 2HA GLY 653 1HA GLY 653 -19.903 18.223 -17.521 1074 H VAL 654 H VAL 654 -16.717 19.379 -16.524 1075 HA VAL 654 HA VAL 654 -15.317 17.314 -17.955 1076 HB VAL 654 HB VAL 654 -14.524 19.410 -15.933 1077 1HG1 VAL 654 3HG1 VAL 654 -13.132 17.335 -15.712 1078 2HG1 VAL 654 1HG1 VAL 654 -12.652 17.536 -17.414 1079 3HG1 VAL 654 2HG1 VAL 654 -12.219 18.778 -16.214 1080 1HG2 VAL 654 2HG2 VAL 654 -15.039 19.607 -18.646 1081 2HG2 VAL 654 3HG2 VAL 654 -14.065 20.741 -17.680 1082 3HG2 VAL 654 1HG2 VAL 654 -13.269 19.429 -18.582 1083 H GLN 655 H GLN 655 -16.346 18.036 -14.569 1084 HA GLN 655 HA GLN 655 -15.085 16.001 -13.309 1085 1HB GLN 655 1HB GLN 655 -17.418 17.710 -12.819 1086 2HB GLN 655 2HB GLN 655 -17.622 16.132 -12.086 1087 1HG GLN 655 1HG GLN 655 -14.896 17.160 -11.676 1088 2HG GLN 655 2HG GLN 655 -16.099 18.277 -11.063 1089 1HE2 GLN 655 1HE2 GLN 655 -14.563 17.281 -9.228 1090 2HE2 GLN 655 2HE2 GLN 655 -15.315 16.043 -8.277 1091 H GLN 656 H GLN 656 -18.332 15.920 -14.929 1092 HA GLN 656 HA GLN 656 -18.792 13.241 -14.334 1093 1HB GLN 656 1HB GLN 656 -20.681 13.425 -15.781 1094 2HB GLN 656 2HB GLN 656 -20.482 15.016 -15.074 1095 1HG GLN 656 1HG GLN 656 -18.972 15.470 -17.219 1096 2HG GLN 656 2HG GLN 656 -19.840 14.103 -17.889 1097 1HE2 GLN 656 1HE2 GLN 656 -20.714 16.810 -15.739 1098 2HE2 GLN 656 2HE2 GLN 656 -22.064 17.392 -16.657 1099 H LYS 657 H LYS 657 -17.106 14.911 -17.012 1100 HA LYS 657 HA LYS 657 -16.948 12.675 -18.712 1101 1HB LYS 657 1HB LYS 657 -15.566 15.332 -18.511 1102 2HB LYS 657 2HB LYS 657 -14.918 14.111 -19.588 1103 1HG LYS 657 1HG LYS 657 -17.220 13.878 -20.628 1104 2HG LYS 657 2HG LYS 657 -17.774 15.196 -19.616 1105 1HD LYS 657 1HD LYS 657 -15.471 16.274 -20.750 1106 2HD LYS 657 2HD LYS 657 -16.080 15.272 -22.053 1107 1HE LYS 657 1HE LYS 657 -18.409 16.391 -21.509 1108 2HE LYS 657 2HE LYS 657 -17.457 17.595 -20.664 1109 H TRP 658 H TRP 658 -15.171 13.719 -15.836 1110 HA TRP 658 HA TRP 658 -12.916 12.046 -16.321 1111 1HB TRP 658 1HB TRP 658 -12.536 13.928 -14.981 1112 2HB TRP 658 2HB TRP 658 -13.936 13.621 -13.973 1113 HD1 TRP 658 HD TRP 658 -13.594 11.926 -11.908 1114 HE1 TRP 658 1HE TRP 658 -11.532 10.774 -10.731 1115 HE3 TRP 658 3HE TRP 658 -10.251 12.934 -15.605 1116 HZ2 TRP 658 2HZ TRP 658 -8.796 10.422 -11.461 1117 HZ3 TRP 658 3HZ TRP 658 -7.905 12.151 -15.294 1118 HH2 TRP 658 HH TRP 658 -7.159 10.935 -13.309 1119 H ASP 659 H ASP 659 -15.798 11.925 -14.099 1120 HA ASP 659 HA ASP 659 -15.229 9.396 -13.142 1121 1HB ASP 659 1HB ASP 659 -17.559 11.254 -13.190 1122 2HB ASP 659 2HB ASP 659 -17.990 9.567 -12.994 1123 HD2 ASP 659 HD ASP 659 -18.032 11.861 -11.224 1124 H ALA 660 H ALA 660 -16.884 10.625 -16.056 1125 HA ALA 660 HA ALA 660 -18.405 8.472 -16.799 1126 1HB ALA 660 2HB ALA 660 -18.750 10.123 -18.307 1127 2HB ALA 660 3HB ALA 660 -17.120 10.799 -18.072 1128 3HB ALA 660 1HB ALA 660 -17.364 9.428 -19.181 1129 H THR 661 H THR 661 -15.438 9.043 -18.720 1130 HA THR 661 HA THR 661 -15.053 6.406 -19.381 1131 HB THR 661 HB THR 661 -12.822 7.199 -20.098 1132 HG1 THR 661 1HG THR 661 -13.576 9.517 -18.464 1133 1HG2 THR 661 2HG2 THR 661 -15.179 8.417 -20.915 1134 2HG2 THR 661 3HG2 THR 661 -14.240 9.810 -20.328 1135 3HG2 THR 661 1HG2 THR 661 -13.579 8.768 -21.611 1136 H ALA 662 H ALA 662 -14.293 8.054 -16.359 1137 HA ALA 662 HA ALA 662 -12.311 6.367 -15.411 1138 1HB ALA 662 3HB ALA 662 -12.654 8.282 -14.142 1139 2HB ALA 662 2HB ALA 662 -13.479 7.066 -13.139 1140 3HB ALA 662 1HB ALA 662 -14.426 8.134 -14.201 1141 H THR 663 H THR 663 -15.601 6.250 -13.955 1142 HA THR 663 HA THR 663 -15.469 3.681 -13.072 1143 HB THR 663 HB THR 663 -17.259 5.123 -12.360 1144 HG1 THR 663 1HG THR 663 -17.905 2.884 -12.693 1145 1HG2 THR 663 3HG2 THR 663 -17.388 5.825 -15.186 1146 2HG2 THR 663 1HG2 THR 663 -18.985 5.260 -14.640 1147 3HG2 THR 663 2HG2 THR 663 -18.191 6.621 -13.811 1148 H GLU 664 H GLU 664 -15.851 4.777 -16.394 1149 HA GLU 664 HA GLU 664 -17.008 2.443 -17.373 1150 1HB GLU 664 1HB GLU 664 -17.007 4.537 -18.648 1151 2HB GLU 664 2HB GLU 664 -15.257 4.542 -18.723 1152 1HG GLU 664 1HG GLU 664 -16.201 3.705 -20.846 1153 2HG GLU 664 2HG GLU 664 -15.283 2.441 -20.052 1154 HE2 GLU 664 HE GLU 664 -18.239 0.858 -21.087 1155 H LEU 665 H LEU 665 -13.564 3.539 -17.109 1156 HA LEU 665 HA LEU 665 -12.617 1.036 -18.153 1157 1HB LEU 665 1HB LEU 665 -11.575 3.309 -18.512 1158 2HB LEU 665 2HB LEU 665 -11.045 3.252 -16.843 1159 HG LEU 665 HG LEU 665 -9.252 2.616 -18.360 1160 1HD1 LEU 665 3HD1 LEU 665 -9.853 1.396 -16.042 1161 2HD1 LEU 665 1HD1 LEU 665 -9.859 -0.015 -17.127 1162 3HD1 LEU 665 2HD1 LEU 665 -8.409 1.011 -17.009 1163 1HD2 LEU 665 1HD2 LEU 665 -10.780 1.704 -20.144 1164 2HD2 LEU 665 2HD2 LEU 665 -9.320 0.740 -19.818 1165 3HD2 LEU 665 3HD2 LEU 665 -10.895 0.212 -19.180 1166 H ASN 666 H ASN 666 -13.474 2.426 -15.044 1167 HA ASN 666 HA ASN 666 -11.840 0.748 -13.506 1168 1HB ASN 666 1HB ASN 666 -13.575 2.915 -13.038 1169 2HB ASN 666 2HB ASN 666 -14.392 1.582 -12.247 1170 1HD2 ASN 666 1HD2 ASN 666 -12.335 4.023 -11.753 1171 2HD2 ASN 666 2HD2 ASN 666 -11.377 3.431 -10.436 1172 H ASN 667 H ASN 667 -15.351 0.745 -14.466 1173 HA ASN 667 HA ASN 667 -15.988 -1.600 -13.139 1174 1HB ASN 667 1HB ASN 667 -18.084 -1.394 -14.201 1175 2HB ASN 667 2HB ASN 667 -17.493 0.252 -14.310 1176 1HD2 ASN 667 1HD2 ASN 667 -17.675 1.171 -16.195 1177 2HD2 ASN 667 2HD2 ASN 667 -17.681 0.404 -17.748 1178 H ALA 668 H ALA 668 -14.831 -0.840 -16.475 1179 HA ALA 668 HA ALA 668 -15.170 -3.391 -17.566 1180 1HB ALA 668 3HB ALA 668 -14.675 -1.087 -18.668 1181 2HB ALA 668 2HB ALA 668 -13.935 -2.540 -19.382 1182 3HB ALA 668 1HB ALA 668 -12.967 -1.467 -18.343 1183 H LEU 669 H LEU 669 -12.581 -1.892 -15.593 1184 HA LEU 669 HA LEU 669 -10.721 -3.979 -16.001 1185 1HB LEU 669 1HB LEU 669 -10.930 -1.501 -14.512 1186 2HB LEU 669 2HB LEU 669 -10.170 -2.754 -13.551 1187 HG LEU 669 HG LEU 669 -9.228 -2.233 -16.361 1188 1HD1 LEU 669 1HD1 LEU 669 -9.371 -0.092 -14.879 1189 2HD1 LEU 669 2HD1 LEU 669 -7.968 -0.799 -14.044 1190 3HD1 LEU 669 3HD1 LEU 669 -7.882 -0.447 -15.786 1191 1HD2 LEU 669 1HD2 LEU 669 -8.545 -4.205 -14.745 1192 2HD2 LEU 669 2HD2 LEU 669 -7.345 -3.396 -15.781 1193 3HD2 LEU 669 3HD2 LEU 669 -7.467 -2.966 -14.058 1194 H GLN 670 H GLN 670 -13.167 -3.249 -13.439 1195 HA GLN 670 HA GLN 670 -12.499 -5.392 -11.829 1196 1HB GLN 670 1HB GLN 670 -14.910 -3.626 -12.170 1197 2HB GLN 670 2HB GLN 670 -15.103 -5.081 -11.213 1198 1HG GLN 670 1HG GLN 670 -12.728 -4.131 -10.195 1199 2HG GLN 670 2HG GLN 670 -13.508 -2.624 -10.630 1200 1HE2 GLN 670 1HE2 GLN 670 -13.310 -5.173 -8.416 1201 2HE2 GLN 670 2HE2 GLN 670 -14.641 -4.773 -7.383 1202 H ASN 671 H ASN 671 -15.113 -5.071 -14.338 1203 HA ASN 671 HA ASN 671 -16.096 -7.604 -14.091 1204 1HB ASN 671 1HB ASN 671 -16.586 -5.411 -15.725 1205 2HB ASN 671 2HB ASN 671 -15.936 -6.553 -16.885 1206 1HD2 ASN 671 1HD2 ASN 671 -17.505 -7.489 -17.937 1207 2HD2 ASN 671 2HD2 ASN 671 -18.973 -8.135 -17.283 1208 H LEU 672 H LEU 672 -13.243 -6.305 -15.830 1209 HA LEU 672 HA LEU 672 -12.758 -8.652 -17.352 1210 1HB LEU 672 1HB LEU 672 -11.918 -6.709 -18.274 1211 2HB LEU 672 2HB LEU 672 -11.291 -6.117 -16.748 1212 HG LEU 672 HG LEU 672 -9.973 -8.591 -17.506 1213 1HD1 LEU 672 1HD1 LEU 672 -10.703 -7.214 -19.749 1214 2HD1 LEU 672 2HD1 LEU 672 -9.103 -6.515 -19.402 1215 3HD1 LEU 672 3HD1 LEU 672 -9.280 -8.274 -19.614 1216 1HD2 LEU 672 2HD2 LEU 672 -9.342 -6.592 -15.911 1217 2HD2 LEU 672 3HD2 LEU 672 -8.088 -7.518 -16.770 1218 3HD2 LEU 672 1HD2 LEU 672 -8.606 -5.932 -17.392 1219 H ALA 673 H ALA 673 -11.586 -7.332 -14.209 1220 HA ALA 673 HA ALA 673 -9.766 -9.490 -13.817 1221 1HB ALA 673 3HB ALA 673 -10.283 -6.945 -12.706 1222 2HB ALA 673 1HB ALA 673 -10.577 -8.110 -11.392 1223 3HB ALA 673 2HB ALA 673 -9.007 -8.091 -12.229 1224 H ARG 674 H ARG 674 -13.195 -9.060 -13.539 1225 HA ARG 674 HA ARG 674 -13.566 -10.841 -11.396 1226 1HB ARG 674 1HB ARG 674 -15.352 -9.594 -13.507 1227 2HB ARG 674 2HB ARG 674 -15.992 -10.885 -12.510 1228 1HG ARG 674 1HG ARG 674 -14.687 -9.170 -10.677 1229 2HG ARG 674 2HG ARG 674 -15.470 -8.082 -11.806 1230 1HD ARG 674 1HD ARG 674 -17.506 -9.872 -11.424 1231 2HD ARG 674 2HD ARG 674 -16.696 -10.023 -9.878 1232 HE ARG 674 HE ARG 674 -16.915 -7.245 -10.436 1233 2HH1 ARG 674 1HH ARG 674 -19.978 -6.628 -8.918 1234 1HH2 ARG 674 2HH2 ARG 674 -19.060 -9.983 -9.762 1235 2HH2 ARG 674 1HH2 ARG 674 -20.299 -8.999 -9.058 1236 H THR 675 H THR 675 -13.179 -11.112 -14.913 1237 HA THR 675 HA THR 675 -13.831 -13.978 -14.752 1238 HB THR 675 HB THR 675 -13.718 -12.049 -17.131 1239 HG1 THR 675 1HG THR 675 -15.860 -13.447 -15.689 1240 1HG2 THR 675 1HG2 THR 675 -13.357 -14.673 -17.451 1241 2HG2 THR 675 2HG2 THR 675 -15.094 -14.752 -17.070 1242 3HG2 THR 675 3HG2 THR 675 -14.533 -13.816 -18.476 1243 H ILE 676 H ILE 676 -11.247 -11.804 -14.666 1244 HA ILE 676 HA ILE 676 -9.480 -13.624 -16.105 1245 HB ILE 676 HB ILE 676 -9.327 -10.781 -15.197 1246 1HG1 ILE 676 1HG1 ILE 676 -8.884 -12.262 -17.796 1247 2HG1 ILE 676 2HG1 ILE 676 -10.147 -11.109 -17.411 1248 1HG2 ILE 676 2HG2 ILE 676 -7.111 -12.682 -15.135 1249 2HG2 ILE 676 3HG2 ILE 676 -6.809 -11.299 -16.214 1250 3HG2 ILE 676 1HG2 ILE 676 -7.222 -11.020 -14.505 1251 1HD1 ILE 676 3HD1 ILE 676 -8.083 -9.482 -16.923 1252 2HD1 ILE 676 1HD1 ILE 676 -7.235 -10.612 -18.006 1253 3HD1 ILE 676 2HD1 ILE 676 -8.673 -9.736 -18.584 1254 H SER 677 H SER 677 -9.744 -11.944 -12.894 1255 HA SER 677 HA SER 677 -7.680 -13.102 -11.646 1256 1HB SER 677 1HB SER 677 -9.191 -11.396 -10.652 1257 2HB SER 677 2HB SER 677 -10.455 -12.598 -10.482 1258 HG SER 677 HG SER 677 -7.998 -12.333 -9.035 1259 H GLU 678 H GLU 678 -10.737 -14.595 -12.640 1260 HA GLU 678 HA GLU 678 -10.647 -16.789 -10.938 1261 1HB GLU 678 1HB GLU 678 -12.064 -17.824 -12.918 1262 2HB GLU 678 2HB GLU 678 -12.722 -16.515 -11.956 1263 1HG GLU 678 1HG GLU 678 -12.591 -14.990 -13.681 1264 2HG GLU 678 2HG GLU 678 -11.075 -15.634 -14.281 1265 HE2 GLU 678 HE GLU 678 -14.502 -16.310 -15.789 1266 H ALA 679 H ALA 679 -8.687 -15.885 -13.651 1267 HA ALA 679 HA ALA 679 -8.060 -18.148 -14.954 1268 1HB ALA 679 1HB ALA 679 -6.165 -16.022 -13.876 1269 2HB ALA 679 2HB ALA 679 -5.775 -17.174 -15.175 1270 3HB ALA 679 3HB ALA 679 -7.058 -15.965 -15.414 1271 H GLY 680 H GLY 680 -6.514 -17.094 -11.832 1272 1HA GLY 680 2HA GLY 680 -5.011 -18.387 -10.602 1273 2HA GLY 680 1HA GLY 680 -5.504 -19.824 -11.476 1274 H GLN 681 H GLN 681 -8.409 -18.369 -10.960 1275 HA GLN 681 HA GLN 681 -8.649 -19.421 -8.255 1276 1HB GLN 681 1HB GLN 681 -9.464 -16.974 -9.332 1277 2HB GLN 681 2HB GLN 681 -10.950 -17.902 -9.308 1278 1HG GLN 681 1HG GLN 681 -10.785 -16.788 -7.169 1279 2HG GLN 681 2HG GLN 681 -10.477 -18.489 -6.880 1280 1HE2 GLN 681 1HE2 GLN 681 -8.638 -19.115 -5.977 1281 2HE2 GLN 681 2HE2 GLN 681 -7.276 -18.106 -5.619 1282 H ALA 682 H ALA 682 -10.832 -19.008 -11.142 1283 HA ALA 682 HA ALA 682 -12.040 -21.571 -10.486 1284 1HB ALA 682 3HB ALA 682 -12.841 -19.679 -12.712 1285 2HB ALA 682 1HB ALA 682 -13.845 -20.858 -11.835 1286 3HB ALA 682 2HB ALA 682 -13.300 -19.373 -11.020 1287 H MET 683 H MET 683 -11.027 -19.928 -13.570 1288 HA MET 683 HA MET 683 -10.934 -21.946 -15.220 1289 1HB MET 683 1HB MET 683 -10.124 -19.588 -15.656 1290 2HB MET 683 2HB MET 683 -8.632 -19.955 -14.813 1291 1HG MET 683 1HG MET 683 -9.392 -21.826 -17.036 1292 2HG MET 683 2HG MET 683 -8.912 -20.210 -17.514 1293 1HE MET 683 1HE MET 683 -7.436 -22.081 -18.718 1294 2HE MET 683 2HE MET 683 -5.797 -22.454 -18.132 1295 3HE MET 683 3HE MET 683 -7.174 -23.461 -17.626 1296 H ALA 684 H ALA 684 -8.667 -21.485 -12.499 1297 HA ALA 684 HA ALA 684 -7.014 -23.691 -13.370 1298 1HB ALA 684 2HB ALA 684 -5.786 -23.151 -11.249 1299 2HB ALA 684 3HB ALA 684 -5.949 -21.760 -12.347 1300 3HB ALA 684 1HB ALA 684 -6.998 -21.891 -10.915 1301 H SER 685 H SER 685 -9.307 -22.886 -10.679 1302 HA SER 685 HA SER 685 -9.102 -25.287 -9.379 1303 1HB SER 685 1HB SER 685 -11.317 -23.232 -9.617 1304 2HB SER 685 2HB SER 685 -11.570 -24.691 -8.680 1305 HG SER 685 HG SER 685 -10.187 -24.016 -7.147 1306 H THR 686 H THR 686 -12.124 -24.382 -11.161 1307 HA THR 686 HA THR 686 -12.017 -26.516 -12.993 1308 HB THR 686 HB THR 686 -12.286 -27.793 -10.798 1309 HG1 THR 686 1HG THR 686 -14.101 -28.987 -11.793 1310 1HG2 THR 686 2HG2 THR 686 -14.808 -26.099 -10.771 1311 2HG2 THR 686 3HG2 THR 686 -14.853 -27.759 -10.128 1312 3HG2 THR 686 1HG2 THR 686 -13.759 -26.555 -9.407 1313 H GLU 687 H GLU 687 -14.149 -26.785 -14.155 1314 HA GLU 687 HA GLU 687 -15.251 -24.145 -14.396 1315 1HB GLU 687 1HB GLU 687 -16.315 -25.037 -16.449 1316 2HB GLU 687 2HB GLU 687 -14.592 -25.353 -16.433 1317 1HG GLU 687 1HG GLU 687 -15.615 -27.612 -15.155 1318 2HG GLU 687 2HG GLU 687 -16.858 -27.263 -16.340 1319 HE2 GLU 687 HE GLU 687 -13.397 -28.747 -17.549 1320 H GLY 688 H GLY 688 -17.266 -23.510 -13.685 1321 1HA GLY 688 2HA GLY 688 -19.099 -25.640 -12.768 1322 2HA GLY 688 1HA GLY 688 -19.586 -24.071 -13.377 1323 H ASN 689 H ASN 689 -16.703 -23.929 -11.457 1324 HA ASN 689 HA ASN 689 -17.722 -23.983 -8.919 1325 1HB ASN 689 1HB ASN 689 -15.278 -23.880 -9.523 1326 2HB ASN 689 2HB ASN 689 -15.476 -22.212 -10.023 1327 1HD2 ASN 689 1HD2 ASN 689 -15.423 -24.453 -7.354 1328 2HD2 ASN 689 2HD2 ASN 689 -15.260 -23.307 -6.066 1329 H VAL 690 H VAL 690 -17.184 -21.190 -11.197 1330 HA VAL 690 HA VAL 690 -18.793 -19.504 -9.437 1331 HB VAL 690 HB VAL 690 -17.210 -18.728 -11.888 1332 1HG1 VAL 690 1HG1 VAL 690 -18.984 -17.165 -10.978 1333 2HG1 VAL 690 2HG1 VAL 690 -18.002 -17.041 -9.498 1334 3HG1 VAL 690 3HG1 VAL 690 -17.336 -16.496 -11.057 1335 1HG2 VAL 690 1HG2 VAL 690 -15.814 -19.897 -10.130 1336 2HG2 VAL 690 2HG2 VAL 690 -15.325 -18.228 -10.514 1337 3HG2 VAL 690 3HG2 VAL 690 -16.236 -18.569 -9.022 1338 H THR 691 H THR 691 -20.803 -18.728 -10.016 1339 HA THR 691 HA THR 691 -21.840 -19.758 -12.571 1340 HB THR 691 HB THR 691 -23.064 -19.207 -9.832 1341 HG1 THR 691 1HG THR 691 -22.081 -21.306 -10.424 1342 1HG2 THR 691 3HG2 THR 691 -24.456 -19.722 -12.510 1343 2HG2 THR 691 1HG2 THR 691 -25.231 -19.986 -10.930 1344 3HG2 THR 691 2HG2 THR 691 -24.732 -18.347 -11.414 1345 H GLY 692 H GLY 692 -21.044 -16.891 -10.730 1346 1HA GLY 692 2HA GLY 692 -21.349 -14.697 -11.139 1347 2HA GLY 692 1HA GLY 692 -22.808 -15.090 -12.028 1348 H MET 693 H MET 693 -19.387 -16.138 -12.619 1349 HA MET 693 HA MET 693 -19.428 -14.534 -15.036 1350 1HB MET 693 1HB MET 693 -17.250 -15.913 -13.394 1351 2HB MET 693 2HB MET 693 -16.907 -15.309 -15.003 1352 1HG MET 693 1HG MET 693 -16.295 -13.523 -13.527 1353 2HG MET 693 2HG MET 693 -17.829 -13.032 -14.218 1354 1HE MET 693 3HE MET 693 -15.934 -14.656 -11.524 1355 2HE MET 693 1HE MET 693 -16.120 -13.105 -10.669 1356 3HE MET 693 2HE MET 693 -16.919 -14.568 -10.043 1357 H PHE 694 H PHE 694 -17.933 -17.734 -14.162 1358 HA PHE 694 HA PHE 694 -17.949 -18.725 -16.732 1359 1HB PHE 694 1HB PHE 694 -17.636 -19.617 -13.920 1360 2HB PHE 694 2HB PHE 694 -18.336 -20.887 -14.903 1361 HD1 PHE 694 1HD PHE 694 -17.087 -21.309 -17.203 1362 HD2 PHE 694 2HD PHE 694 -15.335 -19.456 -13.811 1363 HE1 PHE 694 1HE PHE 694 -14.803 -21.908 -18.055 1364 HE2 PHE 694 2HE PHE 694 -13.051 -20.055 -14.663 1365 HZ PHE 694 HZ PHE 694 -12.813 -21.274 -16.775 1366 H ALA 695 H ALA 695 -19.394 -19.880 -18.005 1367 HA ALA 695 HA ALA 695 -21.395 -20.452 -18.776 1368 1HB ALA 695 3HB ALA 695 -22.568 -21.652 -16.448 1369 2HB ALA 695 2HB ALA 695 -20.817 -21.970 -16.417 1370 3HB ALA 695 1HB ALA 695 -21.784 -22.451 -17.832 No H/Q in entry = 1370 Start of MODEL 18 1 H ALA 1 H ALA 1 -3.982 30.127 -1.939 2 HA ALA 1 HA ALA 1 -5.412 31.311 0.343 3 1HB ALA 1 3HB ALA 1 -2.784 32.327 0.256 4 2HB ALA 1 1HB ALA 1 -3.442 31.147 1.415 5 3HB ALA 1 2HB ALA 1 -2.623 30.583 -0.061 6 H GLU 2 H GLU 2 -2.962 32.333 -2.144 7 HA GLU 2 HA GLU 2 -4.074 34.898 -2.278 8 1HB GLU 2 1HB GLU 2 -2.494 35.217 -4.174 9 2HB GLU 2 2HB GLU 2 -1.713 34.490 -2.784 10 1HG GLU 2 1HG GLU 2 -2.262 32.195 -3.917 11 2HG GLU 2 2HG GLU 2 -2.579 33.132 -5.364 12 HE2 GLU 2 HE GLU 2 1.065 32.170 -4.831 13 H MET 3 H MET 3 -4.097 32.090 -4.589 14 HA MET 3 HA MET 3 -6.660 33.059 -5.520 15 1HB MET 3 1HB MET 3 -4.101 32.851 -7.094 16 2HB MET 3 2HB MET 3 -5.533 32.243 -7.901 17 1HG MET 3 1HG MET 3 -6.111 34.806 -6.608 18 2HG MET 3 2HG MET 3 -4.722 34.959 -7.665 19 1HE MET 3 2HE MET 3 -5.202 36.171 -9.288 20 2HE MET 3 3HE MET 3 -5.247 35.030 -10.654 21 3HE MET 3 1HE MET 3 -6.586 36.177 -10.409 22 H LYS 4 H LYS 4 -7.830 31.362 -6.858 23 HA LYS 4 HA LYS 4 -7.116 28.728 -5.809 24 1HB LYS 4 1HB LYS 4 -9.445 28.140 -6.211 25 2HB LYS 4 2HB LYS 4 -9.330 29.572 -5.208 26 1HG LYS 4 1HG LYS 4 -9.372 30.630 -7.803 27 2HG LYS 4 2HG LYS 4 -10.467 29.267 -7.920 28 1HD LYS 4 1HD LYS 4 -11.742 30.102 -5.947 29 2HD LYS 4 2HD LYS 4 -10.632 31.448 -5.786 30 1HE LYS 4 1HE LYS 4 -11.782 32.644 -7.335 31 2HE LYS 4 2HE LYS 4 -11.574 31.374 -8.524 32 H THR 5 H THR 5 -7.317 30.684 -8.721 33 HA THR 5 HA THR 5 -6.998 28.273 -10.368 34 HB THR 5 HB THR 5 -7.737 29.710 -12.198 35 HG1 THR 5 1HG THR 5 -7.119 31.818 -11.950 36 1HG2 THR 5 3HG2 THR 5 -9.262 29.817 -9.626 37 2HG2 THR 5 1HG2 THR 5 -9.681 31.081 -10.807 38 3HG2 THR 5 2HG2 THR 5 -9.823 29.364 -11.253 39 H ASP 6 H ASP 6 -5.151 30.520 -8.683 40 HA ASP 6 HA ASP 6 -3.294 31.505 -10.251 41 1HB ASP 6 1HB ASP 6 -3.438 30.633 -7.533 42 2HB ASP 6 2HB ASP 6 -1.920 30.014 -8.152 43 HD2 ASP 6 HD ASP 6 -0.808 31.343 -6.902 44 H ALA 7 H ALA 7 -1.361 30.756 -11.361 45 HA ALA 7 HA ALA 7 -1.537 28.149 -12.425 46 1HB ALA 7 1HB ALA 7 0.139 30.573 -12.707 47 2HB ALA 7 2HB ALA 7 0.989 29.045 -13.043 48 3HB ALA 7 3HB ALA 7 -0.485 29.461 -13.950 49 H ALA 8 H ALA 8 -0.064 29.536 -9.557 50 HA ALA 8 HA ALA 8 1.910 27.500 -9.245 51 1HB ALA 8 2HB ALA 8 2.582 29.306 -8.037 52 2HB ALA 8 1HB ALA 8 1.558 28.604 -6.763 53 3HB ALA 8 3HB ALA 8 0.919 29.897 -7.806 54 H THR 9 H THR 9 -1.375 28.185 -7.883 55 HA THR 9 HA THR 9 -1.398 25.888 -6.230 56 HB THR 9 HB THR 9 -2.786 28.024 -5.998 57 HG1 THR 9 1HG THR 9 -4.599 26.674 -5.300 58 1HG2 THR 9 3HG2 THR 9 -4.105 26.757 -8.430 59 2HG2 THR 9 1HG2 THR 9 -5.078 27.685 -7.264 60 3HG2 THR 9 2HG2 THR 9 -3.742 28.475 -8.135 61 H LEU 10 H LEU 10 -2.166 26.473 -9.648 62 HA LEU 10 HA LEU 10 -3.593 24.037 -9.962 63 1HB LEU 10 1HB LEU 10 -2.446 26.118 -11.787 64 2HB LEU 10 2HB LEU 10 -2.997 24.591 -12.445 65 HG LEU 10 HG LEU 10 -4.690 26.529 -10.843 66 1HD1 LEU 10 3HD1 LEU 10 -4.079 27.385 -13.067 67 2HD1 LEU 10 1HD1 LEU 10 -4.741 25.909 -13.809 68 3HD1 LEU 10 2HD1 LEU 10 -5.817 27.026 -12.937 69 1HD2 LEU 10 2HD2 LEU 10 -5.293 23.835 -12.057 70 2HD2 LEU 10 3HD2 LEU 10 -5.593 24.415 -10.402 71 3HD2 LEU 10 1HD2 LEU 10 -6.567 25.040 -11.754 72 H ALA 11 H ALA 11 -0.239 25.124 -10.836 73 HA ALA 11 HA ALA 11 0.604 22.660 -11.801 74 1HB ALA 11 3HB ALA 11 2.066 25.001 -10.527 75 2HB ALA 11 1HB ALA 11 2.901 23.616 -11.272 76 3HB ALA 11 2HB ALA 11 1.851 24.660 -12.260 77 H GLN 12 H GLN 12 0.119 23.878 -8.513 78 HA GLN 12 HA GLN 12 1.798 22.105 -7.208 79 1HB GLN 12 1HB GLN 12 0.298 24.212 -6.427 80 2HB GLN 12 2HB GLN 12 -0.781 22.933 -5.908 81 1HG GLN 12 1HG GLN 12 0.543 22.425 -4.133 82 2HG GLN 12 2HG GLN 12 1.959 22.274 -5.154 83 1HE2 GLN 12 1HE2 GLN 12 0.234 24.188 -2.923 84 2HE2 GLN 12 2HE2 GLN 12 1.280 25.567 -2.861 85 H GLU 13 H GLU 13 -1.617 21.842 -8.315 86 HA GLU 13 HA GLU 13 -1.708 19.161 -7.235 87 1HB GLU 13 1HB GLU 13 -3.834 20.955 -8.476 88 2HB GLU 13 2HB GLU 13 -4.143 19.295 -8.008 89 1HG GLU 13 1HG GLU 13 -4.659 20.142 -5.955 90 2HG GLU 13 2HG GLU 13 -2.928 20.292 -5.721 91 HE2 GLU 13 HE GLU 13 -4.786 22.605 -7.861 92 H ALA 14 H ALA 14 -1.670 20.988 -10.311 93 HA ALA 14 HA ALA 14 -2.385 18.968 -12.050 94 1HB ALA 14 1HB ALA 14 -1.960 21.480 -12.448 95 2HB ALA 14 2HB ALA 14 -0.242 21.040 -12.609 96 3HB ALA 14 3HB ALA 14 -1.445 20.356 -13.729 97 H GLY 15 H GLY 15 0.937 19.931 -10.924 98 1HA GLY 15 2HA GLY 15 2.803 18.700 -10.657 99 2HA GLY 15 1HA GLY 15 2.421 18.042 -12.236 100 H ASN 16 H ASN 16 0.337 17.659 -9.338 101 HA ASN 16 HA ASN 16 1.381 15.093 -8.756 102 1HB ASN 16 1HB ASN 16 -0.773 16.896 -7.706 103 2HB ASN 16 2HB ASN 16 -1.052 15.184 -7.452 104 1HD2 ASN 16 1HD2 ASN 16 -0.876 15.891 -5.196 105 2HD2 ASN 16 2HD2 ASN 16 0.679 15.923 -4.434 106 H PHE 17 H PHE 17 -1.388 16.531 -10.534 107 HA PHE 17 HA PHE 17 -2.914 14.215 -10.823 108 1HB PHE 17 1HB PHE 17 -3.645 16.579 -11.276 109 2HB PHE 17 2HB PHE 17 -2.475 16.707 -12.575 110 HD1 PHE 17 1HD PHE 17 -5.559 14.931 -11.540 111 HD2 PHE 17 2HD PHE 17 -3.023 16.028 -14.760 112 HE1 PHE 17 1HE PHE 17 -7.284 14.122 -13.174 113 HE2 PHE 17 2HE PHE 17 -4.747 15.219 -16.394 114 HZ PHE 17 HZ PHE 17 -6.857 14.275 -15.582 115 H GLU 18 H GLU 18 -0.566 15.781 -13.121 116 HA GLU 18 HA GLU 18 -0.715 14.131 -15.181 117 1HB GLU 18 1HB GLU 18 1.625 15.509 -13.874 118 2HB GLU 18 2HB GLU 18 1.946 14.428 -15.215 119 1HG GLU 18 1HG GLU 18 -0.304 16.037 -15.977 120 2HG GLU 18 2HG GLU 18 0.879 17.126 -15.279 121 HE2 GLU 18 HE GLU 18 0.980 17.610 -17.945 122 H ARG 19 H ARG 19 0.852 13.414 -12.033 123 HA ARG 19 HA ARG 19 2.066 11.060 -12.869 124 1HB ARG 19 1HB ARG 19 2.060 12.589 -10.557 125 2HB ARG 19 2HB ARG 19 1.150 11.187 -10.029 126 1HG ARG 19 1HG ARG 19 2.950 9.688 -10.472 127 2HG ARG 19 2HG ARG 19 3.754 10.818 -11.543 128 1HD ARG 19 1HD ARG 19 3.425 11.980 -8.868 129 2HD ARG 19 2HD ARG 19 4.261 10.443 -8.779 130 HE ARG 19 HE ARG 19 6.048 11.330 -10.089 131 2HH1 ARG 19 1HH ARG 19 6.667 14.650 -10.901 132 1HH2 ARG 19 2HH2 ARG 19 3.428 13.687 -9.723 133 2HH2 ARG 19 1HH2 ARG 19 4.386 15.023 -10.268 134 H ILE 20 H ILE 20 -1.175 11.854 -11.536 135 HA ILE 20 HA ILE 20 -1.962 9.180 -11.098 136 HB ILE 20 HB ILE 20 -3.677 11.620 -11.567 137 1HG1 ILE 20 1HG1 ILE 20 -2.686 10.596 -8.899 138 2HG1 ILE 20 2HG1 ILE 20 -1.851 11.848 -9.796 139 1HG2 ILE 20 3HG2 ILE 20 -4.691 9.249 -11.606 140 2HG2 ILE 20 1HG2 ILE 20 -4.362 9.238 -9.857 141 3HG2 ILE 20 2HG2 ILE 20 -5.434 10.476 -10.554 142 1HD1 ILE 20 2HD1 ILE 20 -4.222 13.006 -9.915 143 2HD1 ILE 20 3HD1 ILE 20 -4.608 11.930 -8.550 144 3HD1 ILE 20 1HD1 ILE 20 -3.276 13.103 -8.409 145 H SER 21 H SER 21 -2.393 11.510 -13.829 146 HA SER 21 HA SER 21 -3.985 9.854 -15.350 147 1HB SER 21 1HB SER 21 -3.808 12.173 -15.939 148 2HB SER 21 2HB SER 21 -2.062 12.097 -16.054 149 HG SER 21 HG SER 21 -2.776 12.037 -18.168 150 H GLY 22 H GLY 22 -0.387 10.303 -15.279 151 1HA GLY 22 2HA GLY 22 1.295 9.022 -16.037 152 2HA GLY 22 1HA GLY 22 0.248 8.545 -17.358 153 H ASP 23 H ASP 23 0.272 7.990 -13.757 154 HA ASP 23 HA ASP 23 0.970 5.365 -13.866 155 1HB ASP 23 1HB ASP 23 -0.513 7.118 -11.938 156 2HB ASP 23 2HB ASP 23 -0.685 5.392 -11.684 157 HD2 ASP 23 HD ASP 23 0.740 6.105 -9.567 158 H LEU 24 H LEU 24 -2.358 6.839 -13.591 159 HA LEU 24 HA LEU 24 -3.850 4.561 -13.627 160 1HB LEU 24 1HB LEU 24 -4.558 6.966 -13.311 161 2HB LEU 24 2HB LEU 24 -4.577 7.116 -15.057 162 HG LEU 24 HG LEU 24 -6.178 5.017 -14.919 163 1HD1 LEU 24 3HD1 LEU 24 -5.742 4.992 -12.349 164 2HD1 LEU 24 1HD1 LEU 24 -6.962 6.288 -12.314 165 3HD1 LEU 24 2HD1 LEU 24 -7.381 4.689 -12.975 166 1HD2 LEU 24 1HD2 LEU 24 -6.730 7.933 -14.611 167 2HD2 LEU 24 2HD2 LEU 24 -7.129 6.820 -15.941 168 3HD2 LEU 24 3HD2 LEU 24 -8.089 6.796 -14.442 169 H LYS 25 H LYS 25 -2.224 6.230 -16.347 170 HA LYS 25 HA LYS 25 -3.467 4.594 -18.320 171 1HB LYS 25 1HB LYS 25 -2.842 6.576 -19.254 172 2HB LYS 25 2HB LYS 25 -1.431 6.757 -18.231 173 1HG LYS 25 1HG LYS 25 -0.062 5.559 -19.658 174 2HG LYS 25 2HG LYS 25 -1.332 4.443 -20.119 175 1HD LYS 25 1HD LYS 25 -0.813 5.783 -22.070 176 2HD LYS 25 2HD LYS 25 -2.389 6.290 -21.497 177 1HE LYS 25 1HE LYS 25 -1.583 8.415 -21.451 178 2HE LYS 25 2HE LYS 25 -0.621 7.942 -20.065 179 H THR 26 H THR 26 -0.511 4.476 -16.324 180 HA THR 26 HA THR 26 0.827 2.491 -17.780 181 HB THR 26 HB THR 26 0.901 3.726 -15.040 182 HG1 THR 26 1HG THR 26 2.122 4.411 -16.985 183 1HG2 THR 26 1HG2 THR 26 1.926 0.962 -15.717 184 2HG2 THR 26 2HG2 THR 26 2.989 2.046 -14.788 185 3HG2 THR 26 3HG2 THR 26 1.387 1.607 -14.148 186 H GLN 27 H GLN 27 -1.557 2.266 -15.077 187 HA GLN 27 HA GLN 27 -1.373 -0.522 -14.954 188 1HB GLN 27 1HB GLN 27 -3.557 1.397 -14.034 189 2HB GLN 27 2HB GLN 27 -3.528 -0.309 -13.634 190 1HG GLN 27 1HG GLN 27 -2.412 0.502 -11.773 191 2HG GLN 27 2HG GLN 27 -1.031 0.269 -12.826 192 1HE2 GLN 27 1HE2 GLN 27 0.270 1.845 -12.128 193 2HE2 GLN 27 2HE2 GLN 27 -0.065 3.542 -12.207 194 H ILE 28 H ILE 28 -3.661 1.757 -16.587 195 HA ILE 28 HA ILE 28 -5.451 -0.099 -17.545 196 HB ILE 28 HB ILE 28 -4.517 2.586 -18.496 197 1HG1 ILE 28 1HG1 ILE 28 -7.119 1.563 -17.321 198 2HG1 ILE 28 2HG1 ILE 28 -5.892 2.485 -16.476 199 1HG2 ILE 28 2HG2 ILE 28 -5.846 0.594 -20.120 200 2HG2 ILE 28 3HG2 ILE 28 -6.887 2.017 -19.874 201 3HG2 ILE 28 1HG2 ILE 28 -5.255 2.216 -20.557 202 1HD1 ILE 28 2HD1 ILE 28 -6.730 3.780 -18.992 203 2HD1 ILE 28 3HD1 ILE 28 -8.070 3.558 -17.842 204 3HD1 ILE 28 1HD1 ILE 28 -6.615 4.458 -17.351 205 H ASP 29 H ASP 29 -2.347 1.060 -19.002 206 HA ASP 29 HA ASP 29 -2.600 -0.458 -21.303 207 1HB ASP 29 1HB ASP 29 -0.831 1.421 -20.355 208 2HB ASP 29 2HB ASP 29 0.145 -0.025 -20.191 209 HD2 ASP 29 HD ASP 29 0.221 -0.815 -23.461 210 H GLN 30 H GLN 30 -1.084 -1.040 -18.071 211 HA GLN 30 HA GLN 30 0.226 -3.368 -18.639 212 1HB GLN 30 1HB GLN 30 -0.983 -2.175 -16.149 213 2HB GLN 30 2HB GLN 30 -0.394 -3.824 -16.074 214 1HG GLN 30 1HG GLN 30 1.832 -3.068 -16.935 215 2HG GLN 30 2HG GLN 30 1.244 -1.419 -17.009 216 1HE2 GLN 30 1HE2 GLN 30 0.585 -0.365 -15.060 217 2HE2 GLN 30 2HE2 GLN 30 1.290 -0.787 -13.535 218 H VAL 31 H VAL 31 -3.175 -2.893 -17.464 219 HA VAL 31 HA VAL 31 -3.811 -5.608 -17.356 220 HB VAL 31 HB VAL 31 -5.388 -3.060 -17.620 221 1HG1 VAL 31 1HG1 VAL 31 -6.324 -5.814 -18.085 222 2HG1 VAL 31 2HG1 VAL 31 -7.256 -4.925 -16.856 223 3HG1 VAL 31 3HG1 VAL 31 -7.081 -4.257 -18.497 224 1HG2 VAL 31 1HG2 VAL 31 -4.139 -3.941 -15.478 225 2HG2 VAL 31 2HG2 VAL 31 -5.772 -3.245 -15.349 226 3HG2 VAL 31 3HG2 VAL 31 -5.555 -5.012 -15.344 227 H GLU 32 H GLU 32 -4.484 -3.131 -19.933 228 HA GLU 32 HA GLU 32 -5.713 -4.724 -21.708 229 1HB GLU 32 1HB GLU 32 -4.078 -2.261 -21.841 230 2HB GLU 32 2HB GLU 32 -4.103 -3.153 -23.349 231 1HG GLU 32 1HG GLU 32 -6.746 -3.296 -22.777 232 2HG GLU 32 2HG GLU 32 -6.377 -1.836 -21.880 233 HE2 GLU 32 HE GLU 32 -7.581 -0.784 -23.316 234 H SER 33 H SER 33 -2.167 -4.428 -21.126 235 HA SER 33 HA SER 33 -1.517 -6.147 -23.264 236 1HB SER 33 1HB SER 33 -0.136 -4.471 -21.398 237 2HB SER 33 2HB SER 33 0.544 -6.077 -21.227 238 HG SER 33 HG SER 33 0.223 -4.683 -23.748 239 H THR 34 H THR 34 -1.526 -6.496 -19.641 240 HA THR 34 HA THR 34 -0.801 -9.166 -19.542 241 HB THR 34 HB THR 34 -2.137 -7.132 -17.798 242 HG1 THR 34 1HG THR 34 -0.140 -9.276 -17.590 243 1HG2 THR 34 3HG2 THR 34 -3.545 -9.320 -17.579 244 2HG2 THR 34 1HG2 THR 34 -2.054 -10.062 -16.950 245 3HG2 THR 34 2HG2 THR 34 -2.797 -8.691 -16.091 246 H ALA 35 H ALA 35 -4.025 -7.675 -20.071 247 HA ALA 35 HA ALA 35 -5.573 -9.924 -19.774 248 1HB ALA 35 3HB ALA 35 -6.141 -8.003 -22.011 249 2HB ALA 35 2HB ALA 35 -6.065 -7.368 -20.350 250 3HB ALA 35 1HB ALA 35 -7.230 -8.649 -20.761 251 H GLY 36 H GLY 36 -3.418 -8.931 -22.448 252 1HA GLY 36 2HA GLY 36 -2.547 -10.167 -24.125 253 2HA GLY 36 1HA GLY 36 -4.226 -10.453 -24.537 254 H SER 37 H SER 37 -2.150 -11.571 -21.766 255 HA SER 37 HA SER 37 -1.945 -14.170 -22.740 256 1HB SER 37 1HB SER 37 -1.724 -13.219 -19.850 257 2HB SER 37 2HB SER 37 -1.066 -14.709 -20.497 258 HG SER 37 HG SER 37 0.677 -13.394 -20.629 259 H LEU 38 H LEU 38 -4.446 -12.433 -20.972 260 HA LEU 38 HA LEU 38 -5.690 -14.784 -19.915 261 1HB LEU 38 1HB LEU 38 -6.265 -11.856 -19.983 262 2HB LEU 38 2HB LEU 38 -7.588 -12.958 -19.656 263 HG LEU 38 HG LEU 38 -6.937 -12.572 -17.521 264 1HD1 LEU 38 2HD1 LEU 38 -6.571 -15.004 -18.033 265 2HD1 LEU 38 3HD1 LEU 38 -4.831 -14.650 -18.154 266 3HD1 LEU 38 1HD1 LEU 38 -5.688 -14.388 -16.616 267 1HD2 LEU 38 1HD2 LEU 38 -4.244 -11.954 -18.689 268 2HD2 LEU 38 2HD2 LEU 38 -5.318 -10.942 -17.693 269 3HD2 LEU 38 3HD2 LEU 38 -4.404 -12.275 -16.946 270 H GLN 39 H GLN 39 -6.836 -12.308 -22.323 271 HA GLN 39 HA GLN 39 -8.860 -13.886 -23.287 272 1HB GLN 39 1HB GLN 39 -7.548 -12.056 -25.244 273 2HB GLN 39 2HB GLN 39 -9.230 -12.156 -24.762 274 1HG GLN 39 1HG GLN 39 -6.947 -10.824 -23.246 275 2HG GLN 39 2HG GLN 39 -8.368 -10.053 -23.921 276 1HE2 GLN 39 1HE2 GLN 39 -7.102 -10.535 -21.142 277 2HE2 GLN 39 2HE2 GLN 39 -8.438 -10.979 -20.132 278 H GLY 40 H GLY 40 -5.433 -14.193 -23.692 279 1HA GLY 40 2HA GLY 40 -4.153 -15.273 -25.256 280 2HA GLY 40 1HA GLY 40 -5.570 -15.565 -26.245 281 H GLN 41 H GLN 41 -6.560 -16.400 -23.173 282 HA GLN 41 HA GLN 41 -6.270 -19.167 -23.794 283 1HB GLN 41 1HB GLN 41 -4.175 -18.982 -22.659 284 2HB GLN 41 2HB GLN 41 -4.833 -17.922 -21.428 285 1HG GLN 41 1HG GLN 41 -6.364 -19.880 -20.735 286 2HG GLN 41 2HG GLN 41 -5.405 -20.895 -21.795 287 1HE2 GLN 41 1HE2 GLN 41 -5.720 -19.559 -18.733 288 2HE2 GLN 41 2HE2 GLN 41 -4.164 -19.934 -18.071 289 H TRP 42 H TRP 42 -8.327 -19.897 -23.494 290 HA TRP 42 HA TRP 42 -9.614 -19.522 -20.980 291 1HB TRP 42 1HB TRP 42 -10.688 -18.047 -23.387 292 2HB TRP 42 2HB TRP 42 -11.655 -18.436 -21.979 293 HD1 TRP 42 HD TRP 42 -9.757 -15.619 -23.257 294 HE1 TRP 42 1HE TRP 42 -9.013 -13.871 -21.426 295 HE3 TRP 42 3HE TRP 42 -10.602 -18.652 -19.264 296 HZ2 TRP 42 2HZ TRP 42 -8.864 -13.951 -18.577 297 HZ3 TRP 42 3HZ TRP 42 -10.132 -17.740 -16.992 298 HH2 TRP 42 HH TRP 42 -9.292 -15.476 -16.614 299 H ARG 43 H ARG 43 -11.648 -20.846 -20.927 300 HA ARG 43 HA ARG 43 -11.307 -23.070 -22.699 301 1HB ARG 43 1HB ARG 43 -12.762 -22.542 -20.114 302 2HB ARG 43 2HB ARG 43 -13.396 -23.823 -21.128 303 1HG ARG 43 1HG ARG 43 -10.424 -23.809 -20.708 304 2HG ARG 43 2HG ARG 43 -11.402 -24.211 -19.311 305 1HD ARG 43 1HD ARG 43 -12.426 -25.617 -21.654 306 2HD ARG 43 2HD ARG 43 -10.707 -25.918 -21.495 307 HE ARG 43 HE ARG 43 -12.817 -26.749 -19.616 308 2HH1 ARG 43 1HH ARG 43 -10.605 -28.440 -17.539 309 1HH2 ARG 43 2HH2 ARG 43 -9.338 -26.271 -20.089 310 2HH2 ARG 43 1HH2 ARG 43 -8.891 -27.340 -18.802 311 H GLY 44 H GLY 44 -14.479 -22.082 -21.359 312 1HA GLY 44 2HA GLY 44 -16.064 -22.628 -23.454 313 2HA GLY 44 1HA GLY 44 -15.431 -21.056 -23.898 314 H ALA 45 H ALA 45 -15.173 -19.843 -21.315 315 HA ALA 45 HA ALA 45 -17.842 -19.012 -20.927 316 1HB ALA 45 2HB ALA 45 -16.625 -20.948 -18.937 317 2HB ALA 45 1HB ALA 45 -18.232 -21.002 -19.700 318 3HB ALA 45 3HB ALA 45 -17.876 -19.775 -18.461 319 H ALA 46 H ALA 46 -14.559 -19.397 -19.450 320 HA ALA 46 HA ALA 46 -14.716 -16.862 -18.150 321 1HB ALA 46 2HB ALA 46 -12.263 -17.354 -17.734 322 2HB ALA 46 3HB ALA 46 -13.387 -18.611 -17.164 323 3HB ALA 46 1HB ALA 46 -12.476 -18.850 -18.674 324 H GLY 47 H GLY 47 -13.894 -18.044 -21.349 325 1HA GLY 47 2HA GLY 47 -12.957 -17.057 -23.152 326 2HA GLY 47 1HA GLY 47 -12.166 -15.901 -22.098 327 H THR 48 H THR 48 -15.498 -16.742 -23.291 328 HA THR 48 HA THR 48 -15.994 -14.324 -24.510 329 HB THR 48 HB THR 48 -18.444 -15.086 -24.134 330 HG1 THR 48 1HG THR 48 -18.399 -17.310 -23.135 331 1HG2 THR 48 2HG2 THR 48 -16.889 -15.968 -26.034 332 2HG2 THR 48 3HG2 THR 48 -16.630 -17.386 -24.990 333 3HG2 THR 48 1HG2 THR 48 -18.265 -17.002 -25.580 334 H ALA 49 H ALA 49 -15.993 -15.122 -21.076 335 HA ALA 49 HA ALA 49 -17.515 -12.801 -20.356 336 1HB ALA 49 1HB ALA 49 -16.018 -14.994 -18.922 337 2HB ALA 49 3HB ALA 49 -17.744 -14.566 -18.842 338 3HB ALA 49 2HB ALA 49 -16.534 -13.540 -18.034 339 H ALA 50 H ALA 50 -14.043 -13.825 -20.333 340 HA ALA 50 HA ALA 50 -13.199 -11.274 -19.345 341 1HB ALA 50 1HB ALA 50 -10.974 -12.220 -19.559 342 2HB ALA 50 3HB ALA 50 -11.583 -13.526 -20.603 343 3HB ALA 50 2HB ALA 50 -12.054 -13.466 -18.888 344 H GLN 51 H GLN 51 -12.581 -13.065 -22.455 345 HA GLN 51 HA GLN 51 -11.419 -11.148 -23.856 346 1HB GLN 51 1HB GLN 51 -11.656 -13.083 -25.090 347 2HB GLN 51 2HB GLN 51 -13.303 -13.357 -24.558 348 1HG GLN 51 1HG GLN 51 -12.696 -11.002 -26.367 349 2HG GLN 51 2HG GLN 51 -12.821 -12.608 -27.058 350 1HE2 GLN 51 1HE2 GLN 51 -14.469 -9.870 -26.372 351 2HE2 GLN 51 2HE2 GLN 51 -16.097 -10.456 -26.293 352 H ALA 52 H ALA 52 -14.880 -11.297 -22.978 353 HA ALA 52 HA ALA 52 -15.600 -9.114 -24.683 354 1HB ALA 52 1HB ALA 52 -17.221 -10.842 -24.141 355 2HB ALA 52 3HB ALA 52 -17.765 -9.305 -23.427 356 3HB ALA 52 2HB ALA 52 -17.012 -10.548 -22.399 357 H ALA 53 H ALA 53 -14.981 -9.614 -21.149 358 HA ALA 53 HA ALA 53 -15.572 -7.052 -20.313 359 1HB ALA 53 1HB ALA 53 -13.367 -8.849 -19.237 360 2HB ALA 53 3HB ALA 53 -15.099 -9.112 -18.920 361 3HB ALA 53 2HB ALA 53 -14.305 -7.627 -18.345 362 H VAL 54 H VAL 54 -12.341 -8.431 -21.262 363 HA VAL 54 HA VAL 54 -10.926 -6.074 -21.028 364 HB VAL 54 HB VAL 54 -9.545 -7.836 -21.268 365 1HG1 VAL 54 3HG1 VAL 54 -11.724 -8.969 -22.965 366 2HG1 VAL 54 1HG1 VAL 54 -10.076 -9.595 -23.214 367 3HG1 VAL 54 2HG1 VAL 54 -10.831 -9.694 -21.606 368 1HG2 VAL 54 1HG2 VAL 54 -8.970 -6.170 -23.055 369 2HG2 VAL 54 2HG2 VAL 54 -8.395 -7.823 -23.379 370 3HG2 VAL 54 3HG2 VAL 54 -9.835 -7.200 -24.221 371 H VAL 55 H VAL 55 -12.929 -7.356 -23.724 372 HA VAL 55 HA VAL 55 -12.172 -5.526 -25.659 373 HB VAL 55 HB VAL 55 -14.483 -7.302 -25.111 374 1HG1 VAL 55 2HG1 VAL 55 -14.610 -4.980 -27.053 375 2HG1 VAL 55 3HG1 VAL 55 -15.625 -6.434 -27.209 376 3HG1 VAL 55 1HG1 VAL 55 -15.761 -5.404 -25.763 377 1HG2 VAL 55 1HG2 VAL 55 -12.429 -8.028 -26.317 378 2HG2 VAL 55 2HG2 VAL 55 -13.913 -8.210 -27.283 379 3HG2 VAL 55 3HG2 VAL 55 -12.804 -6.854 -27.601 380 H ARG 56 H ARG 56 -14.971 -5.383 -23.342 381 HA ARG 56 HA ARG 56 -15.756 -2.863 -24.122 382 1HB ARG 56 1HB ARG 56 -17.319 -4.112 -22.832 383 2HB ARG 56 2HB ARG 56 -16.133 -4.521 -21.608 384 1HG ARG 56 1HG ARG 56 -16.267 -2.414 -20.565 385 2HG ARG 56 2HG ARG 56 -16.812 -1.607 -22.022 386 1HD ARG 56 1HD ARG 56 -19.010 -2.000 -21.543 387 2HD ARG 56 2HD ARG 56 -18.715 -3.689 -21.179 388 HE ARG 56 HE ARG 56 -17.655 -2.477 -18.970 389 2HH1 ARG 56 1HH ARG 56 -20.401 -1.474 -17.095 390 1HH2 ARG 56 2HH2 ARG 56 -20.763 -2.034 -20.612 391 2HH2 ARG 56 1HH2 ARG 56 -21.600 -1.568 -19.169 392 H PHE 57 H PHE 57 -13.678 -3.953 -21.345 393 HA PHE 57 HA PHE 57 -13.204 -1.475 -20.244 394 1HB PHE 57 1HB PHE 57 -12.385 -3.283 -18.973 395 2HB PHE 57 2HB PHE 57 -11.944 -4.202 -20.398 396 HD1 PHE 57 1HD PHE 57 -10.852 -1.498 -18.137 397 HD2 PHE 57 2HD PHE 57 -9.729 -4.138 -21.264 398 HE1 PHE 57 1HE PHE 57 -8.440 -0.901 -17.775 399 HE2 PHE 57 2HE PHE 57 -7.318 -3.541 -20.902 400 HZ PHE 57 HZ PHE 57 -6.702 -1.930 -19.162 401 H GLN 58 H GLN 58 -11.623 -3.132 -23.014 402 HA GLN 58 HA GLN 58 -9.455 -1.435 -23.209 403 1HB GLN 58 1HB GLN 58 -10.937 -3.172 -25.205 404 2HB GLN 58 2HB GLN 58 -9.577 -2.192 -25.717 405 1HG GLN 58 1HG GLN 58 -8.910 -3.611 -23.253 406 2HG GLN 58 2HG GLN 58 -9.489 -4.745 -24.457 407 1HE2 GLN 58 1HE2 GLN 58 -7.123 -5.325 -24.017 408 2HE2 GLN 58 2HE2 GLN 58 -5.947 -4.676 -25.110 409 H GLU 59 H GLU 59 -12.595 -1.384 -25.053 410 HA GLU 59 HA GLU 59 -12.109 0.885 -26.466 411 1HB GLU 59 1HB GLU 59 -14.642 -0.401 -25.423 412 2HB GLU 59 2HB GLU 59 -14.738 1.117 -26.293 413 1HG GLU 59 1HG GLU 59 -13.094 -1.112 -27.498 414 2HG GLU 59 2HG GLU 59 -14.840 -1.240 -27.575 415 HE2 GLU 59 HE GLU 59 -13.547 -0.598 -30.163 416 H ALA 60 H ALA 60 -12.957 0.492 -23.047 417 HA ALA 60 HA ALA 60 -13.626 3.279 -22.729 418 1HB ALA 60 2HB ALA 60 -13.264 0.976 -20.769 419 2HB ALA 60 3HB ALA 60 -13.830 2.605 -20.329 420 3HB ALA 60 1HB ALA 60 -14.803 1.590 -21.420 421 H ALA 61 H ALA 61 -10.812 1.155 -22.561 422 HA ALA 61 HA ALA 61 -9.216 2.595 -20.818 423 1HB ALA 61 1HB ALA 61 -8.975 0.303 -22.233 424 2HB ALA 61 2HB ALA 61 -7.965 1.370 -23.237 425 3HB ALA 61 3HB ALA 61 -7.582 1.146 -21.513 426 H ASN 62 H ASN 62 -9.332 2.789 -24.452 427 HA ASN 62 HA ASN 62 -7.611 4.877 -24.692 428 1HB ASN 62 1HB ASN 62 -9.397 5.367 -26.747 429 2HB ASN 62 2HB ASN 62 -8.142 4.145 -26.812 430 1HD2 ASN 62 1HD2 ASN 62 -8.666 1.985 -26.022 431 2HD2 ASN 62 2HD2 ASN 62 -10.260 1.348 -26.255 432 H LYS 63 H LYS 63 -11.237 4.871 -24.375 433 HA LYS 63 HA LYS 63 -11.697 7.562 -24.585 434 1HB LYS 63 1HB LYS 63 -13.322 5.565 -24.390 435 2HB LYS 63 2HB LYS 63 -13.192 5.784 -22.657 436 1HG LYS 63 1HG LYS 63 -14.831 7.348 -22.864 437 2HG LYS 63 2HG LYS 63 -13.605 8.395 -23.551 438 1HD LYS 63 1HD LYS 63 -15.603 8.234 -25.030 439 2HD LYS 63 2HD LYS 63 -14.161 7.638 -25.830 440 1HE LYS 63 1HE LYS 63 -14.826 5.366 -25.632 441 2HE LYS 63 2HE LYS 63 -15.932 5.698 -24.314 442 H GLN 64 H GLN 64 -10.445 5.663 -21.821 443 HA GLN 64 HA GLN 64 -10.664 7.837 -20.030 444 1HB GLN 64 1HB GLN 64 -9.883 5.038 -19.945 445 2HB GLN 64 2HB GLN 64 -8.695 6.001 -19.089 446 1HG GLN 64 1HG GLN 64 -11.385 6.931 -18.435 447 2HG GLN 64 2HG GLN 64 -11.269 5.204 -18.162 448 1HE2 GLN 64 1HE2 GLN 64 -9.957 4.384 -16.595 449 2HE2 GLN 64 2HE2 GLN 64 -9.156 5.340 -15.393 450 H LYS 65 H LYS 65 -8.018 6.366 -22.003 451 HA LYS 65 HA LYS 65 -5.940 7.915 -21.019 452 1HB LYS 65 1HB LYS 65 -6.456 6.191 -23.349 453 2HB LYS 65 2HB LYS 65 -5.274 7.448 -23.652 454 1HG LYS 65 1HG LYS 65 -3.852 5.874 -22.729 455 2HG LYS 65 2HG LYS 65 -4.348 6.663 -21.245 456 1HD LYS 65 1HD LYS 65 -4.877 4.521 -20.599 457 2HD LYS 65 2HD LYS 65 -6.371 4.851 -21.455 458 1HE LYS 65 1HE LYS 65 -4.795 4.013 -23.545 459 2HE LYS 65 2HE LYS 65 -4.083 3.089 -22.237 460 H GLN 66 H GLN 66 -8.355 8.550 -23.617 461 HA GLN 66 HA GLN 66 -7.167 10.901 -24.491 462 1HB GLN 66 1HB GLN 66 -8.928 9.570 -25.708 463 2HB GLN 66 2HB GLN 66 -10.121 10.146 -24.562 464 1HG GLN 66 1HG GLN 66 -8.405 12.192 -25.970 465 2HG GLN 66 2HG GLN 66 -9.682 11.417 -26.886 466 1HE2 GLN 66 1HE2 GLN 66 -9.524 14.159 -26.204 467 2HE2 GLN 66 2HE2 GLN 66 -10.877 14.572 -25.206 468 H GLU 67 H GLU 67 -9.857 10.299 -22.130 469 HA GLU 67 HA GLU 67 -10.275 12.976 -21.559 470 1HB GLU 67 1HB GLU 67 -11.248 10.420 -20.666 471 2HB GLU 67 2HB GLU 67 -10.856 11.362 -19.242 472 1HG GLU 67 1HG GLU 67 -12.376 12.716 -21.474 473 2HG GLU 67 2HG GLU 67 -13.240 11.586 -20.450 474 HE2 GLU 67 HE GLU 67 -12.462 11.889 -18.191 475 H LEU 68 H LEU 68 -7.796 10.691 -20.538 476 HA LEU 68 HA LEU 68 -7.055 12.082 -18.175 477 1HB LEU 68 1HB LEU 68 -5.878 9.896 -19.853 478 2HB LEU 68 2HB LEU 68 -4.903 10.667 -18.618 479 HG LEU 68 HG LEU 68 -7.480 9.128 -18.230 480 1HD1 LEU 68 1HD1 LEU 68 -4.596 8.553 -17.856 481 2HD1 LEU 68 2HD1 LEU 68 -5.689 7.993 -16.567 482 3HD1 LEU 68 3HD1 LEU 68 -5.952 7.467 -18.247 483 1HD2 LEU 68 3HD2 LEU 68 -6.130 11.095 -16.456 484 2HD2 LEU 68 1HD2 LEU 68 -7.847 10.643 -16.584 485 3HD2 LEU 68 2HD2 LEU 68 -6.711 9.589 -15.707 486 H ASP 69 H ASP 69 -5.651 11.877 -21.520 487 HA ASP 69 HA ASP 69 -3.677 13.750 -21.016 488 1HB ASP 69 1HB ASP 69 -4.213 12.075 -23.061 489 2HB ASP 69 2HB ASP 69 -4.922 13.519 -23.755 490 HD2 ASP 69 HD ASP 69 -2.035 12.092 -22.712 491 H GLU 70 H GLU 70 -6.924 13.986 -22.655 492 HA GLU 70 HA GLU 70 -6.887 16.588 -23.347 493 1HB GLU 70 1HB GLU 70 -9.161 16.353 -23.705 494 2HB GLU 70 2HB GLU 70 -8.721 14.664 -23.547 495 1HG GLU 70 1HG GLU 70 -9.355 14.697 -21.144 496 2HG GLU 70 2HG GLU 70 -9.729 16.406 -21.248 497 HE2 GLU 70 HE GLU 70 -12.013 13.720 -23.155 498 H ILE 71 H ILE 71 -7.823 15.186 -20.141 499 HA ILE 71 HA ILE 71 -8.392 17.727 -19.012 500 HB ILE 71 HB ILE 71 -7.957 14.981 -17.846 501 1HG1 ILE 71 1HG1 ILE 71 -10.478 16.620 -18.240 502 2HG1 ILE 71 2HG1 ILE 71 -9.957 15.309 -19.280 503 1HG2 ILE 71 2HG2 ILE 71 -7.507 17.214 -16.404 504 2HG2 ILE 71 3HG2 ILE 71 -9.270 17.071 -16.206 505 3HG2 ILE 71 1HG2 ILE 71 -8.209 15.724 -15.729 506 1HD1 ILE 71 2HD1 ILE 71 -10.239 14.859 -16.293 507 2HD1 ILE 71 3HD1 ILE 71 -11.659 14.781 -17.363 508 3HD1 ILE 71 1HD1 ILE 71 -10.296 13.664 -17.610 509 H SER 72 H SER 72 -5.531 15.575 -19.206 510 HA SER 72 HA SER 72 -4.030 16.969 -17.324 511 1HB SER 72 1HB SER 72 -2.948 15.004 -17.718 512 2HB SER 72 2HB SER 72 -3.603 14.859 -19.337 513 HG SER 72 HG SER 72 -1.972 16.295 -20.118 514 H THR 73 H THR 73 -4.812 17.527 -20.732 515 HA THR 73 HA THR 73 -2.717 19.538 -20.990 516 HB THR 73 HB THR 73 -4.574 17.990 -22.790 517 HG1 THR 73 1HG THR 73 -2.442 17.974 -23.899 518 1HG2 THR 73 3HG2 THR 73 -4.877 20.526 -23.312 519 2HG2 THR 73 1HG2 THR 73 -3.146 20.519 -23.729 520 3HG2 THR 73 2HG2 THR 73 -4.286 19.502 -24.643 521 H ASN 74 H ASN 74 -6.132 19.240 -20.226 522 HA ASN 74 HA ASN 74 -6.994 21.702 -21.053 523 1HB ASN 74 1HB ASN 74 -7.834 19.640 -19.092 524 2HB ASN 74 2HB ASN 74 -8.335 21.252 -18.621 525 1HD2 ASN 74 1HD2 ASN 74 -8.840 18.598 -20.687 526 2HD2 ASN 74 2HD2 ASN 74 -10.124 19.231 -21.662 527 H ILE 75 H ILE 75 -4.840 20.719 -18.443 528 HA ILE 75 HA ILE 75 -5.225 23.011 -16.804 529 HB ILE 75 HB ILE 75 -2.842 21.169 -16.858 530 1HG1 ILE 75 1HG1 ILE 75 -4.933 19.839 -16.878 531 2HG1 ILE 75 2HG1 ILE 75 -4.003 19.649 -15.405 532 1HG2 ILE 75 1HG2 ILE 75 -2.818 23.290 -15.473 533 2HG2 ILE 75 2HG2 ILE 75 -4.127 22.567 -14.507 534 3HG2 ILE 75 3HG2 ILE 75 -2.538 21.769 -14.591 535 1HD1 ILE 75 3HD1 ILE 75 -6.266 21.674 -15.621 536 2HD1 ILE 75 1HD1 ILE 75 -6.539 19.988 -15.121 537 3HD1 ILE 75 2HD1 ILE 75 -5.493 21.047 -14.145 538 H ARG 76 H ARG 76 -2.672 21.975 -19.167 539 HA ARG 76 HA ARG 76 -1.092 24.154 -18.950 540 1HB ARG 76 1HB ARG 76 -1.721 22.856 -21.638 541 2HB ARG 76 2HB ARG 76 -0.196 23.544 -21.117 542 1HG ARG 76 1HG ARG 76 -0.487 21.679 -19.163 543 2HG ARG 76 2HG ARG 76 -1.425 20.892 -20.416 544 1HD ARG 76 1HD ARG 76 1.064 21.956 -21.533 545 2HD ARG 76 2HD ARG 76 1.407 20.924 -20.160 546 HE ARG 76 HE ARG 76 -0.559 19.669 -21.858 547 2HH1 ARG 76 1HH ARG 76 1.647 17.605 -23.573 548 1HH2 ARG 76 2HH2 ARG 76 2.907 20.385 -21.704 549 2HH2 ARG 76 1HH2 ARG 76 3.355 19.050 -22.712 550 H GLN 77 H GLN 77 -4.304 23.876 -20.354 551 HA GLN 77 HA GLN 77 -4.054 26.192 -21.981 552 1HB GLN 77 1HB GLN 77 -6.351 24.391 -21.160 553 2HB GLN 77 2HB GLN 77 -6.662 25.884 -22.022 554 1HG GLN 77 1HG GLN 77 -4.476 24.460 -23.316 555 2HG GLN 77 2HG GLN 77 -5.839 23.376 -23.118 556 1HE2 GLN 77 1HE2 GLN 77 -4.575 26.167 -24.684 557 2HE2 GLN 77 2HE2 GLN 77 -5.886 26.486 -25.770 558 H ALA 78 H ALA 78 -4.941 25.437 -18.643 559 HA ALA 78 HA ALA 78 -6.446 27.741 -18.100 560 1HB ALA 78 3HB ALA 78 -4.695 26.343 -16.073 561 2HB ALA 78 1HB ALA 78 -6.328 27.023 -15.873 562 3HB ALA 78 2HB ALA 78 -6.100 25.507 -16.778 563 H GLY 79 H GLY 79 -3.034 27.183 -18.657 564 1HA GLY 79 2HA GLY 79 -2.496 29.970 -17.829 565 2HA GLY 79 1HA GLY 79 -1.731 29.142 -19.171 566 H VAL 80 H VAL 80 -1.768 26.578 -17.322 567 HA VAL 80 HA VAL 80 0.339 27.383 -15.470 568 HB VAL 80 HB VAL 80 -0.825 24.631 -15.665 569 1HG1 VAL 80 3HG1 VAL 80 0.804 26.165 -13.802 570 2HG1 VAL 80 1HG1 VAL 80 -0.622 25.460 -13.004 571 3HG1 VAL 80 2HG1 VAL 80 0.513 24.411 -13.887 572 1HG2 VAL 80 3HG2 VAL 80 -2.341 27.069 -15.112 573 2HG2 VAL 80 1HG2 VAL 80 -2.909 25.403 -15.383 574 3HG2 VAL 80 2HG2 VAL 80 -2.389 25.913 -13.759 575 H GLN 81 H GLN 81 2.107 27.706 -16.877 576 HA GLN 81 HA GLN 81 3.148 25.209 -17.904 577 1HB GLN 81 1HB GLN 81 3.976 26.816 -19.917 578 2HB GLN 81 2HB GLN 81 2.494 25.885 -19.997 579 1HG GLN 81 1HG GLN 81 1.130 27.770 -19.457 580 2HG GLN 81 2HG GLN 81 2.480 28.677 -18.804 581 1HE2 GLN 81 1HE2 GLN 81 1.993 30.426 -20.127 582 2HE2 GLN 81 2HE2 GLN 81 2.373 30.463 -21.816 583 H TYR 82 H TYR 82 3.511 27.539 -15.741 584 HA TYR 82 HA TYR 82 6.401 27.402 -15.856 585 1HB TYR 82 1HB TYR 82 6.559 29.888 -15.703 586 2HB TYR 82 2HB TYR 82 5.652 29.475 -17.145 587 HD1 TYR 82 1HD TYR 82 3.036 29.419 -16.890 588 HD2 TYR 82 2HD TYR 82 5.670 31.421 -14.177 589 HE1 TYR 82 1HE TYR 82 1.116 30.883 -16.094 590 HE2 TYR 82 2HE TYR 82 3.741 32.878 -13.390 591 HH TYR 82 HH TYR 82 1.682 33.494 -13.773 592 H SER 83 H SER 83 5.991 26.023 -13.978 593 HA SER 83 HA SER 83 5.568 27.679 -11.636 594 1HB SER 83 1HB SER 83 3.623 25.885 -12.552 595 2HB SER 83 2HB SER 83 4.465 24.960 -11.325 596 HG SER 83 HG SER 83 3.032 27.435 -11.054 597 H ARG 84 H ARG 84 6.325 24.301 -12.774 598 HA ARG 84 HA ARG 84 8.183 24.045 -10.609 599 1HB ARG 84 1HB ARG 84 6.569 22.209 -11.643 600 2HB ARG 84 2HB ARG 84 7.831 22.015 -12.843 601 1HG ARG 84 1HG ARG 84 9.378 21.936 -10.611 602 2HG ARG 84 2HG ARG 84 7.878 21.362 -9.909 603 1HD ARG 84 1HD ARG 84 8.280 20.021 -12.452 604 2HD ARG 84 2HD ARG 84 9.752 19.887 -11.512 605 HE ARG 84 HE ARG 84 7.406 19.335 -9.886 606 2HH1 ARG 84 1HH ARG 84 7.768 15.881 -9.936 607 1HH2 ARG 84 2HH2 ARG 84 9.595 17.890 -12.268 608 2HH2 ARG 84 1HH2 ARG 84 9.293 16.267 -11.744 609 H ALA 85 H ALA 85 8.498 25.921 -13.083 610 HA ALA 85 HA ALA 85 10.712 24.800 -14.514 611 1HB ALA 85 1HB ALA 85 10.341 27.699 -14.698 612 2HB ALA 85 2HB ALA 85 10.219 26.454 -15.964 613 3HB ALA 85 3HB ALA 85 8.816 26.811 -14.929 614 H ASP 86 H ASP 86 11.548 24.391 -12.044 615 HA ASP 86 HA ASP 86 13.490 26.519 -11.681 616 1HB ASP 86 1HB ASP 86 11.442 26.367 -9.959 617 2HB ASP 86 2HB ASP 86 12.385 25.056 -9.276 618 HD2 ASP 86 HD ASP 86 11.802 27.253 -7.921 619 H GLU 87 H GLU 87 12.373 23.197 -10.685 620 HA GLU 87 HA GLU 87 14.902 22.325 -9.918 621 1HB GLU 87 1HB GLU 87 12.286 20.974 -10.600 622 2HB GLU 87 2HB GLU 87 13.716 19.989 -10.368 623 1HG GLU 87 1HG GLU 87 13.286 22.080 -8.282 624 2HG GLU 87 2HG GLU 87 12.061 20.828 -8.330 625 HE2 GLU 87 HE GLU 87 13.621 18.918 -6.468 626 H GLU 88 H GLU 88 13.211 22.482 -13.042 627 HA GLU 88 HA GLU 88 14.972 20.688 -14.329 628 1HB GLU 88 1HB GLU 88 12.631 21.168 -15.092 629 2HB GLU 88 2HB GLU 88 13.116 22.795 -15.523 630 1HG GLU 88 1HG GLU 88 13.704 21.992 -17.562 631 2HG GLU 88 2HG GLU 88 15.043 21.174 -16.783 632 HE2 GLU 88 HE GLU 88 13.522 20.366 -18.946 633 H GLN 89 H GLN 89 14.649 24.287 -14.130 634 HA GLN 89 HA GLN 89 17.077 24.552 -15.656 635 1HB GLN 89 1HB GLN 89 15.114 26.057 -16.062 636 2HB GLN 89 2HB GLN 89 15.271 26.687 -14.434 637 1HG GLN 89 1HG GLN 89 17.867 26.825 -15.701 638 2HG GLN 89 2HG GLN 89 16.688 27.507 -16.804 639 1HE2 GLN 89 1HE2 GLN 89 18.706 28.134 -14.279 640 2HE2 GLN 89 2HE2 GLN 89 18.012 29.590 -13.647 641 H GLN 90 H GLN 90 16.987 23.304 -12.890 642 HA GLN 90 HA GLN 90 17.731 24.834 -10.866 643 1HB GLN 90 1HB GLN 90 17.983 22.111 -11.553 644 2HB GLN 90 2HB GLN 90 19.607 22.591 -11.102 645 1HG GLN 90 1HG GLN 90 18.064 23.813 -9.127 646 2HG GLN 90 2HG GLN 90 17.185 22.324 -9.413 647 1HE2 GLN 90 1HE2 GLN 90 17.735 20.751 -8.132 648 2HE2 GLN 90 2HE2 GLN 90 19.308 20.408 -7.492 649 H GLN 91 H GLN 91 20.252 23.365 -13.049 650 HA GLN 91 HA GLN 91 22.048 25.449 -12.222 651 1HB GLN 91 1HB GLN 91 22.270 22.782 -13.526 652 2HB GLN 91 2HB GLN 91 23.438 23.965 -14.081 653 1HG GLN 91 1HG GLN 91 24.609 23.871 -12.131 654 2HG GLN 91 2HG GLN 91 23.161 24.066 -11.162 655 1HE2 GLN 91 1HE2 GLN 91 25.666 22.154 -11.516 656 2HE2 GLN 91 2HE2 GLN 91 25.017 20.587 -11.163 657 H ALA 92 H ALA 92 21.656 23.990 -15.512 658 HA ALA 92 HA ALA 92 21.317 26.725 -16.539 659 1HB ALA 92 3HB ALA 92 23.265 26.440 -17.622 660 2HB ALA 92 1HB ALA 92 23.397 24.766 -17.033 661 3HB ALA 92 2HB ALA 92 22.511 25.113 -18.537 662 H LEU 93 H LEU 93 21.296 23.488 -18.137 663 HA LEU 93 HA LEU 93 18.493 24.025 -18.833 664 1HB LEU 93 1HB LEU 93 19.809 24.176 -20.786 665 2HB LEU 93 2HB LEU 93 20.737 22.747 -20.378 666 HG LEU 93 HG LEU 93 18.082 21.849 -20.524 667 1HD1 LEU 93 1HD1 LEU 93 17.999 24.234 -21.808 668 2HD1 LEU 93 2HD1 LEU 93 18.456 23.156 -23.148 669 3HD1 LEU 93 3HD1 LEU 93 16.974 22.837 -22.216 670 1HD2 LEU 93 1HD2 LEU 93 20.521 21.057 -21.408 671 2HD2 LEU 93 2HD2 LEU 93 18.981 20.304 -21.890 672 3HD2 LEU 93 3HD2 LEU 93 19.746 21.519 -22.943 673 H SER 94 H SER 94 20.038 20.951 -19.556 674 HA SER 94 HA SER 94 19.021 19.784 -17.132 675 1HB SER 94 1HB SER 94 17.274 19.859 -19.203 676 2HB SER 94 2HB SER 94 18.148 18.408 -19.654 677 HG SER 94 HG SER 94 17.409 17.338 -17.890 678 H SER 95 H SER 95 19.994 18.714 -20.480 679 HA SER 95 HA SER 95 21.678 16.726 -19.337 680 1HB SER 95 1HB SER 95 21.020 17.598 -22.168 681 2HB SER 95 2HB SER 95 22.294 16.433 -21.866 682 HG SER 95 HG SER 95 20.403 15.410 -20.450 683 H GLN 96 H GLN 96 22.079 19.784 -21.242 684 HA GLN 96 HA GLN 96 24.930 19.594 -20.882 685 1HB GLN 96 1HB GLN 96 23.280 20.632 -22.898 686 2HB GLN 96 2HB GLN 96 23.909 22.067 -22.112 687 1HG GLN 96 1HG GLN 96 26.247 21.035 -22.305 688 2HG GLN 96 2HG GLN 96 25.538 19.767 -23.285 689 1HE2 GLN 96 1HE2 GLN 96 25.270 20.070 -25.381 690 2HE2 GLN 96 2HE2 GLN 96 25.456 21.563 -26.240 691 H MET 97 H MET 97 23.097 19.973 -18.547 692 HA MET 97 HA MET 97 23.511 22.721 -17.828 693 1HB MET 97 1HB MET 97 22.109 22.181 -15.920 694 2HB MET 97 2HB MET 97 21.426 21.300 -17.272 695 1HG MET 97 1HG MET 97 22.732 19.255 -16.555 696 2HG MET 97 2HG MET 97 23.316 20.145 -15.163 697 1HE MET 97 2HE MET 97 22.141 17.573 -15.093 698 2HE MET 97 3HE MET 97 21.768 18.032 -13.414 699 3HE MET 97 1HE MET 97 20.487 17.381 -14.464 700 H GLY 98 H GLY 98 25.141 23.505 -16.527 701 1HA GLY 98 2HA GLY 98 26.386 22.446 -14.414 702 2HA GLY 98 1HA GLY 98 27.208 23.456 -15.587 703 H PHE 99 H PHE 99 28.562 22.512 -17.215 704 HA PHE 99 HA PHE 99 28.728 19.839 -17.807 705 1HB PHE 99 1HB PHE 99 29.826 21.872 -18.928 706 2HB PHE 99 2HB PHE 99 30.958 21.951 -17.592 707 HD1 PHE 99 1HD PHE 99 33.018 20.958 -17.876 708 HD2 PHE 99 2HD PHE 99 29.726 19.473 -20.104 709 HE1 PHE 99 1HE PHE 99 34.547 19.372 -19.078 710 HE2 PHE 99 2HE PHE 99 31.255 17.887 -21.306 711 HZ PHE 99 HZ PHE 99 33.648 17.856 -20.779 712 H MET 601 H MET 601 7.946 -22.645 -23.196 713 HA MET 601 HA MET 601 9.588 -21.144 -23.824 714 1HB MET 601 1HB MET 601 11.293 -22.654 -24.912 715 2HB MET 601 2HB MET 601 10.417 -23.475 -23.636 716 1HG MET 601 1HG MET 601 8.785 -24.235 -25.573 717 2HG MET 601 2HG MET 601 10.102 -23.791 -26.640 718 1HE MET 601 3HE MET 601 8.767 -26.609 -26.309 719 2HE MET 601 1HE MET 601 10.135 -26.452 -27.437 720 3HE MET 601 2HE MET 601 10.125 -27.758 -26.227 721 H THR 602 H THR 602 7.954 -22.689 -26.633 722 HA THR 602 HA THR 602 9.173 -21.559 -28.752 723 HB THR 602 HB THR 602 6.195 -21.946 -28.157 724 HG1 THR 602 1HG THR 602 6.802 -23.903 -29.454 725 1HG2 THR 602 3HG2 THR 602 6.945 -20.452 -30.260 726 2HG2 THR 602 1HG2 THR 602 7.408 -22.035 -30.928 727 3HG2 THR 602 2HG2 THR 602 5.721 -21.730 -30.451 728 H GLU 603 H GLU 603 6.887 -19.897 -26.521 729 HA GLU 603 HA GLU 603 8.049 -17.425 -27.432 730 1HB GLU 603 1HB GLU 603 5.877 -16.351 -27.849 731 2HB GLU 603 2HB GLU 603 6.082 -17.729 -28.911 732 1HG GLU 603 1HG GLU 603 4.858 -18.999 -26.852 733 2HG GLU 603 2HG GLU 603 4.223 -17.391 -26.571 734 HE2 GLU 603 HE GLU 603 2.642 -19.528 -29.426 735 H GLN 604 H GLN 604 8.489 -16.154 -25.673 736 HA GLN 604 HA GLN 604 7.430 -17.037 -23.159 737 1HB GLN 604 1HB GLN 604 9.066 -15.466 -22.182 738 2HB GLN 604 2HB GLN 604 9.832 -16.508 -23.364 739 1HG GLN 604 1HG GLN 604 8.851 -14.218 -24.792 740 2HG GLN 604 2HG GLN 604 9.648 -13.613 -23.353 741 1HE2 GLN 604 1HE2 GLN 604 11.473 -12.827 -24.188 742 2HE2 GLN 604 2HE2 GLN 604 12.684 -13.744 -25.021 743 H GLN 605 H GLN 605 5.955 -15.410 -25.458 744 HA GLN 605 HA GLN 605 5.393 -12.908 -24.454 745 1HB GLN 605 1HB GLN 605 3.733 -14.789 -26.183 746 2HB GLN 605 2HB GLN 605 3.280 -13.125 -25.874 747 1HG GLN 605 1HG GLN 605 5.681 -12.513 -26.716 748 2HG GLN 605 2HG GLN 605 5.740 -14.149 -27.341 749 1HE2 GLN 605 1HE2 GLN 605 5.346 -14.202 -29.408 750 2HE2 GLN 605 2HE2 GLN 605 4.154 -13.297 -30.279 751 H TRP 606 H TRP 606 3.413 -15.955 -24.192 752 HA TRP 606 HA TRP 606 2.597 -15.107 -21.536 753 1HB TRP 606 1HB TRP 606 0.273 -15.233 -21.934 754 2HB TRP 606 2HB TRP 606 0.945 -14.117 -23.106 755 HD1 TRP 606 HD TRP 606 0.934 -14.948 -25.720 756 HE1 TRP 606 1HE TRP 606 -0.451 -16.742 -27.071 757 HE3 TRP 606 3HE TRP 606 -0.746 -17.486 -21.647 758 HZ2 TRP 606 2HZ TRP 606 -2.057 -18.972 -26.302 759 HZ3 TRP 606 3HZ TRP 606 -2.218 -19.460 -22.035 760 HH2 TRP 606 HH TRP 606 -2.876 -20.213 -24.266 761 H ASN 607 H ASN 607 3.021 -16.873 -20.286 762 HA ASN 607 HA ASN 607 2.624 -19.464 -21.566 763 1HB ASN 607 1HB ASN 607 4.644 -18.776 -19.367 764 2HB ASN 607 2HB ASN 607 4.476 -20.334 -20.153 765 1HD2 ASN 607 1HD2 ASN 607 5.997 -20.720 -21.552 766 2HD2 ASN 607 2HD2 ASN 607 6.759 -19.594 -22.625 767 H PHE 608 H PHE 608 2.376 -21.247 -19.686 768 HA PHE 608 HA PHE 608 0.099 -20.655 -18.248 769 1HB PHE 608 1HB PHE 608 1.493 -22.876 -18.923 770 2HB PHE 608 2HB PHE 608 2.192 -22.674 -17.328 771 HD1 PHE 608 1HD PHE 608 -0.245 -24.370 -19.046 772 HD2 PHE 608 2HD PHE 608 0.249 -22.138 -15.471 773 HE1 PHE 608 1HE PHE 608 -2.212 -25.556 -18.033 774 HE2 PHE 608 2HE PHE 608 -1.718 -23.324 -14.458 775 HZ PHE 608 HZ PHE 608 -2.924 -25.019 -15.752 776 H ALA 609 H ALA 609 3.569 -20.495 -17.303 777 HA ALA 609 HA ALA 609 2.898 -19.878 -14.574 778 1HB ALA 609 2HB ALA 609 5.486 -19.972 -16.168 779 2HB ALA 609 1HB ALA 609 4.887 -21.167 -14.992 780 3HB ALA 609 3HB ALA 609 5.410 -19.558 -14.438 781 H GLY 610 H GLY 610 2.673 -18.201 -17.466 782 1HA GLY 610 2HA GLY 610 3.189 -15.981 -18.015 783 2HA GLY 610 1HA GLY 610 3.570 -15.640 -16.339 784 H ILE 611 H ILE 611 0.747 -16.897 -18.268 785 HA ILE 611 HA ILE 611 -0.921 -14.774 -17.710 786 HB ILE 611 HB ILE 611 -1.297 -16.368 -19.487 787 1HG1 ILE 611 1HG1 ILE 611 -3.382 -15.699 -17.496 788 2HG1 ILE 611 2HG1 ILE 611 -3.288 -15.325 -19.205 789 1HG2 ILE 611 2HG2 ILE 611 -0.559 -18.352 -17.987 790 2HG2 ILE 611 3HG2 ILE 611 -2.276 -18.422 -17.522 791 3HG2 ILE 611 1HG2 ILE 611 -1.808 -18.614 -19.228 792 1HD1 ILE 611 3HD1 ILE 611 -3.667 -17.914 -19.548 793 2HD1 ILE 611 1HD1 ILE 611 -4.268 -17.860 -17.873 794 3HD1 ILE 611 2HD1 ILE 611 -5.053 -16.878 -19.133 795 H GLU 612 H GLU 612 0.212 -17.337 -15.643 796 HA GLU 612 HA GLU 612 -1.950 -17.527 -13.933 797 1HB GLU 612 1HB GLU 612 -0.102 -19.131 -13.895 798 2HB GLU 612 2HB GLU 612 1.035 -17.882 -13.427 799 1HG GLU 612 1HG GLU 612 -0.204 -17.543 -11.285 800 2HG GLU 612 2HG GLU 612 -1.365 -18.769 -11.755 801 HE2 GLU 612 HE GLU 612 -0.291 -21.214 -11.317 802 H ALA 613 H ALA 613 0.899 -15.306 -13.961 803 HA ALA 613 HA ALA 613 -0.084 -13.953 -11.600 804 1HB ALA 613 2HB ALA 613 2.346 -14.412 -12.010 805 2HB ALA 613 1HB ALA 613 1.985 -12.684 -11.780 806 3HB ALA 613 3HB ALA 613 2.277 -13.322 -13.416 807 H ALA 614 H ALA 614 -0.412 -13.825 -15.067 808 HA ALA 614 HA ALA 614 -0.680 -11.169 -15.605 809 1HB ALA 614 3HB ALA 614 -2.238 -13.581 -16.604 810 2HB ALA 614 1HB ALA 614 -2.354 -11.964 -17.339 811 3HB ALA 614 2HB ALA 614 -0.800 -12.832 -17.338 812 H ALA 615 H ALA 615 -3.219 -13.424 -14.318 813 HA ALA 615 HA ALA 615 -5.231 -11.517 -14.135 814 1HB ALA 615 2HB ALA 615 -6.403 -13.178 -12.989 815 2HB ALA 615 3HB ALA 615 -5.199 -14.137 -13.883 816 3HB ALA 615 1HB ALA 615 -4.947 -13.778 -12.158 817 H SER 616 H SER 616 -2.770 -12.615 -11.708 818 HA SER 616 HA SER 616 -3.643 -11.090 -9.627 819 1HB SER 616 1HB SER 616 -1.410 -12.715 -10.220 820 2HB SER 616 2HB SER 616 -0.715 -11.171 -9.767 821 HG SER 616 HG SER 616 -2.470 -12.862 -8.222 822 H ALA 617 H ALA 617 -1.846 -10.180 -12.555 823 HA ALA 617 HA ALA 617 -0.946 -7.672 -11.567 824 1HB ALA 617 1HB ALA 617 -0.777 -9.288 -13.987 825 2HB ALA 617 3HB ALA 617 0.330 -8.031 -13.385 826 3HB ALA 617 2HB ALA 617 -1.079 -7.577 -14.374 827 H ILE 618 H ILE 618 -3.804 -8.867 -13.403 828 HA ILE 618 HA ILE 618 -4.847 -6.372 -14.057 829 HB ILE 618 HB ILE 618 -6.210 -9.020 -13.560 830 1HG1 ILE 618 1HG1 ILE 618 -4.559 -9.234 -15.285 831 2HG1 ILE 618 2HG1 ILE 618 -6.143 -9.199 -16.035 832 1HG2 ILE 618 2HG2 ILE 618 -7.661 -6.899 -13.471 833 2HG2 ILE 618 3HG2 ILE 618 -7.327 -6.763 -15.214 834 3HG2 ILE 618 1HG2 ILE 618 -8.148 -8.207 -14.576 835 1HD1 ILE 618 1HD1 ILE 618 -5.801 -6.677 -16.388 836 2HD1 ILE 618 2HD1 ILE 618 -4.110 -6.935 -15.896 837 3HD1 ILE 618 3HD1 ILE 618 -4.748 -7.745 -17.347 838 H GLN 619 H GLN 619 -5.310 -8.473 -11.151 839 HA GLN 619 HA GLN 619 -7.232 -6.982 -9.930 840 1HB GLN 619 1HB GLN 619 -5.333 -9.057 -9.192 841 2HB GLN 619 2HB GLN 619 -5.483 -7.908 -7.878 842 1HG GLN 619 1HG GLN 619 -7.902 -9.124 -9.284 843 2HG GLN 619 2HG GLN 619 -7.163 -9.856 -7.874 844 1HE2 GLN 619 1HE2 GLN 619 -9.611 -7.978 -8.851 845 2HE2 GLN 619 2HE2 GLN 619 -9.907 -7.009 -7.447 846 H GLY 620 H GLY 620 -3.684 -6.839 -9.107 847 1HA GLY 620 2HA GLY 620 -2.377 -5.114 -8.495 848 2HA GLY 620 1HA GLY 620 -3.744 -4.590 -7.532 849 H ASN 621 H ASN 621 -3.843 -4.870 -11.103 850 HA ASN 621 HA ASN 621 -3.246 -2.143 -11.510 851 1HB ASN 621 1HB ASN 621 -4.244 -4.444 -13.209 852 2HB ASN 621 2HB ASN 621 -4.401 -2.821 -13.851 853 1HD2 ASN 621 1HD2 ASN 621 -2.229 -1.514 -12.988 854 2HD2 ASN 621 2HD2 ASN 621 -0.765 -2.207 -13.600 855 H VAL 622 H VAL 622 -6.137 -4.158 -10.971 856 HA VAL 622 HA VAL 622 -8.039 -2.318 -11.949 857 HB VAL 622 HB VAL 622 -8.134 -4.678 -10.077 858 1HG1 VAL 622 2HG1 VAL 622 -10.334 -2.776 -10.869 859 2HG1 VAL 622 3HG1 VAL 622 -10.689 -4.490 -10.545 860 3HG1 VAL 622 1HG1 VAL 622 -9.963 -3.476 -9.275 861 1HG2 VAL 622 3HG2 VAL 622 -7.873 -4.573 -12.800 862 2HG2 VAL 622 1HG2 VAL 622 -8.582 -5.932 -11.896 863 3HG2 VAL 622 2HG2 VAL 622 -9.639 -4.694 -12.616 864 H THR 623 H THR 623 -6.924 -3.142 -8.588 865 HA THR 623 HA THR 623 -8.423 -1.145 -7.331 866 HB THR 623 HB THR 623 -6.956 -1.681 -5.421 867 HG1 THR 623 1HG THR 623 -5.024 -3.028 -6.037 868 1HG2 THR 623 1HG2 THR 623 -8.397 -3.628 -6.771 869 2HG2 THR 623 2HG2 THR 623 -6.760 -4.327 -6.781 870 3HG2 THR 623 3HG2 THR 623 -7.539 -3.907 -5.237 871 H SER 624 H SER 624 -5.180 -1.080 -8.856 872 HA SER 624 HA SER 624 -4.279 1.264 -7.857 873 1HB SER 624 1HB SER 624 -3.990 0.003 -10.605 874 2HB SER 624 2HB SER 624 -3.165 1.497 -10.207 875 HG SER 624 HG SER 624 -2.014 -0.656 -9.824 876 H ILE 625 H ILE 625 -6.405 0.747 -10.756 877 HA ILE 625 HA ILE 625 -6.663 3.516 -11.285 878 HB ILE 625 HB ILE 625 -7.804 0.974 -12.292 879 1HG1 ILE 625 1HG1 ILE 625 -7.302 2.893 -14.319 880 2HG1 ILE 625 2HG1 ILE 625 -6.000 3.047 -13.157 881 1HG2 ILE 625 3HG2 ILE 625 -9.228 3.626 -12.501 882 2HG2 ILE 625 1HG2 ILE 625 -9.404 2.354 -13.734 883 3HG2 ILE 625 2HG2 ILE 625 -9.882 2.033 -12.050 884 1HD1 ILE 625 1HD1 ILE 625 -6.922 0.400 -14.367 885 2HD1 ILE 625 2HD1 ILE 625 -5.515 1.337 -14.922 886 3HD1 ILE 625 3HD1 ILE 625 -5.528 0.634 -13.287 887 H HIS 626 H HIS 626 -8.260 1.203 -9.138 888 HA HIS 626 HA HIS 626 -10.658 2.536 -8.783 889 1HB HIS 626 1HB HIS 626 -9.990 0.217 -8.010 890 2HB HIS 626 2HB HIS 626 -9.148 0.977 -6.674 891 HD1 HIS 626 1HD HIS 626 -10.917 -0.453 -5.194 892 HD2 HIS 626 2HD HIS 626 -12.492 2.738 -7.416 893 HE1 HIS 626 1HE HIS 626 -13.220 0.036 -4.210 894 H SER 627 H SER 627 -7.492 2.871 -7.057 895 HA SER 627 HA SER 627 -8.550 5.001 -5.485 896 1HB SER 627 1HB SER 627 -6.156 3.317 -5.520 897 2HB SER 627 2HB SER 627 -5.727 4.998 -5.273 898 HG SER 627 HG SER 627 -7.697 4.818 -3.642 899 H LEU 628 H LEU 628 -6.116 4.595 -8.147 900 HA LEU 628 HA LEU 628 -5.161 7.085 -8.412 901 1HB LEU 628 1HB LEU 628 -5.783 4.878 -10.279 902 2HB LEU 628 2HB LEU 628 -5.521 6.447 -11.015 903 HG LEU 628 HG LEU 628 -3.516 5.501 -9.010 904 1HD1 LEU 628 3HD1 LEU 628 -3.999 4.230 -11.683 905 2HD1 LEU 628 1HD1 LEU 628 -2.335 4.412 -11.077 906 3HD1 LEU 628 2HD1 LEU 628 -3.530 3.491 -10.133 907 1HD2 LEU 628 1HD2 LEU 628 -3.449 7.153 -11.540 908 2HD2 LEU 628 2HD2 LEU 628 -3.135 7.671 -9.866 909 3HD2 LEU 628 3HD2 LEU 628 -1.980 6.603 -10.699 910 H LEU 629 H LEU 629 -8.400 5.923 -9.490 911 HA LEU 629 HA LEU 629 -9.133 8.329 -10.730 912 1HB LEU 629 1HB LEU 629 -10.295 5.766 -10.100 913 2HB LEU 629 2HB LEU 629 -11.444 7.047 -9.767 914 HG LEU 629 HG LEU 629 -11.635 6.085 -12.046 915 1HD1 LEU 629 2HD1 LEU 629 -11.196 8.976 -11.499 916 2HD1 LEU 629 3HD1 LEU 629 -11.320 8.475 -13.203 917 3HD1 LEU 629 1HD1 LEU 629 -12.646 8.115 -12.071 918 1HD2 LEU 629 3HD2 LEU 629 -9.065 5.823 -12.229 919 2HD2 LEU 629 1HD2 LEU 629 -9.998 6.250 -13.684 920 3HD2 LEU 629 2HD2 LEU 629 -9.095 7.507 -12.805 921 H ASP 630 H ASP 630 -9.431 7.092 -7.364 922 HA ASP 630 HA ASP 630 -11.010 9.222 -6.496 923 1HB ASP 630 1HB ASP 630 -9.594 6.920 -5.349 924 2HB ASP 630 2HB ASP 630 -9.471 8.314 -4.294 925 HD2 ASP 630 HD ASP 630 -11.052 8.536 -2.976 926 H GLU 631 H GLU 631 -7.458 8.470 -6.387 927 HA GLU 631 HA GLU 631 -6.729 10.738 -4.971 928 1HB GLU 631 1HB GLU 631 -4.814 9.545 -4.995 929 2HB GLU 631 2HB GLU 631 -5.438 8.508 -6.262 930 1HG GLU 631 1HG GLU 631 -4.624 9.991 -8.005 931 2HG GLU 631 2HG GLU 631 -4.263 11.259 -6.850 932 HE2 GLU 631 HE GLU 631 -2.059 8.717 -8.250 933 H GLY 632 H GLY 632 -7.325 10.135 -8.440 934 1HA GLY 632 2HA GLY 632 -7.147 11.482 -10.255 935 2HA GLY 632 1HA GLY 632 -6.178 12.611 -9.328 936 H LYS 633 H LYS 633 -9.463 11.373 -8.484 937 HA LYS 633 HA LYS 633 -10.942 13.467 -9.503 938 1HB LYS 633 1HB LYS 633 -11.659 11.199 -8.481 939 2HB LYS 633 2HB LYS 633 -11.641 12.035 -6.941 940 1HG LYS 633 1HG LYS 633 -13.898 12.171 -7.842 941 2HG LYS 633 2HG LYS 633 -13.196 13.776 -7.900 942 1HD LYS 633 1HD LYS 633 -12.434 12.707 -10.363 943 2HD LYS 633 2HD LYS 633 -14.020 11.999 -10.125 944 1HE LYS 633 1HE LYS 633 -14.536 14.590 -9.368 945 2HE LYS 633 2HE LYS 633 -13.262 14.864 -10.539 946 H GLN 634 H GLN 634 -8.930 13.238 -6.578 947 HA GLN 634 HA GLN 634 -10.006 15.499 -5.336 948 1HB GLN 634 1HB GLN 634 -7.400 13.971 -5.056 949 2HB GLN 634 2HB GLN 634 -7.685 15.428 -4.124 950 1HG GLN 634 1HG GLN 634 -9.919 13.437 -4.110 951 2HG GLN 634 2HG GLN 634 -8.447 12.920 -3.312 952 1HE2 GLN 634 1HE2 GLN 634 -8.107 13.519 -1.306 953 2HE2 GLN 634 2HE2 GLN 634 -8.918 14.784 -0.443 954 H SER 635 H SER 635 -7.732 15.014 -7.978 955 HA SER 635 HA SER 635 -6.656 17.657 -7.709 956 1HB SER 635 1HB SER 635 -5.873 15.220 -8.989 957 2HB SER 635 2HB SER 635 -6.054 16.413 -10.259 958 HG SER 635 HG SER 635 -3.890 16.311 -9.211 959 H LEU 636 H LEU 636 -9.331 16.025 -9.249 960 HA LEU 636 HA LEU 636 -9.642 17.676 -11.493 961 1HB LEU 636 1HB LEU 636 -11.063 15.553 -10.136 962 2HB LEU 636 2HB LEU 636 -12.174 16.794 -10.681 963 HG LEU 636 HG LEU 636 -11.794 14.889 -12.276 964 1HD1 LEU 636 3HD1 LEU 636 -11.801 17.747 -12.832 965 2HD1 LEU 636 1HD1 LEU 636 -11.068 16.804 -14.152 966 3HD1 LEU 636 2HD1 LEU 636 -12.716 16.425 -13.596 967 1HD2 LEU 636 1HD2 LEU 636 -9.352 14.670 -11.848 968 2HD2 LEU 636 2HD2 LEU 636 -9.776 14.763 -13.574 969 3HD2 LEU 636 3HD2 LEU 636 -9.097 16.186 -12.746 970 H THR 637 H THR 637 -11.111 17.793 -8.177 971 HA THR 637 HA THR 637 -12.455 20.244 -8.711 972 HB THR 637 HB THR 637 -13.416 18.827 -7.046 973 HG1 THR 637 1HG THR 637 -13.183 20.242 -5.201 974 1HG2 THR 637 2HG2 THR 637 -10.549 18.555 -6.078 975 2HG2 THR 637 3HG2 THR 637 -11.893 18.330 -4.933 976 3HG2 THR 637 1HG2 THR 637 -11.754 17.276 -6.361 977 H LYS 638 H LYS 638 -9.228 19.353 -7.534 978 HA LYS 638 HA LYS 638 -8.695 21.994 -6.563 979 1HB LYS 638 1HB LYS 638 -7.015 19.512 -6.960 980 2HB LYS 638 2HB LYS 638 -6.326 21.033 -6.431 981 1HG LYS 638 1HG LYS 638 -8.153 21.043 -4.585 982 2HG LYS 638 2HG LYS 638 -8.456 19.373 -5.022 983 1HD LYS 638 1HD LYS 638 -5.766 20.505 -4.114 984 2HD LYS 638 2HD LYS 638 -6.849 19.545 -3.126 985 1HE LYS 638 1HE LYS 638 -6.273 18.220 -5.692 986 2HE LYS 638 2HE LYS 638 -4.802 18.568 -4.804 987 H LEU 639 H LEU 639 -8.567 20.277 -9.626 988 HA LEU 639 HA LEU 639 -6.911 22.408 -10.755 989 1HB LEU 639 1HB LEU 639 -7.711 19.694 -11.811 990 2HB LEU 639 2HB LEU 639 -6.813 20.884 -12.731 991 HG LEU 639 HG LEU 639 -5.730 20.054 -10.068 992 1HD1 LEU 639 3HD1 LEU 639 -6.510 18.012 -11.530 993 2HD1 LEU 639 1HD1 LEU 639 -5.033 18.383 -12.452 994 3HD1 LEU 639 2HD1 LEU 639 -4.928 18.004 -10.716 995 1HD2 LEU 639 1HD2 LEU 639 -4.843 21.787 -11.939 996 2HD2 LEU 639 2HD2 LEU 639 -3.781 20.903 -10.817 997 3HD2 LEU 639 3HD2 LEU 639 -4.023 20.300 -12.474 998 H ALA 640 H ALA 640 -10.147 21.591 -10.173 999 HA ALA 640 HA ALA 640 -11.491 22.084 -12.484 1000 1HB ALA 640 2HB ALA 640 -13.330 22.806 -11.039 1001 2HB ALA 640 3HB ALA 640 -12.470 21.443 -10.284 1002 3HB ALA 640 1HB ALA 640 -12.193 23.101 -9.701 1003 H ALA 641 H ALA 641 -9.819 24.402 -10.320 1004 HA ALA 641 HA ALA 641 -10.870 26.735 -11.437 1005 1HB ALA 641 2HB ALA 641 -9.304 27.809 -10.101 1006 2HB ALA 641 3HB ALA 641 -9.397 26.226 -9.292 1007 3HB ALA 641 1HB ALA 641 -8.049 26.583 -10.398 1008 H ALA 642 H ALA 642 -8.355 24.459 -12.494 1009 HA ALA 642 HA ALA 642 -6.975 26.090 -14.254 1010 1HB ALA 642 1HB ALA 642 -6.675 23.586 -13.422 1011 2HB ALA 642 3HB ALA 642 -6.018 24.111 -14.991 1012 3HB ALA 642 2HB ALA 642 -7.556 23.216 -14.924 1013 H TRP 643 H TRP 643 -10.235 24.772 -14.379 1014 HA TRP 643 HA TRP 643 -10.434 25.246 -17.237 1015 1HB TRP 643 1HB TRP 643 -12.242 24.040 -15.159 1016 2HB TRP 643 2HB TRP 643 -12.857 24.510 -16.731 1017 HD1 TRP 643 HD TRP 643 -12.293 22.881 -18.774 1018 HE1 TRP 643 1HE TRP 643 -11.133 20.531 -19.080 1019 HE3 TRP 643 3HE TRP 643 -10.275 22.685 -14.111 1020 HZ2 TRP 643 2HZ TRP 643 -9.536 18.891 -17.375 1021 HZ3 TRP 643 3HZ TRP 643 -8.929 20.674 -13.512 1022 HH2 TRP 643 HH TRP 643 -8.547 18.819 -15.057 1023 H GLY 644 H GLY 644 -10.843 26.842 -14.168 1024 1HA GLY 644 2HA GLY 644 -12.712 28.813 -15.285 1025 2HA GLY 644 1HA GLY 644 -11.115 29.346 -14.799 1026 H GLY 645 H GLY 645 -12.675 26.645 -13.101 1027 1HA GLY 645 2HA GLY 645 -13.940 28.206 -11.081 1028 2HA GLY 645 1HA GLY 645 -12.350 27.680 -10.566 1029 H SER 646 H SER 646 -14.366 26.697 -9.073 1030 HA SER 646 HA SER 646 -14.616 23.969 -10.074 1031 1HB SER 646 1HB SER 646 -14.832 23.389 -7.581 1032 2HB SER 646 2HB SER 646 -13.247 23.898 -8.128 1033 HG SER 646 HG SER 646 -13.536 25.141 -6.336 1034 H GLY 647 H GLY 647 -16.611 24.770 -11.218 1035 1HA GLY 647 2HA GLY 647 -18.819 25.715 -9.637 1036 2HA GLY 647 1HA GLY 647 -18.953 24.018 -10.055 1037 H SER 648 H SER 648 -17.205 26.298 -12.161 1038 HA SER 648 HA SER 648 -19.317 27.106 -13.723 1039 1HB SER 648 1HB SER 648 -16.375 27.069 -13.892 1040 2HB SER 648 2HB SER 648 -17.129 26.942 -15.469 1041 HG SER 648 HG SER 648 -16.736 29.171 -14.155 1042 H GLU 649 H GLU 649 -20.203 26.315 -15.723 1043 HA GLU 649 HA GLU 649 -20.635 23.652 -15.871 1044 1HB GLU 649 1HB GLU 649 -21.394 24.092 -18.224 1045 2HB GLU 649 2HB GLU 649 -22.025 25.246 -17.066 1046 1HG GLU 649 1HG GLU 649 -19.898 26.680 -17.703 1047 2HG GLU 649 2HG GLU 649 -19.823 25.644 -19.115 1048 HE2 GLU 649 HE GLU 649 -20.859 26.431 -20.712 1049 H ALA 650 H ALA 650 -17.954 25.566 -17.267 1050 HA ALA 650 HA ALA 650 -16.953 23.787 -19.092 1051 1HB ALA 650 3HB ALA 650 -16.049 26.102 -17.565 1052 2HB ALA 650 2HB ALA 650 -15.611 25.591 -19.213 1053 3HB ALA 650 1HB ALA 650 -14.728 24.935 -17.813 1054 H TYR 651 H TYR 651 -15.530 24.164 -15.773 1055 HA TYR 651 HA TYR 651 -14.155 21.792 -15.779 1056 1HB TYR 651 1HB TYR 651 -13.748 23.387 -14.026 1057 2HB TYR 651 2HB TYR 651 -15.458 23.662 -13.761 1058 HD1 TYR 651 1HD TYR 651 -16.289 22.926 -11.732 1059 HD2 TYR 651 2HD TYR 651 -13.068 20.765 -13.538 1060 HE1 TYR 651 1HE TYR 651 -16.230 21.339 -9.746 1061 HE2 TYR 651 2HE TYR 651 -13.020 19.186 -11.546 1062 HH TYR 651 HH TYR 651 -15.442 19.439 -8.987 1063 H GLN 652 H GLN 652 -17.607 22.412 -15.095 1064 HA GLN 652 HA GLN 652 -18.159 20.058 -13.785 1065 1HB GLN 652 1HB GLN 652 -19.841 21.870 -15.553 1066 2HB GLN 652 2HB GLN 652 -20.529 20.459 -14.775 1067 1HG GLN 652 1HG GLN 652 -19.107 21.708 -12.699 1068 2HG GLN 652 2HG GLN 652 -19.766 23.057 -13.602 1069 1HE2 GLN 652 1HE2 GLN 652 -20.389 20.429 -11.502 1070 2HE2 GLN 652 2HE2 GLN 652 -22.096 20.634 -11.296 1071 H GLY 653 H GLY 653 -18.424 20.850 -17.324 1072 1HA GLY 653 2HA GLY 653 -18.355 19.536 -19.145 1073 2HA GLY 653 1HA GLY 653 -19.292 18.378 -18.222 1074 H VAL 654 H VAL 654 -16.110 19.404 -17.035 1075 HA VAL 654 HA VAL 654 -14.735 17.216 -18.284 1076 HB VAL 654 HB VAL 654 -14.008 19.368 -16.306 1077 1HG1 VAL 654 2HG1 VAL 654 -12.791 17.290 -15.708 1078 2HG1 VAL 654 3HG1 VAL 654 -12.152 17.212 -17.367 1079 3HG1 VAL 654 1HG1 VAL 654 -11.712 18.572 -16.308 1080 1HG2 VAL 654 2HG2 VAL 654 -14.148 19.318 -19.091 1081 2HG2 VAL 654 3HG2 VAL 654 -13.302 20.522 -18.089 1082 3HG2 VAL 654 1HG2 VAL 654 -12.415 19.121 -18.737 1083 H GLN 655 H GLN 655 -16.010 18.075 -15.020 1084 HA GLN 655 HA GLN 655 -14.955 15.973 -13.643 1085 1HB GLN 655 1HB GLN 655 -17.186 17.869 -13.313 1086 2HB GLN 655 2HB GLN 655 -17.496 16.338 -12.519 1087 1HG GLN 655 1HG GLN 655 -14.739 17.128 -12.028 1088 2HG GLN 655 2HG GLN 655 -15.800 18.463 -11.624 1089 1HE2 GLN 655 1HE2 GLN 655 -14.460 17.405 -9.622 1090 2HE2 GLN 655 2HE2 GLN 655 -15.446 16.434 -8.581 1091 H GLN 656 H GLN 656 -18.090 16.152 -15.459 1092 HA GLN 656 HA GLN 656 -18.861 13.559 -14.831 1093 1HB GLN 656 1HB GLN 656 -19.709 15.702 -16.697 1094 2HB GLN 656 2HB GLN 656 -20.080 14.087 -17.267 1095 1HG GLN 656 1HG GLN 656 -21.904 14.151 -15.914 1096 2HG GLN 656 2HG GLN 656 -20.802 13.969 -14.564 1097 1HE2 GLN 656 1HE2 GLN 656 -21.362 16.654 -16.829 1098 2HE2 GLN 656 2HE2 GLN 656 -21.775 17.856 -15.652 1099 H LYS 657 H LYS 657 -16.837 14.946 -17.442 1100 HA LYS 657 HA LYS 657 -16.765 12.601 -19.009 1101 1HB LYS 657 1HB LYS 657 -15.026 15.072 -18.868 1102 2HB LYS 657 2HB LYS 657 -14.718 13.769 -19.997 1103 1HG LYS 657 1HG LYS 657 -16.840 14.072 -21.097 1104 2HG LYS 657 2HG LYS 657 -17.464 15.067 -19.797 1105 1HD LYS 657 1HD LYS 657 -16.794 16.873 -21.002 1106 2HD LYS 657 2HD LYS 657 -15.150 16.441 -20.579 1107 1HE LYS 657 1HE LYS 657 -14.959 15.040 -22.620 1108 2HE LYS 657 2HE LYS 657 -16.632 15.367 -23.028 1109 H TRP 658 H TRP 658 -15.049 13.726 -16.119 1110 HA TRP 658 HA TRP 658 -12.913 11.858 -16.364 1111 1HB TRP 658 1HB TRP 658 -12.545 13.873 -15.151 1112 2HB TRP 658 2HB TRP 658 -13.925 13.587 -14.109 1113 HD1 TRP 658 HD TRP 658 -13.549 11.891 -12.034 1114 HE1 TRP 658 1HE TRP 658 -11.454 10.804 -10.855 1115 HE3 TRP 658 3HE TRP 658 -10.247 12.956 -15.751 1116 HZ2 TRP 658 2HZ TRP 658 -8.712 10.518 -11.592 1117 HZ3 TRP 658 3HZ TRP 658 -7.880 12.238 -15.442 1118 HH2 TRP 658 HH TRP 658 -7.095 11.058 -13.450 1119 H ASP 659 H ASP 659 -15.883 12.116 -14.273 1120 HA ASP 659 HA ASP 659 -15.552 9.611 -13.143 1121 1HB ASP 659 1HB ASP 659 -17.376 11.773 -12.973 1122 2HB ASP 659 2HB ASP 659 -18.364 10.405 -13.442 1123 HD2 ASP 659 HD ASP 659 -16.831 11.295 -10.098 1124 H ALA 660 H ALA 660 -16.956 10.788 -16.193 1125 HA ALA 660 HA ALA 660 -18.652 8.707 -16.835 1126 1HB ALA 660 3HB ALA 660 -18.799 10.520 -18.265 1127 2HB ALA 660 1HB ALA 660 -17.035 10.742 -18.340 1128 3HB ALA 660 2HB ALA 660 -17.806 9.426 -19.257 1129 H THR 661 H THR 661 -15.625 9.021 -18.725 1130 HA THR 661 HA THR 661 -15.393 6.334 -19.265 1131 HB THR 661 HB THR 661 -13.095 6.967 -19.968 1132 HG1 THR 661 1HG THR 661 -12.301 9.006 -19.145 1133 1HG2 THR 661 1HG2 THR 661 -15.353 8.173 -20.974 1134 2HG2 THR 661 2HG2 THR 661 -14.466 9.598 -20.382 1135 3HG2 THR 661 3HG2 THR 661 -13.715 8.516 -21.579 1136 H ALA 662 H ALA 662 -14.622 8.060 -16.302 1137 HA ALA 662 HA ALA 662 -12.711 6.385 -15.232 1138 1HB ALA 662 1HB ALA 662 -13.088 8.300 -13.990 1139 2HB ALA 662 3HB ALA 662 -14.014 7.124 -13.027 1140 3HB ALA 662 2HB ALA 662 -14.856 8.199 -14.168 1141 H THR 663 H THR 663 -16.041 6.287 -13.878 1142 HA THR 663 HA THR 663 -15.933 3.728 -12.960 1143 HB THR 663 HB THR 663 -17.761 5.076 -12.266 1144 HG1 THR 663 1HG THR 663 -19.593 3.837 -13.196 1145 1HG2 THR 663 3HG2 THR 663 -17.710 5.998 -15.044 1146 2HG2 THR 663 1HG2 THR 663 -19.357 5.500 -14.587 1147 3HG2 THR 663 2HG2 THR 663 -18.508 6.745 -13.639 1148 H GLU 664 H GLU 664 -16.369 4.801 -16.306 1149 HA GLU 664 HA GLU 664 -17.463 2.458 -17.282 1150 1HB GLU 664 1HB GLU 664 -17.444 4.505 -18.601 1151 2HB GLU 664 2HB GLU 664 -15.693 4.560 -18.597 1152 1HG GLU 664 1HG GLU 664 -16.284 3.658 -20.734 1153 2HG GLU 664 2HG GLU 664 -15.728 2.285 -19.797 1154 HE2 GLU 664 HE GLU 664 -18.182 1.149 -21.525 1155 H LEU 665 H LEU 665 -14.014 3.535 -16.978 1156 HA LEU 665 HA LEU 665 -13.058 1.027 -17.984 1157 1HB LEU 665 1HB LEU 665 -12.001 3.323 -18.266 1158 2HB LEU 665 2HB LEU 665 -11.483 3.191 -16.598 1159 HG LEU 665 HG LEU 665 -9.708 2.588 -18.179 1160 1HD1 LEU 665 3HD1 LEU 665 -10.126 1.463 -15.847 1161 2HD1 LEU 665 1HD1 LEU 665 -10.420 0.008 -16.830 1162 3HD1 LEU 665 2HD1 LEU 665 -8.856 0.853 -16.935 1163 1HD2 LEU 665 3HD2 LEU 665 -11.129 1.710 -19.984 1164 2HD2 LEU 665 1HD2 LEU 665 -9.827 0.579 -19.543 1165 3HD2 LEU 665 2HD2 LEU 665 -11.492 0.277 -18.993 1166 H ASN 666 H ASN 666 -13.762 2.531 -14.838 1167 HA ASN 666 HA ASN 666 -12.264 0.805 -13.286 1168 1HB ASN 666 1HB ASN 666 -13.793 2.999 -12.774 1169 2HB ASN 666 2HB ASN 666 -14.940 1.771 -12.276 1170 1HD2 ASN 666 1HD2 ASN 666 -13.254 3.823 -10.850 1171 2HD2 ASN 666 2HD2 ASN 666 -12.453 2.967 -9.574 1172 H ASN 667 H ASN 667 -15.775 0.789 -14.262 1173 HA ASN 667 HA ASN 667 -16.446 -1.539 -12.967 1174 1HB ASN 667 1HB ASN 667 -17.556 -0.358 -15.568 1175 2HB ASN 667 2HB ASN 667 -18.352 -1.622 -14.651 1176 1HD2 ASN 667 1HD2 ASN 667 -18.912 1.291 -15.340 1177 2HD2 ASN 667 2HD2 ASN 667 -19.380 2.028 -13.844 1178 H ALA 668 H ALA 668 -15.432 -0.903 -16.406 1179 HA ALA 668 HA ALA 668 -15.609 -3.453 -17.393 1180 1HB ALA 668 1HB ALA 668 -14.965 -1.113 -18.446 1181 2HB ALA 668 2HB ALA 668 -13.302 -1.673 -18.149 1182 3HB ALA 668 3HB ALA 668 -14.389 -2.624 -19.189 1183 H LEU 669 H LEU 669 -12.879 -1.879 -15.611 1184 HA LEU 669 HA LEU 669 -11.108 -4.006 -15.809 1185 1HB LEU 669 1HB LEU 669 -11.372 -1.522 -14.327 1186 2HB LEU 669 2HB LEU 669 -10.623 -2.775 -13.357 1187 HG LEU 669 HG LEU 669 -9.622 -2.255 -16.143 1188 1HD1 LEU 669 1HD1 LEU 669 -9.838 -0.097 -14.691 1189 2HD1 LEU 669 2HD1 LEU 669 -8.439 -0.769 -13.820 1190 3HD1 LEU 669 3HD1 LEU 669 -8.325 -0.436 -15.565 1191 1HD2 LEU 669 2HD2 LEU 669 -8.950 -4.174 -14.418 1192 2HD2 LEU 669 3HD2 LEU 669 -7.776 -3.427 -15.527 1193 3HD2 LEU 669 1HD2 LEU 669 -7.859 -2.896 -13.831 1194 H GLN 670 H GLN 670 -13.686 -3.276 -13.389 1195 HA GLN 670 HA GLN 670 -13.091 -5.315 -11.658 1196 1HB GLN 670 1HB GLN 670 -15.494 -3.660 -12.297 1197 2HB GLN 670 2HB GLN 670 -15.812 -5.146 -11.424 1198 1HG GLN 670 1HG GLN 670 -13.515 -3.983 -10.185 1199 2HG GLN 670 2HG GLN 670 -14.641 -2.666 -10.443 1200 1HE2 GLN 670 1HE2 GLN 670 -13.719 -5.052 -8.382 1201 2HE2 GLN 670 2HE2 GLN 670 -15.153 -5.252 -7.431 1202 H ASN 671 H ASN 671 -15.439 -5.293 -14.434 1203 HA ASN 671 HA ASN 671 -16.094 -7.985 -14.118 1204 1HB ASN 671 1HB ASN 671 -17.003 -5.842 -15.670 1205 2HB ASN 671 2HB ASN 671 -16.286 -6.887 -16.879 1206 1HD2 ASN 671 1HD2 ASN 671 -17.750 -8.075 -17.816 1207 2HD2 ASN 671 2HD2 ASN 671 -19.077 -8.900 -17.068 1208 H LEU 672 H LEU 672 -13.434 -6.223 -15.621 1209 HA LEU 672 HA LEU 672 -12.687 -8.301 -17.433 1210 1HB LEU 672 1HB LEU 672 -12.197 -6.043 -18.000 1211 2HB LEU 672 2HB LEU 672 -11.366 -5.764 -16.483 1212 HG LEU 672 HG LEU 672 -9.927 -6.038 -18.557 1213 1HD1 LEU 672 3HD1 LEU 672 -9.186 -6.252 -16.134 1214 2HD1 LEU 672 1HD1 LEU 672 -9.246 -8.014 -16.377 1215 3HD1 LEU 672 2HD1 LEU 672 -8.148 -7.017 -17.361 1216 1HD2 LEU 672 1HD2 LEU 672 -11.236 -7.972 -19.467 1217 2HD2 LEU 672 2HD2 LEU 672 -9.473 -8.217 -19.421 1218 3HD2 LEU 672 3HD2 LEU 672 -10.512 -8.986 -18.196 1219 H ALA 673 H ALA 673 -11.717 -7.194 -14.146 1220 HA ALA 673 HA ALA 673 -9.709 -9.259 -13.988 1221 1HB ALA 673 1HB ALA 673 -10.133 -6.756 -12.813 1222 2HB ALA 673 2HB ALA 673 -10.440 -7.912 -11.495 1223 3HB ALA 673 3HB ALA 673 -8.884 -7.939 -12.358 1224 H ARG 674 H ARG 674 -13.120 -8.837 -13.360 1225 HA ARG 674 HA ARG 674 -13.345 -10.657 -11.272 1226 1HB ARG 674 1HB ARG 674 -15.234 -9.473 -13.319 1227 2HB ARG 674 2HB ARG 674 -15.802 -10.819 -12.351 1228 1HG ARG 674 1HG ARG 674 -14.413 -8.675 -10.808 1229 2HG ARG 674 2HG ARG 674 -15.913 -8.176 -11.565 1230 1HD ARG 674 1HD ARG 674 -17.050 -9.173 -9.872 1231 2HD ARG 674 2HD ARG 674 -16.472 -10.727 -10.440 1232 HE ARG 674 HE ARG 674 -14.324 -9.766 -8.986 1233 2HH1 ARG 674 1HH ARG 674 -15.243 -10.422 -5.701 1234 1HH2 ARG 674 2HH2 ARG 674 -17.758 -10.216 -8.239 1235 2HH2 ARG 674 1HH2 ARG 674 -17.484 -10.484 -6.550 1236 H THR 675 H THR 675 -13.047 -10.973 -14.791 1237 HA THR 675 HA THR 675 -13.634 -13.847 -14.588 1238 HB THR 675 HB THR 675 -13.439 -12.042 -17.054 1239 HG1 THR 675 1HG THR 675 -15.257 -12.300 -14.985 1240 1HG2 THR 675 1HG2 THR 675 -13.353 -14.707 -17.160 1241 2HG2 THR 675 2HG2 THR 675 -15.083 -14.575 -16.762 1242 3HG2 THR 675 3HG2 THR 675 -14.450 -13.818 -18.244 1243 H ILE 676 H ILE 676 -11.075 -11.621 -14.554 1244 HA ILE 676 HA ILE 676 -9.278 -13.513 -15.872 1245 HB ILE 676 HB ILE 676 -9.138 -10.597 -15.193 1246 1HG1 ILE 676 1HG1 ILE 676 -8.833 -12.250 -17.707 1247 2HG1 ILE 676 2HG1 ILE 676 -10.078 -11.075 -17.332 1248 1HG2 ILE 676 2HG2 ILE 676 -6.900 -12.507 -15.214 1249 2HG2 ILE 676 3HG2 ILE 676 -6.682 -11.098 -16.280 1250 3HG2 ILE 676 1HG2 ILE 676 -7.009 -10.861 -14.547 1251 1HD1 ILE 676 3HD1 ILE 676 -7.978 -9.428 -17.062 1252 2HD1 ILE 676 1HD1 ILE 676 -7.214 -10.621 -18.140 1253 3HD1 ILE 676 2HD1 ILE 676 -8.686 -9.767 -18.659 1254 H SER 677 H SER 677 -9.621 -11.576 -12.820 1255 HA SER 677 HA SER 677 -7.522 -12.482 -11.458 1256 1HB SER 677 1HB SER 677 -9.043 -10.859 -10.499 1257 2HB SER 677 2HB SER 677 -10.369 -12.005 -10.493 1258 HG SER 677 HG SER 677 -8.723 -11.523 -8.488 1259 H GLU 678 H GLU 678 -10.403 -14.307 -12.411 1260 HA GLU 678 HA GLU 678 -10.073 -16.384 -10.554 1261 1HB GLU 678 1HB GLU 678 -11.688 -17.601 -11.992 1262 2HB GLU 678 2HB GLU 678 -12.221 -15.963 -11.671 1263 1HG GLU 678 1HG GLU 678 -10.987 -15.366 -13.923 1264 2HG GLU 678 2HG GLU 678 -11.045 -17.090 -14.233 1265 HE2 GLU 678 HE GLU 678 -14.369 -15.293 -13.210 1266 H ALA 679 H ALA 679 -8.795 -15.691 -13.821 1267 HA ALA 679 HA ALA 679 -7.938 -18.080 -14.696 1268 1HB ALA 679 2HB ALA 679 -6.028 -15.747 -14.701 1269 2HB ALA 679 3HB ALA 679 -6.433 -16.880 -16.013 1270 3HB ALA 679 1HB ALA 679 -7.590 -15.611 -15.544 1271 H GLY 680 H GLY 680 -6.863 -16.352 -11.808 1272 1HA GLY 680 2HA GLY 680 -5.677 -17.163 -10.051 1273 2HA GLY 680 1HA GLY 680 -4.395 -17.218 -11.245 1274 H GLN 681 H GLN 681 -7.057 -19.120 -9.742 1275 HA GLN 681 HA GLN 681 -5.596 -21.509 -10.562 1276 1HB GLN 681 1HB GLN 681 -6.455 -20.582 -7.903 1277 2HB GLN 681 2HB GLN 681 -7.027 -22.201 -8.250 1278 1HG GLN 681 1HG GLN 681 -4.943 -23.083 -8.031 1279 2HG GLN 681 2HG GLN 681 -4.251 -21.899 -9.123 1280 1HE2 GLN 681 1HE2 GLN 681 -2.426 -21.917 -7.719 1281 2HE2 GLN 681 2HE2 GLN 681 -2.395 -20.965 -6.272 1282 H ALA 682 H ALA 682 -8.477 -19.698 -10.767 1283 HA ALA 682 HA ALA 682 -10.448 -21.652 -10.686 1284 1HB ALA 682 3HB ALA 682 -10.643 -19.437 -12.687 1285 2HB ALA 682 2HB ALA 682 -10.402 -18.975 -10.985 1286 3HB ALA 682 1HB ALA 682 -11.807 -19.965 -11.449 1287 H MET 683 H MET 683 -8.937 -20.209 -13.668 1288 HA MET 683 HA MET 683 -9.921 -21.792 -15.519 1289 1HB MET 683 1HB MET 683 -7.945 -19.979 -15.498 1290 2HB MET 683 2HB MET 683 -6.904 -21.389 -15.475 1291 1HG MET 683 1HG MET 683 -7.269 -20.688 -17.803 1292 2HG MET 683 2HG MET 683 -8.023 -22.249 -17.547 1293 1HE MET 683 1HE MET 683 -9.570 -22.034 -19.608 1294 2HE MET 683 2HE MET 683 -10.340 -22.760 -18.176 1295 3HE MET 683 3HE MET 683 -11.242 -21.597 -19.178 1296 H ALA 684 H ALA 684 -7.628 -22.794 -13.005 1297 HA ALA 684 HA ALA 684 -7.156 -25.339 -14.320 1298 1HB ALA 684 3HB ALA 684 -5.636 -25.706 -12.396 1299 2HB ALA 684 1HB ALA 684 -5.290 -24.170 -13.226 1300 3HB ALA 684 2HB ALA 684 -6.178 -24.168 -11.684 1301 H SER 685 H SER 685 -8.678 -23.986 -11.323 1302 HA SER 685 HA SER 685 -9.695 -26.578 -10.676 1303 1HB SER 685 1HB SER 685 -9.887 -23.828 -9.407 1304 2HB SER 685 2HB SER 685 -10.884 -25.148 -8.829 1305 HG SER 685 HG SER 685 -8.656 -24.752 -7.811 1306 H THR 686 H THR 686 -11.757 -23.753 -10.146 1307 HA THR 686 HA THR 686 -13.575 -24.729 -12.250 1308 HB THR 686 HB THR 686 -14.050 -25.174 -9.652 1309 HG1 THR 686 1HG THR 686 -16.235 -25.157 -10.395 1310 1HG2 THR 686 2HG2 THR 686 -13.825 -22.682 -9.077 1311 2HG2 THR 686 3HG2 THR 686 -15.254 -22.397 -10.099 1312 3HG2 THR 686 1HG2 THR 686 -15.391 -23.405 -8.639 1313 H GLU 687 H GLU 687 -14.209 -23.282 -13.730 1314 HA GLU 687 HA GLU 687 -13.828 -20.485 -12.999 1315 1HB GLU 687 1HB GLU 687 -13.034 -20.009 -15.269 1316 2HB GLU 687 2HB GLU 687 -12.024 -21.240 -14.537 1317 1HG GLU 687 1HG GLU 687 -12.420 -22.475 -16.408 1318 2HG GLU 687 2HG GLU 687 -14.013 -22.772 -15.742 1319 HE2 GLU 687 HE GLU 687 -15.773 -21.719 -17.038 1320 H GLY 688 H GLY 688 -15.054 -19.044 -14.800 1321 1HA GLY 688 2HA GLY 688 -17.657 -20.340 -15.345 1322 2HA GLY 688 1HA GLY 688 -16.942 -19.064 -16.310 1323 H ASN 689 H ASN 689 -16.967 -19.267 -12.709 1324 HA ASN 689 HA ASN 689 -18.894 -17.096 -12.708 1325 1HB ASN 689 1HB ASN 689 -19.273 -19.216 -11.302 1326 2HB ASN 689 2HB ASN 689 -17.883 -18.753 -10.340 1327 1HD2 ASN 689 1HD2 ASN 689 -20.886 -18.972 -9.903 1328 2HD2 ASN 689 2HD2 ASN 689 -21.340 -17.496 -9.118 1329 H VAL 690 H VAL 690 -16.136 -18.179 -10.576 1330 HA VAL 690 HA VAL 690 -14.420 -16.092 -11.103 1331 HB VAL 690 HB VAL 690 -16.584 -14.975 -10.005 1332 1HG1 VAL 690 3HG1 VAL 690 -15.847 -16.527 -7.900 1333 2HG1 VAL 690 1HG1 VAL 690 -14.965 -15.027 -7.523 1334 3HG1 VAL 690 2HG1 VAL 690 -16.730 -14.989 -7.746 1335 1HG2 VAL 690 1HG2 VAL 690 -13.932 -14.228 -10.526 1336 2HG2 VAL 690 2HG2 VAL 690 -15.309 -13.150 -10.193 1337 3HG2 VAL 690 3HG2 VAL 690 -14.249 -13.677 -8.863 1338 H THR 691 H THR 691 -13.251 -15.668 -8.569 1339 HA THR 691 HA THR 691 -12.114 -18.265 -8.144 1340 HB THR 691 HB THR 691 -11.687 -15.454 -7.031 1341 HG1 THR 691 1HG THR 691 -10.020 -17.386 -8.469 1342 1HG2 THR 691 2HG2 THR 691 -10.951 -17.906 -5.733 1343 2HG2 THR 691 3HG2 THR 691 -9.488 -17.293 -6.542 1344 3HG2 THR 691 1HG2 THR 691 -10.351 -16.270 -5.368 1345 H GLY 692 H GLY 692 -14.062 -15.961 -6.139 1346 1HA GLY 692 2HA GLY 692 -15.634 -16.485 -4.576 1347 2HA GLY 692 1HA GLY 692 -14.228 -17.154 -3.772 1348 H MET 693 H MET 693 -15.601 -18.445 -6.827 1349 HA MET 693 HA MET 693 -17.316 -20.290 -5.811 1350 1HB MET 693 1HB MET 693 -16.032 -19.680 -8.307 1351 2HB MET 693 2HB MET 693 -15.781 -21.396 -8.053 1352 1HG MET 693 1HG MET 693 -18.537 -20.171 -7.662 1353 2HG MET 693 2HG MET 693 -17.977 -20.604 -9.265 1354 1HE MET 693 1HE MET 693 -19.710 -21.924 -9.688 1355 2HE MET 693 2HE MET 693 -18.736 -23.363 -10.073 1356 3HE MET 693 3HE MET 693 -20.145 -23.504 -8.995 1357 H PHE 694 H PHE 694 -13.744 -20.536 -6.266 1358 HA PHE 694 HA PHE 694 -13.860 -23.045 -4.744 1359 1HB PHE 694 1HB PHE 694 -11.931 -23.724 -6.070 1360 2HB PHE 694 2HB PHE 694 -13.053 -23.019 -7.217 1361 HD1 PHE 694 1HD PHE 694 -9.902 -22.501 -5.405 1362 HD2 PHE 694 2HD PHE 694 -12.543 -20.953 -8.343 1363 HE1 PHE 694 1HE PHE 694 -8.123 -20.899 -6.160 1364 HE2 PHE 694 2HE PHE 694 -10.764 -19.352 -9.099 1365 HZ PHE 694 HZ PHE 694 -8.576 -19.344 -7.998 1366 H ALA 695 H ALA 695 -12.635 -23.207 -2.882 1367 HA ALA 695 HA ALA 695 -10.939 -20.879 -2.283 1368 1HB ALA 695 3HB ALA 695 -11.965 -22.384 0.020 1369 2HB ALA 695 1HB ALA 695 -12.005 -20.634 -0.308 1370 3HB ALA 695 2HB ALA 695 -13.264 -21.695 -0.983 No H/Q in entry = 1370 Start of MODEL 19 1 H ALA 1 H ALA 1 -12.033 36.286 -3.755 2 HA ALA 1 HA ALA 1 -10.087 35.027 -2.810 3 1HB ALA 1 3HB ALA 1 -10.862 32.798 -3.226 4 2HB ALA 1 2HB ALA 1 -9.452 33.048 -4.284 5 3HB ALA 1 1HB ALA 1 -11.097 33.131 -4.959 6 H GLU 2 H GLU 2 -7.993 34.747 -4.334 7 HA GLU 2 HA GLU 2 -8.293 36.737 -6.446 8 1HB GLU 2 1HB GLU 2 -6.900 37.112 -4.072 9 2HB GLU 2 2HB GLU 2 -5.628 36.596 -5.161 10 1HG GLU 2 1HG GLU 2 -6.214 38.366 -6.771 11 2HG GLU 2 2HG GLU 2 -7.613 38.822 -5.819 12 HE2 GLU 2 HE GLU 2 -4.044 40.224 -4.961 13 H MET 3 H MET 3 -5.968 34.259 -5.130 14 HA MET 3 HA MET 3 -5.429 33.547 -7.904 15 1HB MET 3 1HB MET 3 -3.836 33.437 -5.314 16 2HB MET 3 2HB MET 3 -3.409 32.339 -6.611 17 1HG MET 3 1HG MET 3 -2.425 34.000 -7.829 18 2HG MET 3 2HG MET 3 -3.796 35.072 -7.625 19 1HE MET 3 3HE MET 3 -0.250 34.791 -7.144 20 2HE MET 3 1HE MET 3 -0.981 36.313 -7.707 21 3HE MET 3 2HE MET 3 -0.017 36.289 -6.212 22 H LYS 4 H LYS 4 -7.476 32.266 -7.917 23 HA LYS 4 HA LYS 4 -7.306 29.841 -6.290 24 1HB LYS 4 1HB LYS 4 -9.663 29.553 -6.771 25 2HB LYS 4 2HB LYS 4 -9.376 31.154 -6.119 26 1HG LYS 4 1HG LYS 4 -9.074 31.582 -8.855 27 2HG LYS 4 2HG LYS 4 -10.328 30.358 -8.815 28 1HD LYS 4 1HD LYS 4 -10.728 32.483 -6.790 29 2HD LYS 4 2HD LYS 4 -10.714 33.099 -8.430 30 1HE LYS 4 1HE LYS 4 -12.485 31.531 -9.101 31 2HE LYS 4 2HE LYS 4 -12.417 30.722 -7.548 32 H THR 5 H THR 5 -7.060 31.138 -9.564 33 HA THR 5 HA THR 5 -6.855 28.382 -10.583 34 HB THR 5 HB THR 5 -7.455 29.404 -12.765 35 HG1 THR 5 1HG THR 5 -8.013 31.806 -12.494 36 1HG2 THR 5 2HG2 THR 5 -9.214 30.357 -10.447 37 2HG2 THR 5 3HG2 THR 5 -9.686 30.480 -12.159 38 3HG2 THR 5 1HG2 THR 5 -9.440 28.881 -11.416 39 H ASP 6 H ASP 6 -4.996 30.916 -9.435 40 HA ASP 6 HA ASP 6 -3.104 31.509 -11.150 41 1HB ASP 6 1HB ASP 6 -1.438 31.226 -9.198 42 2HB ASP 6 2HB ASP 6 -2.830 32.250 -8.907 43 HD2 ASP 6 HD ASP 6 -4.426 29.970 -6.864 44 H ALA 7 H ALA 7 -1.599 30.401 -12.435 45 HA ALA 7 HA ALA 7 -1.682 27.698 -12.804 46 1HB ALA 7 1HB ALA 7 0.219 29.916 -13.432 47 2HB ALA 7 2HB ALA 7 0.833 28.255 -13.611 48 3HB ALA 7 3HB ALA 7 -0.606 28.775 -14.520 49 H ALA 8 H ALA 8 -0.103 29.553 -10.257 50 HA ALA 8 HA ALA 8 1.828 27.662 -9.518 51 1HB ALA 8 2HB ALA 8 2.253 29.666 -8.507 52 2HB ALA 8 1HB ALA 8 1.266 28.966 -7.201 53 3HB ALA 8 3HB ALA 8 0.528 30.085 -8.373 54 H THR 9 H THR 9 -1.580 28.238 -8.428 55 HA THR 9 HA THR 9 -1.544 26.072 -6.592 56 HB THR 9 HB THR 9 -3.074 28.279 -6.905 57 HG1 THR 9 1HG THR 9 -4.026 25.620 -6.101 58 1HG2 THR 9 3HG2 THR 9 -4.662 25.991 -8.186 59 2HG2 THR 9 1HG2 THR 9 -5.352 27.540 -7.645 60 3HG2 THR 9 2HG2 THR 9 -4.195 27.505 -8.997 61 H LEU 10 H LEU 10 -2.305 26.406 -10.057 62 HA LEU 10 HA LEU 10 -3.584 23.890 -10.249 63 1HB LEU 10 1HB LEU 10 -2.423 25.852 -12.204 64 2HB LEU 10 2HB LEU 10 -2.984 24.280 -12.737 65 HG LEU 10 HG LEU 10 -4.625 26.455 -11.418 66 1HD1 LEU 10 1HD1 LEU 10 -3.970 26.564 -13.906 67 2HD1 LEU 10 2HD1 LEU 10 -5.103 25.208 -14.118 68 3HD1 LEU 10 3HD1 LEU 10 -5.685 26.761 -13.473 69 1HD2 LEU 10 1HD2 LEU 10 -5.357 23.593 -12.059 70 2HD2 LEU 10 2HD2 LEU 10 -5.480 24.449 -10.503 71 3HD2 LEU 10 3HD2 LEU 10 -6.566 24.883 -11.846 72 H ALA 11 H ALA 11 -0.256 25.048 -11.139 73 HA ALA 11 HA ALA 11 0.718 22.569 -11.895 74 1HB ALA 11 2HB ALA 11 1.821 25.207 -11.045 75 2HB ALA 11 3HB ALA 11 2.934 23.821 -10.969 76 3HB ALA 11 1HB ALA 11 2.148 24.248 -12.508 77 H GLN 12 H GLN 12 0.062 23.960 -8.710 78 HA GLN 12 HA GLN 12 1.768 22.362 -7.233 79 1HB GLN 12 1HB GLN 12 0.266 24.431 -6.577 80 2HB GLN 12 2HB GLN 12 -0.947 23.223 -6.205 81 1HG GLN 12 1HG GLN 12 0.097 22.649 -4.270 82 2HG GLN 12 2HG GLN 12 1.629 22.419 -5.090 83 1HE2 GLN 12 1HE2 GLN 12 3.214 23.712 -4.569 84 2HE2 GLN 12 2HE2 GLN 12 3.095 25.286 -3.856 85 H GLU 13 H GLU 13 -1.593 21.844 -8.426 86 HA GLU 13 HA GLU 13 -1.526 19.200 -7.240 87 1HB GLU 13 1HB GLU 13 -3.789 20.777 -8.541 88 2HB GLU 13 2HB GLU 13 -3.965 19.151 -7.913 89 1HG GLU 13 1HG GLU 13 -3.437 21.718 -6.392 90 2HG GLU 13 2HG GLU 13 -4.686 20.520 -6.115 91 HE2 GLU 13 HE GLU 13 -1.838 20.273 -3.746 92 H ALA 14 H ALA 14 -1.716 20.942 -10.372 93 HA ALA 14 HA ALA 14 -2.295 18.825 -12.035 94 1HB ALA 14 2HB ALA 14 -2.047 21.366 -12.489 95 2HB ALA 14 3HB ALA 14 -0.319 21.012 -12.731 96 3HB ALA 14 1HB ALA 14 -1.540 20.238 -13.770 97 H GLY 15 H GLY 15 0.965 20.066 -11.007 98 1HA GLY 15 2HA GLY 15 2.917 18.975 -10.728 99 2HA GLY 15 1HA GLY 15 2.578 18.289 -12.305 100 H ASN 16 H ASN 16 0.442 17.711 -9.504 101 HA ASN 16 HA ASN 16 1.715 15.219 -8.930 102 1HB ASN 16 1HB ASN 16 0.812 16.199 -6.977 103 2HB ASN 16 2HB ASN 16 -0.603 16.810 -7.811 104 1HD2 ASN 16 1HD2 ASN 16 -2.281 15.951 -6.831 105 2HD2 ASN 16 2HD2 ASN 16 -2.556 14.269 -6.522 106 H PHE 17 H PHE 17 -1.194 16.534 -10.574 107 HA PHE 17 HA PHE 17 -2.646 14.185 -10.830 108 1HB PHE 17 1HB PHE 17 -3.472 16.491 -11.322 109 2HB PHE 17 2HB PHE 17 -2.281 16.677 -12.595 110 HD1 PHE 17 1HD PHE 17 -2.826 16.125 -14.794 111 HD2 PHE 17 2HD PHE 17 -5.239 14.635 -11.638 112 HE1 PHE 17 1HE PHE 17 -4.482 15.259 -16.470 113 HE2 PHE 17 2HE PHE 17 -6.895 13.768 -13.314 114 HZ PHE 17 HZ PHE 17 -6.497 14.090 -15.710 115 H GLU 18 H GLU 18 -0.368 15.752 -13.198 116 HA GLU 18 HA GLU 18 -0.508 14.076 -15.228 117 1HB GLU 18 1HB GLU 18 1.770 15.559 -13.966 118 2HB GLU 18 2HB GLU 18 2.193 14.376 -15.188 119 1HG GLU 18 1HG GLU 18 1.402 15.684 -16.877 120 2HG GLU 18 2HG GLU 18 -0.106 15.994 -16.039 121 HE2 GLU 18 HE GLU 18 2.929 18.541 -15.912 122 H ARG 19 H ARG 19 1.005 13.379 -12.061 123 HA ARG 19 HA ARG 19 2.281 11.046 -12.865 124 1HB ARG 19 1HB ARG 19 2.242 12.563 -10.573 125 2HB ARG 19 2HB ARG 19 1.258 11.211 -10.051 126 1HG ARG 19 1HG ARG 19 3.023 9.617 -10.547 127 2HG ARG 19 2HG ARG 19 3.964 10.823 -11.402 128 1HD ARG 19 1HD ARG 19 4.022 12.136 -9.153 129 2HD ARG 19 2HD ARG 19 3.423 10.668 -8.407 130 HE ARG 19 HE ARG 19 5.650 9.945 -10.024 131 2HH1 ARG 19 1HH ARG 19 8.158 10.252 -7.641 132 1HH2 ARG 19 2HH2 ARG 19 4.996 11.842 -7.104 133 2HH2 ARG 19 1HH2 ARG 19 6.570 11.576 -6.429 134 H ILE 20 H ILE 20 -0.949 11.721 -11.371 135 HA ILE 20 HA ILE 20 -1.716 9.060 -11.049 136 HB ILE 20 HB ILE 20 -3.416 11.514 -11.507 137 1HG1 ILE 20 1HG1 ILE 20 -2.776 10.361 -8.809 138 2HG1 ILE 20 2HG1 ILE 20 -1.617 11.420 -9.587 139 1HG2 ILE 20 1HG2 ILE 20 -4.478 9.184 -11.746 140 2HG2 ILE 20 2HG2 ILE 20 -4.223 9.039 -9.990 141 3HG2 ILE 20 3HG2 ILE 20 -5.241 10.348 -10.636 142 1HD1 ILE 20 2HD1 ILE 20 -4.056 12.751 -9.972 143 2HD1 ILE 20 3HD1 ILE 20 -4.190 12.079 -8.330 144 3HD1 ILE 20 1HD1 ILE 20 -2.828 13.147 -8.746 145 H SER 21 H SER 21 -2.127 11.375 -13.793 146 HA SER 21 HA SER 21 -3.696 9.748 -15.343 147 1HB SER 21 1HB SER 21 -2.680 11.095 -17.280 148 2HB SER 21 2HB SER 21 -3.445 12.021 -16.004 149 HG SER 21 HG SER 21 -0.638 11.659 -16.528 150 H GLY 22 H GLY 22 -0.079 10.163 -15.373 151 1HA GLY 22 2HA GLY 22 1.570 8.773 -16.001 152 2HA GLY 22 1HA GLY 22 0.533 8.317 -17.338 153 H ASP 23 H ASP 23 0.605 7.781 -13.734 154 HA ASP 23 HA ASP 23 1.168 5.142 -13.811 155 1HB ASP 23 1HB ASP 23 -0.044 7.035 -11.910 156 2HB ASP 23 2HB ASP 23 -0.678 5.417 -11.687 157 HD2 ASP 23 HD ASP 23 2.075 4.542 -9.857 158 H LEU 24 H LEU 24 -2.085 6.777 -13.750 159 HA LEU 24 HA LEU 24 -3.664 4.524 -13.730 160 1HB LEU 24 1HB LEU 24 -4.292 6.958 -13.439 161 2HB LEU 24 2HB LEU 24 -4.289 7.089 -15.187 162 HG LEU 24 HG LEU 24 -5.970 5.090 -15.098 163 1HD1 LEU 24 1HD1 LEU 24 -5.497 4.926 -12.531 164 2HD1 LEU 24 2HD1 LEU 24 -6.702 6.231 -12.423 165 3HD1 LEU 24 3HD1 LEU 24 -7.143 4.672 -13.160 166 1HD2 LEU 24 3HD2 LEU 24 -6.317 7.989 -14.841 167 2HD2 LEU 24 1HD2 LEU 24 -7.077 6.830 -15.957 168 3HD2 LEU 24 2HD2 LEU 24 -7.735 7.049 -14.318 169 H LYS 25 H LYS 25 -1.899 6.101 -16.410 170 HA LYS 25 HA LYS 25 -3.170 4.489 -18.400 171 1HB LYS 25 1HB LYS 25 -2.467 6.623 -19.107 172 2HB LYS 25 2HB LYS 25 -0.883 6.455 -18.380 173 1HG LYS 25 1HG LYS 25 -0.046 5.226 -20.143 174 2HG LYS 25 2HG LYS 25 -1.546 4.355 -20.390 175 1HD LYS 25 1HD LYS 25 -0.974 5.908 -22.291 176 2HD LYS 25 2HD LYS 25 -2.541 6.237 -21.578 177 1HE LYS 25 1HE LYS 25 -1.777 8.400 -21.492 178 2HE LYS 25 2HE LYS 25 -0.985 7.867 -20.023 179 H THR 26 H THR 26 -0.088 4.452 -16.539 180 HA THR 26 HA THR 26 1.146 2.377 -17.921 181 HB THR 26 HB THR 26 1.294 3.623 -15.169 182 HG1 THR 26 1HG THR 26 2.307 4.294 -17.338 183 1HG2 THR 26 2HG2 THR 26 2.755 1.097 -16.097 184 2HG2 THR 26 3HG2 THR 26 3.341 2.144 -14.782 185 3HG2 THR 26 1HG2 THR 26 1.790 1.287 -14.614 186 H GLN 27 H GLN 27 -1.210 2.285 -15.196 187 HA GLN 27 HA GLN 27 -1.031 -0.509 -14.968 188 1HB GLN 27 1HB GLN 27 -3.278 1.348 -14.070 189 2HB GLN 27 2HB GLN 27 -2.997 -0.281 -13.489 190 1HG GLN 27 1HG GLN 27 -0.805 1.811 -13.286 191 2HG GLN 27 2HG GLN 27 -2.086 1.759 -12.090 192 1HE2 GLN 27 1HE2 GLN 27 0.937 0.734 -12.804 193 2HE2 GLN 27 2HE2 GLN 27 1.065 -0.683 -11.816 194 H ILE 28 H ILE 28 -3.280 1.763 -16.648 195 HA ILE 28 HA ILE 28 -5.125 -0.137 -17.485 196 HB ILE 28 HB ILE 28 -4.294 2.580 -18.423 197 1HG1 ILE 28 1HG1 ILE 28 -6.900 1.483 -17.326 198 2HG1 ILE 28 2HG1 ILE 28 -5.673 2.304 -16.381 199 1HG2 ILE 28 3HG2 ILE 28 -5.611 0.571 -20.062 200 2HG2 ILE 28 1HG2 ILE 28 -6.632 2.008 -19.816 201 3HG2 ILE 28 2HG2 ILE 28 -4.996 2.184 -20.496 202 1HD1 ILE 28 2HD1 ILE 28 -5.903 4.290 -17.983 203 2HD1 ILE 28 3HD1 ILE 28 -7.322 3.461 -18.668 204 3HD1 ILE 28 1HD1 ILE 28 -7.323 3.964 -16.960 205 H ASP 29 H ASP 29 -1.972 0.906 -18.850 206 HA ASP 29 HA ASP 29 -2.298 -0.498 -21.242 207 1HB ASP 29 1HB ASP 29 -0.292 1.120 -19.936 208 2HB ASP 29 2HB ASP 29 0.488 -0.347 -20.493 209 HD2 ASP 29 HD ASP 29 1.329 1.838 -22.338 210 H GLN 30 H GLN 30 -0.842 -1.208 -18.014 211 HA GLN 30 HA GLN 30 0.423 -3.554 -18.648 212 1HB GLN 30 1HB GLN 30 -0.793 -2.449 -16.108 213 2HB GLN 30 2HB GLN 30 -0.128 -4.070 -16.111 214 1HG GLN 30 1HG GLN 30 2.062 -3.228 -16.864 215 2HG GLN 30 2HG GLN 30 1.417 -1.609 -17.052 216 1HE2 GLN 30 1HE2 GLN 30 2.925 -0.775 -15.622 217 2HE2 GLN 30 2HE2 GLN 30 2.815 -0.974 -13.905 218 H VAL 31 H VAL 31 -2.991 -2.947 -17.626 219 HA VAL 31 HA VAL 31 -3.712 -5.660 -17.504 220 HB VAL 31 HB VAL 31 -5.226 -3.073 -17.809 221 1HG1 VAL 31 2HG1 VAL 31 -6.428 -5.018 -18.914 222 2HG1 VAL 31 3HG1 VAL 31 -6.512 -5.769 -17.303 223 3HG1 VAL 31 1HG1 VAL 31 -7.308 -4.205 -17.598 224 1HG2 VAL 31 3HG2 VAL 31 -4.217 -4.679 -15.590 225 2HG2 VAL 31 1HG2 VAL 31 -4.816 -3.003 -15.610 226 3HG2 VAL 31 2HG2 VAL 31 -5.962 -4.357 -15.451 227 H GLU 32 H GLU 32 -4.168 -3.135 -20.076 228 HA GLU 32 HA GLU 32 -5.461 -4.619 -21.895 229 1HB GLU 32 1HB GLU 32 -3.658 -2.283 -21.955 230 2HB GLU 32 2HB GLU 32 -3.659 -3.171 -23.465 231 1HG GLU 32 1HG GLU 32 -6.321 -3.145 -23.081 232 2HG GLU 32 2HG GLU 32 -5.941 -1.746 -22.097 233 HE2 GLU 32 HE GLU 32 -4.174 -2.140 -25.400 234 H SER 33 H SER 33 -1.904 -4.564 -21.265 235 HA SER 33 HA SER 33 -1.370 -6.374 -23.365 236 1HB SER 33 1HB SER 33 0.129 -4.668 -21.722 237 2HB SER 33 2HB SER 33 0.636 -6.264 -21.207 238 HG SER 33 HG SER 33 0.788 -6.645 -23.697 239 H THR 34 H THR 34 -1.430 -6.611 -19.736 240 HA THR 34 HA THR 34 -0.837 -9.301 -19.525 241 HB THR 34 HB THR 34 -2.252 -7.199 -17.891 242 HG1 THR 34 1HG THR 34 -0.177 -9.221 -17.429 243 1HG2 THR 34 2HG2 THR 34 -3.551 -9.393 -17.536 244 2HG2 THR 34 3HG2 THR 34 -2.014 -10.116 -17.005 245 3HG2 THR 34 1HG2 THR 34 -2.726 -8.766 -16.090 246 H ALA 35 H ALA 35 -4.033 -7.714 -20.056 247 HA ALA 35 HA ALA 35 -5.607 -9.954 -19.816 248 1HB ALA 35 1HB ALA 35 -6.229 -7.997 -21.989 249 2HB ALA 35 3HB ALA 35 -6.030 -7.345 -20.344 250 3HB ALA 35 2HB ALA 35 -7.254 -8.598 -20.663 251 H GLY 36 H GLY 36 -3.447 -8.910 -22.457 252 1HA GLY 36 2HA GLY 36 -2.631 -10.075 -24.206 253 2HA GLY 36 1HA GLY 36 -4.317 -10.353 -24.593 254 H SER 37 H SER 37 -2.257 -11.548 -21.848 255 HA SER 37 HA SER 37 -2.001 -14.108 -22.908 256 1HB SER 37 1HB SER 37 -1.863 -13.299 -19.972 257 2HB SER 37 2HB SER 37 -1.125 -14.713 -20.699 258 HG SER 37 HG SER 37 0.583 -13.418 -20.875 259 H LEU 38 H LEU 38 -4.454 -12.503 -20.877 260 HA LEU 38 HA LEU 38 -5.713 -14.871 -19.992 261 1HB LEU 38 1HB LEU 38 -6.359 -11.957 -20.050 262 2HB LEU 38 2HB LEU 38 -7.656 -13.095 -19.743 263 HG LEU 38 HG LEU 38 -6.985 -12.567 -17.609 264 1HD1 LEU 38 1HD1 LEU 38 -6.636 -15.111 -18.343 265 2HD1 LEU 38 2HD1 LEU 38 -4.977 -14.755 -17.808 266 3HD1 LEU 38 3HD1 LEU 38 -6.340 -14.538 -16.684 267 1HD2 LEU 38 3HD2 LEU 38 -4.886 -11.346 -18.634 268 2HD2 LEU 38 1HD2 LEU 38 -4.942 -11.801 -16.914 269 3HD2 LEU 38 2HD2 LEU 38 -4.040 -12.807 -18.072 270 H GLN 39 H GLN 39 -6.792 -12.416 -22.453 271 HA GLN 39 HA GLN 39 -8.842 -13.901 -23.440 272 1HB GLN 39 1HB GLN 39 -8.293 -12.543 -25.636 273 2HB GLN 39 2HB GLN 39 -8.815 -11.696 -24.193 274 1HG GLN 39 1HG GLN 39 -5.928 -12.066 -24.101 275 2HG GLN 39 2HG GLN 39 -6.371 -11.345 -25.636 276 1HE2 GLN 39 1HE2 GLN 39 -8.055 -11.067 -22.538 277 2HE2 GLN 39 2HE2 GLN 39 -7.845 -9.363 -22.313 278 H GLY 40 H GLY 40 -5.377 -14.326 -23.867 279 1HA GLY 40 2HA GLY 40 -4.184 -15.582 -25.374 280 2HA GLY 40 1HA GLY 40 -5.658 -16.005 -26.222 281 H GLN 41 H GLN 41 -6.414 -16.430 -22.995 282 HA GLN 41 HA GLN 41 -5.965 -19.265 -23.262 283 1HB GLN 41 1HB GLN 41 -4.007 -18.186 -21.969 284 2HB GLN 41 2HB GLN 41 -5.160 -17.846 -20.694 285 1HG GLN 41 1HG GLN 41 -4.376 -20.584 -21.783 286 2HG GLN 41 2HG GLN 41 -4.074 -19.960 -20.173 287 1HE2 GLN 41 1HE2 GLN 41 -6.273 -18.960 -19.235 288 2HE2 GLN 41 2HE2 GLN 41 -7.597 -20.076 -19.203 289 H TRP 42 H TRP 42 -8.080 -19.933 -23.208 290 HA TRP 42 HA TRP 42 -9.554 -19.559 -20.801 291 1HB TRP 42 1HB TRP 42 -10.497 -18.134 -23.293 292 2HB TRP 42 2HB TRP 42 -11.531 -18.503 -21.926 293 HD1 TRP 42 HD TRP 42 -9.633 -15.682 -23.171 294 HE1 TRP 42 1HE TRP 42 -8.988 -13.889 -21.346 295 HE3 TRP 42 3HE TRP 42 -10.568 -18.662 -19.159 296 HZ2 TRP 42 2HZ TRP 42 -8.943 -13.917 -18.492 297 HZ3 TRP 42 3HZ TRP 42 -10.199 -17.702 -16.888 298 HH2 TRP 42 HH TRP 42 -9.415 -15.416 -16.520 299 H ARG 43 H ARG 43 -11.744 -20.764 -21.059 300 HA ARG 43 HA ARG 43 -11.218 -23.000 -22.827 301 1HB ARG 43 1HB ARG 43 -12.574 -22.660 -20.172 302 2HB ARG 43 2HB ARG 43 -13.288 -23.853 -21.238 303 1HG ARG 43 1HG ARG 43 -10.296 -23.916 -20.969 304 2HG ARG 43 2HG ARG 43 -11.218 -24.417 -19.565 305 1HD ARG 43 1HD ARG 43 -12.514 -25.702 -21.722 306 2HD ARG 43 2HD ARG 43 -10.811 -25.822 -22.119 307 HE ARG 43 HE ARG 43 -11.368 -26.488 -19.325 308 2HH1 ARG 43 1HH ARG 43 -10.930 -29.905 -19.761 309 1HH2 ARG 43 2HH2 ARG 43 -11.259 -27.781 -22.622 310 2HH2 ARG 43 1HH2 ARG 43 -11.036 -29.419 -22.105 311 H GLY 44 H GLY 44 -13.873 -20.824 -21.641 312 1HA GLY 44 2HA GLY 44 -15.950 -21.711 -23.222 313 2HA GLY 44 1HA GLY 44 -15.032 -20.615 -24.236 314 H ALA 45 H ALA 45 -16.770 -20.914 -21.100 315 HA ALA 45 HA ALA 45 -18.036 -18.467 -21.338 316 1HB ALA 45 1HB ALA 45 -18.441 -18.807 -18.844 317 2HB ALA 45 2HB ALA 45 -18.914 -20.165 -19.894 318 3HB ALA 45 3HB ALA 45 -17.401 -20.247 -18.960 319 H ALA 46 H ALA 46 -15.308 -19.322 -19.083 320 HA ALA 46 HA ALA 46 -14.799 -16.793 -18.185 321 1HB ALA 46 2HB ALA 46 -12.472 -18.588 -18.743 322 2HB ALA 46 1HB ALA 46 -13.777 -19.238 -17.722 323 3HB ALA 46 3HB ALA 46 -12.932 -17.747 -17.243 324 H GLY 47 H GLY 47 -14.187 -18.210 -21.355 325 1HA GLY 47 2HA GLY 47 -13.160 -17.424 -23.203 326 2HA GLY 47 1HA GLY 47 -12.166 -16.394 -22.192 327 H THR 48 H THR 48 -15.599 -16.688 -23.353 328 HA THR 48 HA THR 48 -15.636 -14.160 -24.529 329 HB THR 48 HB THR 48 -18.046 -14.622 -24.727 330 HG1 THR 48 1HG THR 48 -17.263 -16.273 -22.468 331 1HG2 THR 48 1HG2 THR 48 -16.216 -16.340 -25.747 332 2HG2 THR 48 2HG2 THR 48 -16.990 -17.444 -24.585 333 3HG2 THR 48 3HG2 THR 48 -17.962 -16.668 -25.859 334 H ALA 49 H ALA 49 -16.092 -15.173 -21.172 335 HA ALA 49 HA ALA 49 -17.441 -12.843 -20.334 336 1HB ALA 49 3HB ALA 49 -15.874 -15.058 -19.001 337 2HB ALA 49 2HB ALA 49 -17.616 -14.704 -18.913 338 3HB ALA 49 1HB ALA 49 -16.452 -13.662 -18.060 339 H ALA 50 H ALA 50 -13.958 -13.853 -20.329 340 HA ALA 50 HA ALA 50 -13.140 -11.301 -19.316 341 1HB ALA 50 1HB ALA 50 -10.839 -12.372 -20.007 342 2HB ALA 50 3HB ALA 50 -11.807 -13.849 -20.229 343 3HB ALA 50 2HB ALA 50 -11.752 -13.052 -18.638 344 H GLN 51 H GLN 51 -12.525 -13.093 -22.426 345 HA GLN 51 HA GLN 51 -11.315 -11.199 -23.817 346 1HB GLN 51 1HB GLN 51 -11.640 -13.217 -24.958 347 2HB GLN 51 2HB GLN 51 -13.353 -13.278 -24.594 348 1HG GLN 51 1HG GLN 51 -12.472 -10.951 -26.258 349 2HG GLN 51 2HG GLN 51 -12.339 -12.521 -27.026 350 1HE2 GLN 51 1HE2 GLN 51 -14.384 -9.992 -26.066 351 2HE2 GLN 51 2HE2 GLN 51 -15.916 -10.675 -26.497 352 H ALA 52 H ALA 52 -14.783 -11.270 -22.950 353 HA ALA 52 HA ALA 52 -15.435 -9.053 -24.642 354 1HB ALA 52 3HB ALA 52 -17.068 -10.809 -24.091 355 2HB ALA 52 2HB ALA 52 -17.627 -9.227 -23.498 356 3HB ALA 52 1HB ALA 52 -16.933 -10.408 -22.362 357 H ALA 53 H ALA 53 -14.851 -9.614 -21.114 358 HA ALA 53 HA ALA 53 -15.409 -7.068 -20.228 359 1HB ALA 53 3HB ALA 53 -13.120 -8.697 -19.118 360 2HB ALA 53 2HB ALA 53 -14.791 -9.298 -18.995 361 3HB ALA 53 1HB ALA 53 -14.348 -7.742 -18.252 362 H VAL 54 H VAL 54 -12.162 -8.432 -21.152 363 HA VAL 54 HA VAL 54 -10.755 -6.081 -20.912 364 HB VAL 54 HB VAL 54 -9.345 -7.800 -21.191 365 1HG1 VAL 54 3HG1 VAL 54 -11.526 -8.997 -22.867 366 2HG1 VAL 54 1HG1 VAL 54 -9.874 -9.646 -23.005 367 3HG1 VAL 54 2HG1 VAL 54 -10.702 -9.648 -21.429 368 1HG2 VAL 54 1HG2 VAL 54 -8.941 -6.142 -23.090 369 2HG2 VAL 54 2HG2 VAL 54 -8.212 -7.756 -23.269 370 3HG2 VAL 54 3HG2 VAL 54 -9.696 -7.345 -24.162 371 H VAL 55 H VAL 55 -12.287 -7.480 -23.899 372 HA VAL 55 HA VAL 55 -11.670 -5.566 -25.686 373 HB VAL 55 HB VAL 55 -14.134 -7.219 -25.235 374 1HG1 VAL 55 1HG1 VAL 55 -13.905 -4.870 -26.983 375 2HG1 VAL 55 2HG1 VAL 55 -14.373 -6.355 -27.846 376 3HG1 VAL 55 3HG1 VAL 55 -15.344 -5.784 -26.468 377 1HG2 VAL 55 3HG2 VAL 55 -11.816 -8.065 -26.076 378 2HG2 VAL 55 1HG2 VAL 55 -13.294 -8.597 -26.912 379 3HG2 VAL 55 2HG2 VAL 55 -12.289 -7.307 -27.615 380 H ARG 56 H ARG 56 -14.553 -5.475 -23.472 381 HA ARG 56 HA ARG 56 -15.374 -2.982 -24.258 382 1HB ARG 56 1HB ARG 56 -15.851 -4.807 -21.955 383 2HB ARG 56 2HB ARG 56 -16.137 -3.119 -21.581 384 1HG ARG 56 1HG ARG 56 -18.223 -4.060 -22.400 385 2HG ARG 56 2HG ARG 56 -17.622 -2.953 -23.618 386 1HD ARG 56 1HD ARG 56 -17.048 -4.672 -25.107 387 2HD ARG 56 2HD ARG 56 -16.779 -5.841 -23.830 388 HE ARG 56 HE ARG 56 -19.082 -6.357 -23.815 389 2HH1 ARG 56 1HH ARG 56 -21.667 -5.165 -25.804 390 1HH2 ARG 56 2HH2 ARG 56 -18.510 -3.479 -25.800 391 2HH2 ARG 56 1HH2 ARG 56 -20.108 -3.470 -26.468 392 H PHE 57 H PHE 57 -13.279 -3.990 -21.464 393 HA PHE 57 HA PHE 57 -12.874 -1.494 -20.378 394 1HB PHE 57 1HB PHE 57 -11.994 -3.263 -19.096 395 2HB PHE 57 2HB PHE 57 -11.542 -4.185 -20.516 396 HD1 PHE 57 1HD PHE 57 -9.369 -3.879 -21.561 397 HD2 PHE 57 2HD PHE 57 -10.464 -1.632 -18.132 398 HE1 PHE 57 1HE PHE 57 -6.970 -3.222 -21.225 399 HE2 PHE 57 2HE PHE 57 -8.065 -0.974 -17.797 400 HZ PHE 57 HZ PHE 57 -6.346 -1.777 -19.347 401 H GLN 58 H GLN 58 -11.304 -3.086 -23.181 402 HA GLN 58 HA GLN 58 -9.154 -1.367 -23.382 403 1HB GLN 58 1HB GLN 58 -10.665 -2.996 -25.462 404 2HB GLN 58 2HB GLN 58 -9.215 -2.095 -25.855 405 1HG GLN 58 1HG GLN 58 -8.222 -3.375 -23.724 406 2HG GLN 58 2HG GLN 58 -9.523 -4.502 -24.053 407 1HE2 GLN 58 1HE2 GLN 58 -9.612 -4.094 -26.883 408 2HE2 GLN 58 2HE2 GLN 58 -8.218 -4.840 -27.590 409 H GLU 59 H GLU 59 -12.318 -1.312 -25.186 410 HA GLU 59 HA GLU 59 -11.850 1.026 -26.521 411 1HB GLU 59 1HB GLU 59 -14.437 -0.242 -25.541 412 2HB GLU 59 2HB GLU 59 -14.422 1.176 -26.571 413 1HG GLU 59 1HG GLU 59 -12.736 -1.157 -27.445 414 2HG GLU 59 2HG GLU 59 -14.474 -1.349 -27.560 415 HE2 GLU 59 HE GLU 59 -15.478 0.781 -28.789 416 H ALA 60 H ALA 60 -12.683 0.458 -23.138 417 HA ALA 60 HA ALA 60 -13.543 3.169 -22.693 418 1HB ALA 60 3HB ALA 60 -12.924 0.854 -20.813 419 2HB ALA 60 1HB ALA 60 -13.658 2.402 -20.329 420 3HB ALA 60 2HB ALA 60 -14.528 1.311 -21.434 421 H ALA 61 H ALA 61 -10.563 1.267 -22.648 422 HA ALA 61 HA ALA 61 -9.062 2.831 -20.907 423 1HB ALA 61 3HB ALA 61 -8.648 0.530 -22.192 424 2HB ALA 61 1HB ALA 61 -7.816 1.600 -23.345 425 3HB ALA 61 2HB ALA 61 -7.291 1.543 -21.645 426 H ASN 62 H ASN 62 -9.172 2.936 -24.545 427 HA ASN 62 HA ASN 62 -7.611 5.113 -24.863 428 1HB ASN 62 1HB ASN 62 -9.545 5.471 -26.842 429 2HB ASN 62 2HB ASN 62 -8.168 4.394 -26.972 430 1HD2 ASN 62 1HD2 ASN 62 -8.425 2.194 -26.094 431 2HD2 ASN 62 2HD2 ASN 62 -9.945 1.384 -26.285 432 H LYS 63 H LYS 63 -11.194 4.915 -24.315 433 HA LYS 63 HA LYS 63 -11.781 7.603 -24.565 434 1HB LYS 63 1HB LYS 63 -13.299 5.500 -24.319 435 2HB LYS 63 2HB LYS 63 -13.185 5.805 -22.597 436 1HG LYS 63 1HG LYS 63 -14.946 7.222 -22.936 437 2HG LYS 63 2HG LYS 63 -13.733 8.344 -23.519 438 1HD LYS 63 1HD LYS 63 -15.567 8.148 -25.159 439 2HD LYS 63 2HD LYS 63 -14.074 7.540 -25.847 440 1HE LYS 63 1HE LYS 63 -14.758 5.272 -25.675 441 2HE LYS 63 2HE LYS 63 -15.950 5.619 -24.439 442 H GLN 64 H GLN 64 -10.335 5.752 -21.878 443 HA GLN 64 HA GLN 64 -10.644 7.863 -20.029 444 1HB GLN 64 1HB GLN 64 -9.534 5.141 -20.071 445 2HB GLN 64 2HB GLN 64 -8.549 6.228 -19.113 446 1HG GLN 64 1HG GLN 64 -11.352 6.745 -18.545 447 2HG GLN 64 2HG GLN 64 -11.047 5.027 -18.391 448 1HE2 GLN 64 1HE2 GLN 64 -9.386 4.287 -16.992 449 2HE2 GLN 64 2HE2 GLN 64 -8.878 5.214 -15.619 450 H LYS 65 H LYS 65 -8.073 6.741 -22.272 451 HA LYS 65 HA LYS 65 -6.040 8.391 -21.284 452 1HB LYS 65 1HB LYS 65 -6.544 6.785 -23.737 453 2HB LYS 65 2HB LYS 65 -5.343 8.054 -23.870 454 1HG LYS 65 1HG LYS 65 -4.123 6.135 -23.138 455 2HG LYS 65 2HG LYS 65 -4.296 7.127 -21.704 456 1HD LYS 65 1HD LYS 65 -6.473 5.121 -22.230 457 2HD LYS 65 2HD LYS 65 -4.915 4.483 -21.743 458 1HE LYS 65 1HE LYS 65 -6.506 6.604 -20.221 459 2HE LYS 65 2HE LYS 65 -6.393 4.913 -19.778 460 H GLN 66 H GLN 66 -8.745 8.926 -23.561 461 HA GLN 66 HA GLN 66 -7.774 11.351 -24.543 462 1HB GLN 66 1HB GLN 66 -9.867 9.676 -25.159 463 2HB GLN 66 2HB GLN 66 -10.728 10.998 -24.397 464 1HG GLN 66 1HG GLN 66 -8.627 11.526 -26.532 465 2HG GLN 66 2HG GLN 66 -10.278 11.132 -26.970 466 1HE2 GLN 66 1HE2 GLN 66 -11.968 12.513 -26.435 467 2HE2 GLN 66 2HE2 GLN 66 -11.728 14.176 -26.016 468 H GLU 67 H GLU 67 -10.207 10.562 -21.962 469 HA GLU 67 HA GLU 67 -10.652 13.222 -21.286 470 1HB GLU 67 1HB GLU 67 -11.262 10.542 -20.121 471 2HB GLU 67 2HB GLU 67 -11.275 11.875 -18.983 472 1HG GLU 67 1HG GLU 67 -13.505 11.358 -20.173 473 2HG GLU 67 2HG GLU 67 -12.996 13.034 -20.161 474 HE2 GLU 67 HE GLU 67 -14.146 12.688 -23.222 475 H LEU 68 H LEU 68 -8.084 10.940 -20.503 476 HA LEU 68 HA LEU 68 -7.213 12.307 -18.158 477 1HB LEU 68 1HB LEU 68 -6.345 10.009 -19.810 478 2HB LEU 68 2HB LEU 68 -5.081 10.842 -18.927 479 HG LEU 68 HG LEU 68 -7.597 9.898 -17.552 480 1HD1 LEU 68 2HD1 LEU 68 -5.356 8.278 -18.582 481 2HD1 LEU 68 3HD1 LEU 68 -5.769 8.004 -16.872 482 3HD1 LEU 68 1HD1 LEU 68 -7.013 7.808 -18.131 483 1HD2 LEU 68 3HD2 LEU 68 -4.826 10.672 -16.623 484 2HD2 LEU 68 1HD2 LEU 68 -6.384 11.434 -16.222 485 3HD2 LEU 68 2HD2 LEU 68 -5.996 9.815 -15.592 486 H ASP 69 H ASP 69 -6.009 12.074 -21.577 487 HA ASP 69 HA ASP 69 -3.965 13.891 -21.211 488 1HB ASP 69 1HB ASP 69 -5.004 12.333 -23.306 489 2HB ASP 69 2HB ASP 69 -5.224 13.972 -23.885 490 HD2 ASP 69 HD ASP 69 -2.485 12.011 -22.567 491 H GLU 70 H GLU 70 -7.326 14.251 -22.571 492 HA GLU 70 HA GLU 70 -7.238 16.880 -23.207 493 1HB GLU 70 1HB GLU 70 -9.562 16.755 -23.388 494 2HB GLU 70 2HB GLU 70 -9.126 15.059 -23.448 495 1HG GLU 70 1HG GLU 70 -9.581 14.834 -21.011 496 2HG GLU 70 2HG GLU 70 -9.963 16.542 -20.911 497 HE2 GLU 70 HE GLU 70 -10.724 14.020 -23.063 498 H ILE 71 H ILE 71 -8.034 15.383 -20.007 499 HA ILE 71 HA ILE 71 -8.529 17.862 -18.745 500 HB ILE 71 HB ILE 71 -7.988 15.069 -17.765 501 1HG1 ILE 71 1HG1 ILE 71 -10.497 16.770 -17.695 502 2HG1 ILE 71 2HG1 ILE 71 -10.143 15.576 -18.927 503 1HG2 ILE 71 3HG2 ILE 71 -7.621 17.470 -16.279 504 2HG2 ILE 71 1HG2 ILE 71 -9.105 16.680 -15.695 505 3HG2 ILE 71 2HG2 ILE 71 -7.567 15.784 -15.711 506 1HD1 ILE 71 2HD1 ILE 71 -9.926 14.692 -16.060 507 2HD1 ILE 71 3HD1 ILE 71 -11.555 14.957 -16.727 508 3HD1 ILE 71 1HD1 ILE 71 -10.462 13.779 -17.491 509 H SER 72 H SER 72 -5.674 15.633 -18.858 510 HA SER 72 HA SER 72 -4.094 17.175 -17.204 511 1HB SER 72 1HB SER 72 -2.411 15.672 -17.730 512 2HB SER 72 2HB SER 72 -3.801 14.748 -18.263 513 HG SER 72 HG SER 72 -3.337 15.978 -20.427 514 H THR 73 H THR 73 -5.151 17.643 -20.503 515 HA THR 73 HA THR 73 -2.977 19.502 -21.082 516 HB THR 73 HB THR 73 -5.284 18.287 -22.678 517 HG1 THR 73 1HG THR 73 -3.224 17.521 -23.787 518 1HG2 THR 73 1HG2 THR 73 -4.163 20.791 -23.222 519 2HG2 THR 73 2HG2 THR 73 -3.110 19.683 -24.133 520 3HG2 THR 73 3HG2 THR 73 -4.863 19.700 -24.442 521 H ASN 74 H ASN 74 -6.412 19.423 -20.177 522 HA ASN 74 HA ASN 74 -7.210 21.869 -20.941 523 1HB ASN 74 1HB ASN 74 -7.908 19.957 -18.811 524 2HB ASN 74 2HB ASN 74 -8.195 21.605 -18.287 525 1HD2 ASN 74 1HD2 ASN 74 -9.321 18.990 -20.082 526 2HD2 ASN 74 2HD2 ASN 74 -10.652 19.734 -20.902 527 H ILE 75 H ILE 75 -5.572 20.963 -17.809 528 HA ILE 75 HA ILE 75 -5.361 23.584 -16.854 529 HB ILE 75 HB ILE 75 -3.586 21.236 -16.194 530 1HG1 ILE 75 1HG1 ILE 75 -5.681 21.462 -14.308 531 2HG1 ILE 75 2HG1 ILE 75 -6.445 21.507 -15.885 532 1HG2 ILE 75 2HG2 ILE 75 -3.979 23.927 -15.083 533 2HG2 ILE 75 3HG2 ILE 75 -4.071 22.618 -13.880 534 3HG2 ILE 75 1HG2 ILE 75 -2.623 22.788 -14.902 535 1HD1 ILE 75 1HD1 ILE 75 -4.915 19.476 -16.479 536 2HD1 ILE 75 2HD1 ILE 75 -4.659 19.346 -14.722 537 3HD1 ILE 75 3HD1 ILE 75 -6.299 19.191 -15.396 538 H ARG 76 H ARG 76 -3.072 21.477 -18.702 539 HA ARG 76 HA ARG 76 -0.927 23.105 -18.677 540 1HB ARG 76 1HB ARG 76 -1.868 20.861 -20.229 541 2HB ARG 76 2HB ARG 76 -1.198 22.026 -21.353 542 1HG ARG 76 1HG ARG 76 0.943 21.671 -20.635 543 2HG ARG 76 2HG ARG 76 0.481 21.703 -18.945 544 1HD ARG 76 1HD ARG 76 0.692 19.444 -18.873 545 2HD ARG 76 2HD ARG 76 -0.647 19.303 -19.995 546 HE ARG 76 HE ARG 76 2.210 19.082 -20.641 547 2HH1 ARG 76 1HH ARG 76 1.648 18.470 -24.013 548 1HH2 ARG 76 2HH2 ARG 76 -1.034 19.641 -21.952 549 2HH2 ARG 76 1HH2 ARG 76 -0.601 19.165 -23.560 550 H GLN 77 H GLN 77 -3.902 23.317 -20.675 551 HA GLN 77 HA GLN 77 -2.824 25.425 -22.263 552 1HB GLN 77 1HB GLN 77 -5.657 24.317 -22.035 553 2HB GLN 77 2HB GLN 77 -5.145 25.494 -23.229 554 1HG GLN 77 1HG GLN 77 -3.347 23.161 -23.156 555 2HG GLN 77 2HG GLN 77 -5.004 22.692 -23.478 556 1HE2 GLN 77 1HE2 GLN 77 -6.178 23.992 -25.125 557 2HE2 GLN 77 2HE2 GLN 77 -5.326 24.485 -26.551 558 H ALA 78 H ALA 78 -4.314 25.113 -19.158 559 HA ALA 78 HA ALA 78 -5.775 27.496 -19.048 560 1HB ALA 78 2HB ALA 78 -4.305 26.266 -16.706 561 2HB ALA 78 3HB ALA 78 -5.900 27.056 -16.738 562 3HB ALA 78 1HB ALA 78 -5.693 25.441 -17.456 563 H GLY 79 H GLY 79 -2.325 26.790 -19.031 564 1HA GLY 79 2HA GLY 79 -1.804 29.654 -18.502 565 2HA GLY 79 1HA GLY 79 -0.909 28.661 -19.635 566 H VAL 80 H VAL 80 -1.263 26.332 -17.523 567 HA VAL 80 HA VAL 80 0.444 27.270 -15.395 568 HB VAL 80 HB VAL 80 -0.414 24.435 -15.927 569 1HG1 VAL 80 3HG1 VAL 80 0.985 25.791 -13.827 570 2HG1 VAL 80 1HG1 VAL 80 -0.570 25.204 -13.189 571 3HG1 VAL 80 2HG1 VAL 80 0.563 24.067 -13.958 572 1HG2 VAL 80 1HG2 VAL 80 -2.132 26.736 -15.413 573 2HG2 VAL 80 2HG2 VAL 80 -2.561 25.063 -15.843 574 3HG2 VAL 80 3HG2 VAL 80 -2.272 25.498 -14.142 575 H GLN 81 H GLN 81 2.409 27.852 -16.404 576 HA GLN 81 HA GLN 81 3.964 25.540 -17.155 577 1HB GLN 81 1HB GLN 81 2.898 27.004 -19.181 578 2HB GLN 81 2HB GLN 81 4.347 27.947 -18.898 579 1HG GLN 81 1HG GLN 81 5.732 26.310 -19.716 580 2HG GLN 81 2HG GLN 81 4.841 25.022 -18.929 581 1HE2 GLN 81 1HE2 GLN 81 4.210 23.612 -20.365 582 2HE2 GLN 81 2HE2 GLN 81 3.479 23.930 -21.903 583 H TYR 82 H TYR 82 3.566 27.890 -15.040 584 HA TYR 82 HA TYR 82 6.409 28.197 -14.602 585 1HB TYR 82 1HB TYR 82 6.190 30.676 -14.539 586 2HB TYR 82 2HB TYR 82 5.619 30.118 -16.099 587 HD1 TYR 82 1HD TYR 82 4.854 32.118 -13.282 588 HD2 TYR 82 2HD TYR 82 3.022 29.666 -16.271 589 HE1 TYR 82 1HE TYR 82 2.634 33.298 -12.899 590 HE2 TYR 82 2HE TYR 82 0.808 30.854 -15.878 591 HH TYR 82 HH TYR 82 0.557 33.731 -14.340 592 H SER 83 H SER 83 5.967 26.868 -12.742 593 HA SER 83 HA SER 83 4.820 28.448 -10.611 594 1HB SER 83 1HB SER 83 2.910 27.134 -11.098 595 2HB SER 83 2HB SER 83 3.861 25.715 -11.488 596 HG SER 83 HG SER 83 3.606 26.867 -8.840 597 H ARG 84 H ARG 84 6.295 25.233 -11.476 598 HA ARG 84 HA ARG 84 7.667 25.215 -8.972 599 1HB ARG 84 1HB ARG 84 6.682 23.178 -10.336 600 2HB ARG 84 2HB ARG 84 8.165 23.276 -11.264 601 1HG ARG 84 1HG ARG 84 9.043 21.924 -9.647 602 2HG ARG 84 2HG ARG 84 9.161 23.388 -8.691 603 1HD ARG 84 1HD ARG 84 6.459 22.198 -8.576 604 2HD ARG 84 2HD ARG 84 7.695 21.089 -8.015 605 HE ARG 84 HE ARG 84 8.415 23.368 -6.703 606 2HH1 ARG 84 1HH ARG 84 6.064 23.754 -4.175 607 1HH2 ARG 84 2HH2 ARG 84 5.256 21.806 -7.066 608 2HH2 ARG 84 1HH2 ARG 84 4.656 22.386 -5.549 609 H ALA 85 H ALA 85 8.161 27.158 -11.433 610 HA ALA 85 HA ALA 85 10.834 26.529 -12.230 611 1HB ALA 85 2HB ALA 85 9.247 29.111 -12.517 612 2HB ALA 85 1HB ALA 85 9.147 27.736 -13.642 613 3HB ALA 85 3HB ALA 85 10.679 28.624 -13.455 614 H ASP 86 H ASP 86 11.117 26.282 -9.618 615 HA ASP 86 HA ASP 86 12.454 28.756 -8.897 616 1HB ASP 86 1HB ASP 86 10.426 27.183 -7.301 617 2HB ASP 86 2HB ASP 86 11.735 27.960 -6.435 618 HD2 ASP 86 HD ASP 86 11.277 30.360 -6.068 619 H GLU 87 H GLU 87 11.770 25.341 -7.791 620 HA GLU 87 HA GLU 87 14.204 25.000 -6.531 621 1HB GLU 87 1HB GLU 87 11.874 23.547 -6.781 622 2HB GLU 87 2HB GLU 87 12.977 22.568 -7.728 623 1HG GLU 87 1HG GLU 87 14.410 23.335 -5.372 624 2HG GLU 87 2HG GLU 87 12.814 22.848 -4.837 625 HE2 GLU 87 HE GLU 87 14.985 21.526 -4.293 626 H GLU 88 H GLU 88 13.135 24.352 -9.909 627 HA GLU 88 HA GLU 88 15.333 22.933 -10.725 628 1HB GLU 88 1HB GLU 88 13.054 24.233 -11.929 629 2HB GLU 88 2HB GLU 88 14.470 24.613 -12.889 630 1HG GLU 88 1HG GLU 88 14.945 21.970 -12.526 631 2HG GLU 88 2HG GLU 88 13.202 21.939 -12.345 632 HE2 GLU 88 HE GLU 88 14.761 21.338 -15.400 633 H GLN 89 H GLN 89 14.708 26.490 -11.217 634 HA GLN 89 HA GLN 89 17.525 26.815 -11.727 635 1HB GLN 89 1HB GLN 89 15.117 28.121 -12.581 636 2HB GLN 89 2HB GLN 89 16.073 29.316 -11.726 637 1HG GLN 89 1HG GLN 89 17.831 27.742 -13.422 638 2HG GLN 89 2HG GLN 89 16.479 28.314 -14.380 639 1HE2 GLN 89 1HE2 GLN 89 19.432 29.070 -12.940 640 2HE2 GLN 89 2HE2 GLN 89 19.467 30.782 -13.204 641 H GLN 90 H GLN 90 16.356 26.130 -8.994 642 HA GLN 90 HA GLN 90 16.143 28.115 -7.264 643 1HB GLN 90 1HB GLN 90 16.133 25.682 -6.706 644 2HB GLN 90 2HB GLN 90 17.878 25.639 -6.855 645 1HG GLN 90 1HG GLN 90 17.613 25.933 -4.541 646 2HG GLN 90 2HG GLN 90 17.852 27.584 -5.079 647 1HE2 GLN 90 1HE2 GLN 90 16.168 25.861 -3.008 648 2HE2 GLN 90 2HE2 GLN 90 14.651 26.696 -2.950 649 H GLN 91 H GLN 91 19.409 26.573 -7.677 650 HA GLN 91 HA GLN 91 20.539 29.168 -7.052 651 1HB GLN 91 1HB GLN 91 21.119 26.754 -5.978 652 2HB GLN 91 2HB GLN 91 22.254 26.716 -7.312 653 1HG GLN 91 1HG GLN 91 22.785 29.220 -6.452 654 2HG GLN 91 2HG GLN 91 22.165 28.577 -4.944 655 1HE2 GLN 91 1HE2 GLN 91 24.843 28.969 -6.851 656 2HE2 GLN 91 2HE2 GLN 91 25.910 27.789 -6.165 657 H ALA 92 H ALA 92 21.606 26.380 -9.133 658 HA ALA 92 HA ALA 92 22.038 28.336 -11.283 659 1HB ALA 92 2HB ALA 92 24.192 27.792 -10.270 660 2HB ALA 92 3HB ALA 92 23.846 26.050 -10.398 661 3HB ALA 92 1HB ALA 92 24.081 27.022 -11.871 662 H LEU 93 H LEU 93 22.389 24.744 -10.915 663 HA LEU 93 HA LEU 93 20.312 24.491 -12.977 664 1HB LEU 93 1HB LEU 93 21.557 22.501 -13.775 665 2HB LEU 93 2HB LEU 93 22.360 24.035 -14.047 666 HG LEU 93 HG LEU 93 23.479 23.315 -11.670 667 1HD1 LEU 93 2HD1 LEU 93 22.142 20.993 -12.435 668 2HD1 LEU 93 3HD1 LEU 93 23.837 20.709 -12.899 669 3HD1 LEU 93 1HD1 LEU 93 23.434 21.139 -11.220 670 1HD2 LEU 93 3HD2 LEU 93 24.265 23.082 -14.526 671 2HD2 LEU 93 1HD2 LEU 93 25.012 23.995 -13.192 672 3HD2 LEU 93 2HD2 LEU 93 25.285 22.242 -13.333 673 H SER 94 H SER 94 22.150 22.447 -10.593 674 HA SER 94 HA SER 94 19.633 21.806 -9.359 675 1HB SER 94 1HB SER 94 21.352 19.797 -10.838 676 2HB SER 94 2HB SER 94 20.401 19.283 -9.459 677 HG SER 94 HG SER 94 19.568 20.046 -12.040 678 H SER 95 H SER 95 22.063 23.325 -8.633 679 HA SER 95 HA SER 95 23.980 22.105 -7.291 680 1HB SER 95 1HB SER 95 23.993 24.051 -5.724 681 2HB SER 95 2HB SER 95 23.798 24.535 -7.397 682 HG SER 95 HG SER 95 21.945 24.649 -5.247 683 H GLN 96 H GLN 96 20.544 22.115 -6.467 684 HA GLN 96 HA GLN 96 21.066 21.127 -3.820 685 1HB GLN 96 1HB GLN 96 18.969 22.558 -5.015 686 2HB GLN 96 2HB GLN 96 18.283 20.965 -4.766 687 1HG GLN 96 1HG GLN 96 18.900 21.021 -2.376 688 2HG GLN 96 2HG GLN 96 19.732 22.548 -2.593 689 1HE2 GLN 96 1HE2 GLN 96 16.817 20.999 -1.904 690 2HE2 GLN 96 2HE2 GLN 96 15.743 22.358 -1.922 691 H MET 97 H MET 97 22.022 19.580 -6.175 692 HA MET 97 HA MET 97 20.418 17.187 -5.704 693 1HB MET 97 1HB MET 97 20.087 17.964 -8.023 694 2HB MET 97 2HB MET 97 21.812 18.170 -8.252 695 1HG MET 97 1HG MET 97 21.401 16.091 -9.300 696 2HG MET 97 2HG MET 97 21.989 15.607 -7.721 697 1HE MET 97 2HE MET 97 21.204 13.564 -8.544 698 2HE MET 97 3HE MET 97 20.066 12.992 -7.301 699 3HE MET 97 1HE MET 97 19.540 13.122 -8.996 700 H GLY 98 H GLY 98 21.615 15.916 -4.341 701 1HA GLY 98 2HA GLY 98 24.438 16.081 -4.142 702 2HA GLY 98 1HA GLY 98 23.985 14.706 -5.129 703 H PHE 99 H PHE 99 24.668 13.134 -3.587 704 HA PHE 99 HA PHE 99 22.700 12.617 -1.564 705 1HB PHE 99 1HB PHE 99 25.330 11.296 -2.463 706 2HB PHE 99 2HB PHE 99 24.261 10.576 -1.276 707 HD1 PHE 99 1HD PHE 99 22.004 9.789 -1.964 708 HD2 PHE 99 2HD PHE 99 24.851 11.161 -4.797 709 HE1 PHE 99 1HE PHE 99 20.709 8.677 -3.805 710 HE2 PHE 99 2HE PHE 99 23.556 10.049 -6.637 711 HZ PHE 99 HZ PHE 99 21.501 8.820 -6.119 712 H MET 601 H MET 601 9.589 -18.166 -19.522 713 HA MET 601 HA MET 601 7.989 -18.270 -21.280 714 1HB MET 601 1HB MET 601 10.939 -18.267 -21.741 715 2HB MET 601 2HB MET 601 10.011 -18.592 -23.191 716 1HG MET 601 1HG MET 601 9.839 -16.312 -23.343 717 2HG MET 601 2HG MET 601 8.575 -16.483 -22.141 718 1HE MET 601 1HE MET 601 8.831 -14.182 -21.544 719 2HE MET 601 2HE MET 601 8.761 -14.896 -19.915 720 3HE MET 601 3HE MET 601 9.939 -13.612 -20.274 721 H THR 602 H THR 602 7.219 -20.641 -20.513 722 HA THR 602 HA THR 602 8.174 -22.862 -21.943 723 HB THR 602 HB THR 602 5.550 -22.191 -20.522 724 HG1 THR 602 1HG THR 602 7.914 -23.862 -20.023 725 1HG2 THR 602 3HG2 THR 602 6.184 -24.470 -22.235 726 2HG2 THR 602 1HG2 THR 602 6.073 -24.998 -20.539 727 3HG2 THR 602 2HG2 THR 602 4.699 -24.163 -21.303 728 H GLU 603 H GLU 603 5.401 -20.625 -22.578 729 HA GLU 603 HA GLU 603 5.685 -21.366 -25.360 730 1HB GLU 603 1HB GLU 603 3.088 -21.540 -23.777 731 2HB GLU 603 2HB GLU 603 3.131 -21.490 -25.528 732 1HG GLU 603 1HG GLU 603 4.050 -23.622 -25.716 733 2HG GLU 603 2HG GLU 603 4.926 -23.501 -24.203 734 HE2 GLU 603 HE GLU 603 3.238 -25.888 -24.226 735 H GLN 604 H GLN 604 6.130 -19.437 -26.335 736 HA GLN 604 HA GLN 604 5.736 -17.001 -25.220 737 1HB GLN 604 1HB GLN 604 6.433 -18.067 -27.861 738 2HB GLN 604 2HB GLN 604 5.542 -16.564 -28.002 739 1HG GLN 604 1HG GLN 604 7.185 -15.709 -26.108 740 2HG GLN 604 2HG GLN 604 8.179 -17.069 -26.592 741 1HE2 GLN 604 1HE2 GLN 604 6.744 -14.039 -27.553 742 2HE2 GLN 604 2HE2 GLN 604 7.700 -13.745 -28.966 743 H GLN 605 H GLN 605 3.563 -18.813 -27.474 744 HA GLN 605 HA GLN 605 1.726 -16.988 -28.052 745 1HB GLN 605 1HB GLN 605 1.100 -19.829 -27.133 746 2HB GLN 605 2HB GLN 605 0.071 -18.832 -28.142 747 1HG GLN 605 1HG GLN 605 2.494 -18.722 -29.510 748 2HG GLN 605 2HG GLN 605 2.519 -20.350 -28.861 749 1HE2 GLN 605 1HE2 GLN 605 1.291 -21.894 -29.722 750 2HE2 GLN 605 2HE2 GLN 605 0.151 -21.686 -31.010 751 H TRP 606 H TRP 606 1.799 -18.934 -24.985 752 HA TRP 606 HA TRP 606 0.579 -16.718 -23.598 753 1HB TRP 606 1HB TRP 606 -1.342 -17.836 -22.814 754 2HB TRP 606 2HB TRP 606 -1.345 -17.971 -24.561 755 HD1 TRP 606 HD TRP 606 -0.426 -20.516 -25.503 756 HE1 TRP 606 1HE TRP 606 -0.855 -22.947 -24.571 757 HE3 TRP 606 3HE TRP 606 -1.722 -19.054 -20.809 758 HZ2 TRP 606 2HZ TRP 606 -1.671 -23.963 -22.032 759 HZ3 TRP 606 3HZ TRP 606 -2.321 -20.828 -19.164 760 HH2 TRP 606 HH TRP 606 -2.310 -23.211 -19.711 761 H ASN 607 H ASN 607 2.327 -16.566 -22.198 762 HA ASN 607 HA ASN 607 3.692 -18.839 -21.303 763 1HB ASN 607 1HB ASN 607 4.762 -16.606 -21.392 764 2HB ASN 607 2HB ASN 607 3.601 -15.965 -20.245 765 1HD2 ASN 607 1HD2 ASN 607 6.000 -18.555 -20.648 766 2HD2 ASN 607 2HD2 ASN 607 6.590 -18.569 -19.019 767 H PHE 608 H PHE 608 3.334 -20.089 -19.423 768 HA PHE 608 HA PHE 608 0.854 -19.937 -18.157 769 1HB PHE 608 1HB PHE 608 3.486 -21.375 -17.948 770 2HB PHE 608 2HB PHE 608 2.564 -21.356 -16.457 771 HD1 PHE 608 1HD PHE 608 -0.058 -21.923 -16.881 772 HD2 PHE 608 2HD PHE 608 3.182 -23.205 -19.303 773 HE1 PHE 608 1HE PHE 608 -1.439 -23.847 -17.710 774 HE2 PHE 608 2HE PHE 608 1.800 -25.129 -20.132 775 HZ PHE 608 HZ PHE 608 -0.494 -25.428 -19.326 776 H ALA 609 H ALA 609 4.182 -19.120 -16.936 777 HA ALA 609 HA ALA 609 3.273 -18.179 -14.456 778 1HB ALA 609 3HB ALA 609 5.556 -17.227 -14.304 779 2HB ALA 609 2HB ALA 609 5.799 -17.550 -16.038 780 3HB ALA 609 1HB ALA 609 5.582 -18.903 -14.902 781 H GLY 610 H GLY 610 2.883 -16.941 -17.625 782 1HA GLY 610 2HA GLY 610 2.664 -14.774 -18.412 783 2HA GLY 610 1HA GLY 610 2.860 -14.142 -16.789 784 H ILE 611 H ILE 611 0.605 -16.474 -18.450 785 HA ILE 611 HA ILE 611 -1.628 -14.801 -18.080 786 HB ILE 611 HB ILE 611 -1.327 -16.525 -19.847 787 1HG1 ILE 611 1HG1 ILE 611 -3.564 -15.488 -18.951 788 2HG1 ILE 611 2HG1 ILE 611 -3.587 -16.783 -20.132 789 1HG2 ILE 611 1HG2 ILE 611 -1.384 -18.311 -17.477 790 2HG2 ILE 611 2HG2 ILE 611 -2.289 -18.854 -18.911 791 3HG2 ILE 611 3HG2 ILE 611 -0.551 -18.490 -19.040 792 1HD1 ILE 611 1HD1 ILE 611 -3.491 -17.741 -17.325 793 2HD1 ILE 611 2HD1 ILE 611 -4.957 -16.819 -17.734 794 3HD1 ILE 611 3HD1 ILE 611 -4.527 -18.269 -18.672 795 H GLU 612 H GLU 612 0.124 -16.955 -15.980 796 HA GLU 612 HA GLU 612 -2.099 -17.522 -14.310 797 1HB GLU 612 1HB GLU 612 -0.270 -19.113 -14.399 798 2HB GLU 612 2HB GLU 612 0.906 -17.884 -13.979 799 1HG GLU 612 1HG GLU 612 0.616 -18.789 -11.872 800 2HG GLU 612 2HG GLU 612 -0.683 -17.615 -11.816 801 HE2 GLU 612 HE GLU 612 -1.307 -20.199 -10.342 802 H ALA 613 H ALA 613 0.907 -15.498 -13.950 803 HA ALA 613 HA ALA 613 -0.131 -14.247 -11.597 804 1HB ALA 613 3HB ALA 613 1.963 -13.051 -11.611 805 2HB ALA 613 2HB ALA 613 2.240 -13.443 -13.325 806 3HB ALA 613 1HB ALA 613 2.304 -14.729 -12.096 807 H ALA 614 H ALA 614 -0.536 -13.866 -15.013 808 HA ALA 614 HA ALA 614 -0.721 -11.154 -15.345 809 1HB ALA 614 2HB ALA 614 -2.012 -13.574 -16.563 810 2HB ALA 614 3HB ALA 614 -2.661 -11.973 -16.989 811 3HB ALA 614 1HB ALA 614 -0.951 -12.353 -17.306 812 H ALA 615 H ALA 615 -3.291 -13.460 -14.220 813 HA ALA 615 HA ALA 615 -5.306 -11.607 -13.907 814 1HB ALA 615 2HB ALA 615 -6.378 -13.467 -13.239 815 2HB ALA 615 3HB ALA 615 -4.828 -14.335 -13.359 816 3HB ALA 615 1HB ALA 615 -5.329 -13.618 -11.809 817 H SER 616 H SER 616 -2.819 -12.718 -11.505 818 HA SER 616 HA SER 616 -3.672 -11.198 -9.416 819 1HB SER 616 1HB SER 616 -1.508 -12.869 -9.963 820 2HB SER 616 2HB SER 616 -0.727 -11.329 -9.665 821 HG SER 616 HG SER 616 -2.773 -12.188 -7.858 822 H ALA 617 H ALA 617 -1.905 -10.271 -12.354 823 HA ALA 617 HA ALA 617 -1.021 -7.755 -11.344 824 1HB ALA 617 3HB ALA 617 -0.380 -9.383 -13.472 825 2HB ALA 617 2HB ALA 617 0.125 -7.685 -13.299 826 3HB ALA 617 1HB ALA 617 -1.313 -8.093 -14.266 827 H ILE 618 H ILE 618 -3.817 -8.983 -13.256 828 HA ILE 618 HA ILE 618 -4.872 -6.508 -13.944 829 HB ILE 618 HB ILE 618 -6.219 -9.165 -13.453 830 1HG1 ILE 618 1HG1 ILE 618 -4.422 -9.184 -15.158 831 2HG1 ILE 618 2HG1 ILE 618 -6.008 -9.526 -15.819 832 1HG2 ILE 618 3HG2 ILE 618 -7.854 -7.363 -13.338 833 2HG2 ILE 618 1HG2 ILE 618 -7.264 -6.706 -14.884 834 3HG2 ILE 618 2HG2 ILE 618 -8.051 -8.302 -14.838 835 1HD1 ILE 618 1HD1 ILE 618 -5.535 -6.653 -15.860 836 2HD1 ILE 618 2HD1 ILE 618 -4.199 -7.511 -16.663 837 3HD1 ILE 618 3HD1 ILE 618 -5.873 -7.752 -17.218 838 H GLN 619 H GLN 619 -5.328 -8.566 -11.013 839 HA GLN 619 HA GLN 619 -7.300 -7.059 -9.856 840 1HB GLN 619 1HB GLN 619 -5.436 -9.154 -9.060 841 2HB GLN 619 2HB GLN 619 -5.642 -8.008 -7.751 842 1HG GLN 619 1HG GLN 619 -8.017 -9.177 -9.260 843 2HG GLN 619 2HG GLN 619 -7.323 -9.973 -7.862 844 1HE2 GLN 619 1HE2 GLN 619 -9.917 -8.510 -8.519 845 2HE2 GLN 619 2HE2 GLN 619 -10.173 -7.427 -7.191 846 H GLY 620 H GLY 620 -3.762 -6.964 -8.982 847 1HA GLY 620 2HA GLY 620 -2.450 -5.270 -8.303 848 2HA GLY 620 1HA GLY 620 -3.843 -4.701 -7.404 849 H ASN 621 H ASN 621 -3.835 -5.028 -10.968 850 HA ASN 621 HA ASN 621 -3.132 -2.332 -11.400 851 1HB ASN 621 1HB ASN 621 -4.224 -4.595 -13.107 852 2HB ASN 621 2HB ASN 621 -4.200 -2.972 -13.766 853 1HD2 ASN 621 1HD2 ASN 621 -1.991 -1.818 -12.964 854 2HD2 ASN 621 2HD2 ASN 621 -0.558 -2.664 -13.447 855 H VAL 622 H VAL 622 -6.142 -4.282 -11.130 856 HA VAL 622 HA VAL 622 -7.939 -2.403 -12.123 857 HB VAL 622 HB VAL 622 -8.132 -4.698 -10.186 858 1HG1 VAL 622 3HG1 VAL 622 -10.266 -2.722 -10.972 859 2HG1 VAL 622 1HG1 VAL 622 -10.685 -4.417 -10.627 860 3HG1 VAL 622 2HG1 VAL 622 -9.903 -3.422 -9.376 861 1HG2 VAL 622 2HG2 VAL 622 -8.087 -4.470 -13.009 862 2HG2 VAL 622 3HG2 VAL 622 -8.392 -5.924 -12.029 863 3HG2 VAL 622 1HG2 VAL 622 -9.753 -4.905 -12.557 864 H THR 623 H THR 623 -6.930 -3.097 -8.700 865 HA THR 623 HA THR 623 -8.395 -0.956 -7.613 866 HB THR 623 HB THR 623 -6.939 -1.461 -5.615 867 HG1 THR 623 1HG THR 623 -4.980 -1.881 -6.833 868 1HG2 THR 623 2HG2 THR 623 -8.854 -3.080 -6.382 869 2HG2 THR 623 3HG2 THR 623 -7.541 -4.098 -7.020 870 3HG2 THR 623 1HG2 THR 623 -7.619 -3.734 -5.279 871 H SER 624 H SER 624 -5.104 -1.194 -8.993 872 HA SER 624 HA SER 624 -4.060 1.109 -8.025 873 1HB SER 624 1HB SER 624 -3.753 -0.247 -10.728 874 2HB SER 624 2HB SER 624 -2.808 1.165 -10.300 875 HG SER 624 HG SER 624 -2.457 -1.459 -9.540 876 H ILE 625 H ILE 625 -6.287 0.618 -10.823 877 HA ILE 625 HA ILE 625 -6.229 3.355 -11.590 878 HB ILE 625 HB ILE 625 -7.584 0.869 -12.413 879 1HG1 ILE 625 1HG1 ILE 625 -7.125 2.434 -14.631 880 2HG1 ILE 625 2HG1 ILE 625 -5.867 2.980 -13.540 881 1HG2 ILE 625 1HG2 ILE 625 -8.918 3.555 -12.600 882 2HG2 ILE 625 2HG2 ILE 625 -9.136 2.347 -13.889 883 3HG2 ILE 625 3HG2 ILE 625 -9.614 1.962 -12.218 884 1HD1 ILE 625 3HD1 ILE 625 -6.425 0.054 -14.211 885 2HD1 ILE 625 1HD1 ILE 625 -5.131 1.041 -14.933 886 3HD1 ILE 625 2HD1 ILE 625 -5.097 0.662 -13.194 887 H HIS 626 H HIS 626 -8.186 1.322 -9.401 888 HA HIS 626 HA HIS 626 -10.296 3.111 -9.086 889 1HB HIS 626 1HB HIS 626 -10.126 0.657 -8.405 890 2HB HIS 626 2HB HIS 626 -9.256 1.201 -6.984 891 HD1 HIS 626 1HD HIS 626 -11.355 0.111 -5.668 892 HD2 HIS 626 2HD HIS 626 -12.156 3.577 -7.891 893 HE1 HIS 626 1HE HIS 626 -13.593 1.000 -4.825 894 H SER 627 H SER 627 -7.192 2.692 -7.271 895 HA SER 627 HA SER 627 -7.812 4.828 -5.529 896 1HB SER 627 1HB SER 627 -5.558 2.940 -5.975 897 2HB SER 627 2HB SER 627 -5.077 4.498 -5.334 898 HG SER 627 HG SER 627 -7.077 4.009 -3.808 899 H LEU 628 H LEU 628 -5.967 4.388 -8.574 900 HA LEU 628 HA LEU 628 -4.587 6.786 -8.586 901 1HB LEU 628 1HB LEU 628 -5.442 4.763 -10.559 902 2HB LEU 628 2HB LEU 628 -5.091 6.349 -11.215 903 HG LEU 628 HG LEU 628 -3.104 5.082 -9.360 904 1HD1 LEU 628 1HD1 LEU 628 -4.019 3.815 -11.748 905 2HD1 LEU 628 2HD1 LEU 628 -2.370 4.425 -12.029 906 3HD1 LEU 628 3HD1 LEU 628 -2.695 3.335 -10.660 907 1HD2 LEU 628 3HD2 LEU 628 -3.055 7.480 -10.418 908 2HD2 LEU 628 1HD2 LEU 628 -1.571 6.501 -10.322 909 3HD2 LEU 628 2HD2 LEU 628 -2.466 6.613 -11.857 910 H LEU 629 H LEU 629 -7.868 5.998 -9.921 911 HA LEU 629 HA LEU 629 -8.392 8.590 -10.812 912 1HB LEU 629 1HB LEU 629 -9.817 6.069 -10.459 913 2HB LEU 629 2HB LEU 629 -10.843 7.464 -10.192 914 HG LEU 629 HG LEU 629 -9.293 7.903 -12.573 915 1HD1 LEU 629 2HD1 LEU 629 -10.659 5.213 -12.392 916 2HD1 LEU 629 3HD1 LEU 629 -10.341 6.041 -13.936 917 3HD1 LEU 629 1HD1 LEU 629 -8.986 5.580 -12.878 918 1HD2 LEU 629 1HD2 LEU 629 -11.587 8.798 -11.779 919 2HD2 LEU 629 2HD2 LEU 629 -11.343 8.463 -13.510 920 3HD2 LEU 629 3HD2 LEU 629 -12.241 7.307 -12.499 921 H ASP 630 H ASP 630 -8.714 7.004 -7.627 922 HA ASP 630 HA ASP 630 -10.341 8.915 -6.475 923 1HB ASP 630 1HB ASP 630 -8.723 6.643 -5.647 924 2HB ASP 630 2HB ASP 630 -8.498 7.950 -4.502 925 HD2 ASP 630 HD ASP 630 -11.294 7.528 -2.896 926 H GLU 631 H GLU 631 -6.825 8.704 -7.100 927 HA GLU 631 HA GLU 631 -6.188 10.877 -5.390 928 1HB GLU 631 1HB GLU 631 -4.717 9.096 -7.303 929 2HB GLU 631 2HB GLU 631 -3.987 10.651 -6.958 930 1HG GLU 631 1HG GLU 631 -4.739 8.485 -4.947 931 2HG GLU 631 2HG GLU 631 -3.127 9.045 -5.345 932 HE2 GLU 631 HE GLU 631 -3.588 12.079 -3.534 933 H GLY 632 H GLY 632 -6.802 10.374 -8.895 934 1HA GLY 632 2HA GLY 632 -6.925 11.829 -10.620 935 2HA GLY 632 1HA GLY 632 -6.042 13.013 -9.676 936 H LYS 633 H LYS 633 -9.123 11.364 -8.764 937 HA LYS 633 HA LYS 633 -10.917 13.241 -9.603 938 1HB LYS 633 1HB LYS 633 -11.227 10.928 -8.461 939 2HB LYS 633 2HB LYS 633 -11.211 11.826 -6.957 940 1HG LYS 633 1HG LYS 633 -13.526 11.605 -7.699 941 2HG LYS 633 2HG LYS 633 -13.062 13.289 -7.831 942 1HD LYS 633 1HD LYS 633 -12.333 12.158 -10.322 943 2HD LYS 633 2HD LYS 633 -13.876 11.420 -9.942 944 1HE LYS 633 1HE LYS 633 -14.290 14.100 -9.244 945 2HE LYS 633 2HE LYS 633 -13.263 14.226 -10.659 946 H GLN 634 H GLN 634 -8.739 13.299 -6.762 947 HA GLN 634 HA GLN 634 -9.973 15.528 -5.593 948 1HB GLN 634 1HB GLN 634 -7.245 14.228 -5.274 949 2HB GLN 634 2HB GLN 634 -7.682 15.662 -4.368 950 1HG GLN 634 1HG GLN 634 -9.598 13.324 -4.372 951 2HG GLN 634 2HG GLN 634 -8.150 13.214 -3.391 952 1HE2 GLN 634 1HE2 GLN 634 -10.459 13.124 -2.111 953 2HE2 GLN 634 2HE2 GLN 634 -10.805 14.582 -1.243 954 H SER 635 H SER 635 -7.528 15.065 -8.127 955 HA SER 635 HA SER 635 -6.650 17.764 -8.009 956 1HB SER 635 1HB SER 635 -5.801 15.329 -9.251 957 2HB SER 635 2HB SER 635 -6.058 16.484 -10.543 958 HG SER 635 HG SER 635 -4.270 16.662 -8.296 959 H LEU 636 H LEU 636 -9.330 16.029 -9.380 960 HA LEU 636 HA LEU 636 -9.753 17.583 -11.682 961 1HB LEU 636 1HB LEU 636 -11.048 15.455 -10.226 962 2HB LEU 636 2HB LEU 636 -12.227 16.648 -10.734 963 HG LEU 636 HG LEU 636 -11.911 14.765 -12.332 964 1HD1 LEU 636 1HD1 LEU 636 -11.272 17.551 -13.332 965 2HD1 LEU 636 2HD1 LEU 636 -11.753 16.188 -14.371 966 3HD1 LEU 636 3HD1 LEU 636 -12.879 16.808 -13.139 967 1HD2 LEU 636 2HD2 LEU 636 -9.513 14.410 -12.022 968 2HD2 LEU 636 3HD2 LEU 636 -9.912 14.678 -13.736 969 3HD2 LEU 636 1HD2 LEU 636 -9.172 15.984 -12.779 970 H THR 637 H THR 637 -11.123 17.765 -8.327 971 HA THR 637 HA THR 637 -12.544 20.168 -8.902 972 HB THR 637 HB THR 637 -13.466 18.826 -7.177 973 HG1 THR 637 1HG THR 637 -13.464 20.683 -5.971 974 1HG2 THR 637 1HG2 THR 637 -10.572 18.479 -6.323 975 2HG2 THR 637 2HG2 THR 637 -11.871 18.298 -5.120 976 3HG2 THR 637 3HG2 THR 637 -11.824 17.234 -6.546 977 H LYS 638 H LYS 638 -9.271 19.381 -7.788 978 HA LYS 638 HA LYS 638 -8.781 22.058 -6.889 979 1HB LYS 638 1HB LYS 638 -7.019 19.627 -7.278 980 2HB LYS 638 2HB LYS 638 -6.405 21.175 -6.733 981 1HG LYS 638 1HG LYS 638 -8.197 21.097 -4.879 982 2HG LYS 638 2HG LYS 638 -8.496 19.436 -5.353 983 1HD LYS 638 1HD LYS 638 -5.792 20.546 -4.457 984 2HD LYS 638 2HD LYS 638 -6.875 19.603 -3.452 985 1HE LYS 638 1HE LYS 638 -6.564 18.087 -5.841 986 2HE LYS 638 2HE LYS 638 -4.960 18.681 -5.461 987 H LEU 639 H LEU 639 -8.613 20.230 -9.898 988 HA LEU 639 HA LEU 639 -6.981 22.307 -11.122 989 1HB LEU 639 1HB LEU 639 -7.986 19.640 -12.120 990 2HB LEU 639 2HB LEU 639 -7.071 20.773 -13.094 991 HG LEU 639 HG LEU 639 -5.961 19.779 -10.478 992 1HD1 LEU 639 1HD1 LEU 639 -6.712 17.824 -11.878 993 2HD1 LEU 639 2HD1 LEU 639 -5.547 18.355 -13.114 994 3HD1 LEU 639 3HD1 LEU 639 -4.974 17.874 -11.499 995 1HD2 LEU 639 3HD2 LEU 639 -5.059 21.676 -12.191 996 2HD2 LEU 639 1HD2 LEU 639 -4.015 20.699 -11.131 997 3HD2 LEU 639 2HD2 LEU 639 -4.237 20.234 -12.834 998 H ALA 640 H ALA 640 -10.264 21.545 -10.485 999 HA ALA 640 HA ALA 640 -11.626 22.193 -12.738 1000 1HB ALA 640 3HB ALA 640 -12.566 21.490 -10.527 1001 2HB ALA 640 2HB ALA 640 -13.424 22.876 -11.244 1002 3HB ALA 640 1HB ALA 640 -12.268 23.135 -9.915 1003 H ALA 641 H ALA 641 -10.006 24.415 -10.405 1004 HA ALA 641 HA ALA 641 -10.952 26.803 -11.404 1005 1HB ALA 641 3HB ALA 641 -9.138 25.937 -9.478 1006 2HB ALA 641 2HB ALA 641 -9.534 27.631 -9.854 1007 3HB ALA 641 1HB ALA 641 -8.123 26.857 -10.615 1008 H ALA 642 H ALA 642 -8.587 24.511 -12.718 1009 HA ALA 642 HA ALA 642 -7.305 26.274 -14.482 1010 1HB ALA 642 1HB ALA 642 -6.702 23.866 -13.694 1011 2HB ALA 642 3HB ALA 642 -6.333 24.325 -15.373 1012 3HB ALA 642 2HB ALA 642 -7.767 23.332 -15.016 1013 H TRP 643 H TRP 643 -10.452 24.660 -14.500 1014 HA TRP 643 HA TRP 643 -10.826 25.088 -17.328 1015 1HB TRP 643 1HB TRP 643 -12.465 23.915 -15.103 1016 2HB TRP 643 2HB TRP 643 -13.219 24.348 -16.625 1017 HD1 TRP 643 HD TRP 643 -12.766 22.712 -18.700 1018 HE1 TRP 643 1HE TRP 643 -11.604 20.370 -19.059 1019 HE3 TRP 643 3HE TRP 643 -10.438 22.586 -14.181 1020 HZ2 TRP 643 2HZ TRP 643 -9.880 18.764 -17.449 1021 HZ3 TRP 643 3HZ TRP 643 -9.034 20.595 -13.654 1022 HH2 TRP 643 HH TRP 643 -8.736 18.727 -15.202 1023 H GLY 644 H GLY 644 -11.731 26.521 -14.157 1024 1HA GLY 644 2HA GLY 644 -13.120 28.701 -15.582 1025 2HA GLY 644 1HA GLY 644 -11.834 29.044 -14.443 1026 H GLY 645 H GLY 645 -12.114 27.786 -12.206 1027 1HA GLY 645 2HA GLY 645 -14.718 28.574 -11.207 1028 2HA GLY 645 1HA GLY 645 -13.326 28.046 -10.282 1029 H SER 646 H SER 646 -14.339 26.464 -9.009 1030 HA SER 646 HA SER 646 -14.773 24.000 -10.344 1031 1HB SER 646 1HB SER 646 -15.471 23.373 -7.852 1032 2HB SER 646 2HB SER 646 -13.791 23.627 -8.279 1033 HG SER 646 HG SER 646 -15.086 24.875 -6.369 1034 H GLY 647 H GLY 647 -16.717 26.713 -9.265 1035 1HA GLY 647 2HA GLY 647 -18.988 26.823 -8.785 1036 2HA GLY 647 1HA GLY 647 -19.194 25.153 -9.275 1037 H SER 648 H SER 648 -17.568 25.508 -11.793 1038 HA SER 648 HA SER 648 -19.460 27.192 -13.236 1039 1HB SER 648 1HB SER 648 -16.530 26.771 -13.455 1040 2HB SER 648 2HB SER 648 -17.365 26.738 -14.995 1041 HG SER 648 HG SER 648 -18.241 28.827 -14.562 1042 H GLU 649 H GLU 649 -20.269 26.377 -15.320 1043 HA GLU 649 HA GLU 649 -20.892 23.669 -15.199 1044 1HB GLU 649 1HB GLU 649 -21.884 24.072 -17.483 1045 2HB GLU 649 2HB GLU 649 -22.410 25.220 -16.268 1046 1HG GLU 649 1HG GLU 649 -21.577 26.952 -17.471 1047 2HG GLU 649 2HG GLU 649 -19.981 26.228 -17.482 1048 HE2 GLU 649 HE GLU 649 -20.430 25.950 -20.907 1049 H ALA 650 H ALA 650 -18.264 25.491 -16.723 1050 HA ALA 650 HA ALA 650 -17.494 23.735 -18.701 1051 1HB ALA 650 1HB ALA 650 -16.331 25.936 -17.129 1052 2HB ALA 650 2HB ALA 650 -15.124 24.754 -17.688 1053 3HB ALA 650 3HB ALA 650 -16.182 25.569 -18.864 1054 H TYR 651 H TYR 651 -15.772 23.993 -15.517 1055 HA TYR 651 HA TYR 651 -14.469 21.603 -15.662 1056 1HB TYR 651 1HB TYR 651 -13.933 23.107 -13.872 1057 2HB TYR 651 2HB TYR 651 -15.620 23.429 -13.519 1058 HD1 TYR 651 1HD TYR 651 -13.125 20.632 -13.350 1059 HD2 TYR 651 2HD TYR 651 -16.577 22.475 -11.622 1060 HE1 TYR 651 1HE TYR 651 -13.039 18.990 -11.410 1061 HE2 TYR 651 2HE TYR 651 -16.480 20.828 -9.688 1062 HH TYR 651 HH TYR 651 -13.777 18.619 -9.336 1063 H GLN 652 H GLN 652 -17.863 22.240 -14.716 1064 HA GLN 652 HA GLN 652 -18.385 19.864 -13.465 1065 1HB GLN 652 1HB GLN 652 -20.079 21.792 -15.072 1066 2HB GLN 652 2HB GLN 652 -20.792 20.315 -14.454 1067 1HG GLN 652 1HG GLN 652 -19.214 21.578 -12.357 1068 2HG GLN 652 2HG GLN 652 -20.326 22.751 -13.035 1069 1HE2 GLN 652 1HE2 GLN 652 -20.933 22.351 -10.633 1070 2HE2 GLN 652 2HE2 GLN 652 -22.236 21.243 -10.357 1071 H GLY 653 H GLY 653 -18.763 20.716 -16.978 1072 1HA GLY 653 2HA GLY 653 -18.803 19.431 -18.820 1073 2HA GLY 653 1HA GLY 653 -19.689 18.254 -17.871 1074 H VAL 654 H VAL 654 -16.462 19.269 -16.810 1075 HA VAL 654 HA VAL 654 -15.138 17.111 -18.167 1076 HB VAL 654 HB VAL 654 -14.321 19.225 -16.182 1077 1HG1 VAL 654 2HG1 VAL 654 -13.073 17.107 -15.735 1078 2HG1 VAL 654 3HG1 VAL 654 -12.488 17.144 -17.416 1079 3HG1 VAL 654 1HG1 VAL 654 -12.038 18.445 -16.288 1080 1HG2 VAL 654 2HG2 VAL 654 -14.645 19.300 -18.926 1081 2HG2 VAL 654 3HG2 VAL 654 -13.655 20.420 -17.961 1082 3HG2 VAL 654 1HG2 VAL 654 -12.899 19.009 -18.739 1083 H GLN 655 H GLN 655 -16.239 17.914 -14.824 1084 HA GLN 655 HA GLN 655 -15.117 15.815 -13.521 1085 1HB GLN 655 1HB GLN 655 -17.269 17.720 -13.063 1086 2HB GLN 655 2HB GLN 655 -17.712 16.159 -12.400 1087 1HG GLN 655 1HG GLN 655 -14.897 16.936 -11.844 1088 2HG GLN 655 2HG GLN 655 -16.079 18.025 -11.145 1089 1HE2 GLN 655 1HE2 GLN 655 -14.654 16.802 -9.375 1090 2HE2 GLN 655 2HE2 GLN 655 -15.468 15.492 -8.588 1091 H GLN 656 H GLN 656 -18.356 15.938 -15.160 1092 HA GLN 656 HA GLN 656 -18.992 13.300 -14.570 1093 1HB GLN 656 1HB GLN 656 -20.862 13.612 -15.996 1094 2HB GLN 656 2HB GLN 656 -20.526 15.214 -15.370 1095 1HG GLN 656 1HG GLN 656 -18.999 15.446 -17.530 1096 2HG GLN 656 2HG GLN 656 -19.956 14.108 -18.133 1097 1HE2 GLN 656 1HE2 GLN 656 -20.638 16.987 -16.144 1098 2HE2 GLN 656 2HE2 GLN 656 -21.946 17.607 -17.095 1099 H LYS 657 H LYS 657 -17.176 14.838 -17.244 1100 HA LYS 657 HA LYS 657 -17.139 12.577 -18.919 1101 1HB LYS 657 1HB LYS 657 -15.648 15.168 -18.742 1102 2HB LYS 657 2HB LYS 657 -14.994 13.899 -19.757 1103 1HG LYS 657 1HG LYS 657 -17.808 13.979 -20.283 1104 2HG LYS 657 2HG LYS 657 -17.263 15.645 -20.263 1105 1HD LYS 657 1HD LYS 657 -15.254 14.247 -21.695 1106 2HD LYS 657 2HD LYS 657 -16.763 13.560 -22.261 1107 1HE LYS 657 1HE LYS 657 -17.513 16.133 -22.379 1108 2HE LYS 657 2HE LYS 657 -15.785 16.412 -22.457 1109 H TRP 658 H TRP 658 -15.311 13.560 -16.049 1110 HA TRP 658 HA TRP 658 -13.176 11.720 -16.499 1111 1HB TRP 658 1HB TRP 658 -12.727 13.676 -15.228 1112 2HB TRP 658 2HB TRP 658 -14.060 13.368 -14.133 1113 HD1 TRP 658 HD TRP 658 -13.510 11.891 -12.001 1114 HE1 TRP 658 1HE TRP 658 -11.412 10.637 -11.006 1115 HE3 TRP 658 3HE TRP 658 -10.607 12.355 -16.150 1116 HZ2 TRP 658 2HZ TRP 658 -8.831 9.995 -12.042 1117 HZ3 TRP 658 3HZ TRP 658 -8.310 11.387 -16.075 1118 HH2 TRP 658 HH TRP 658 -7.412 10.240 -14.112 1119 H ASP 659 H ASP 659 -16.069 11.883 -14.297 1120 HA ASP 659 HA ASP 659 -15.684 9.388 -13.198 1121 1HB ASP 659 1HB ASP 659 -17.281 11.268 -12.466 1122 2HB ASP 659 2HB ASP 659 -18.374 10.727 -13.724 1123 HD2 ASP 659 HD ASP 659 -19.879 10.229 -12.263 1124 H ALA 660 H ALA 660 -17.188 10.527 -16.231 1125 HA ALA 660 HA ALA 660 -18.771 8.384 -16.897 1126 1HB ALA 660 1HB ALA 660 -19.001 10.124 -18.375 1127 2HB ALA 660 2HB ALA 660 -17.266 10.521 -18.346 1128 3HB ALA 660 3HB ALA 660 -17.848 9.145 -19.314 1129 H THR 661 H THR 661 -15.750 8.793 -18.776 1130 HA THR 661 HA THR 661 -15.426 6.112 -19.301 1131 HB THR 661 HB THR 661 -13.189 6.813 -20.057 1132 HG1 THR 661 1HG THR 661 -12.779 7.998 -17.997 1133 1HG2 THR 661 1HG2 THR 661 -15.455 8.028 -20.989 1134 2HG2 THR 661 2HG2 THR 661 -14.606 9.447 -20.331 1135 3HG2 THR 661 3HG2 THR 661 -13.831 8.447 -21.583 1136 H ALA 662 H ALA 662 -14.703 7.888 -16.353 1137 HA ALA 662 HA ALA 662 -12.740 6.282 -15.273 1138 1HB ALA 662 3HB ALA 662 -13.183 8.205 -14.059 1139 2HB ALA 662 2HB ALA 662 -14.041 7.000 -13.070 1140 3HB ALA 662 1HB ALA 662 -14.948 8.024 -14.209 1141 H THR 663 H THR 663 -16.081 6.091 -13.947 1142 HA THR 663 HA THR 663 -15.886 3.544 -12.995 1143 HB THR 663 HB THR 663 -17.739 4.920 -12.343 1144 HG1 THR 663 1HG THR 663 -18.829 3.128 -14.378 1145 1HG2 THR 663 3HG2 THR 663 -17.749 5.724 -15.108 1146 2HG2 THR 663 1HG2 THR 663 -19.331 4.984 -14.765 1147 3HG2 THR 663 2HG2 THR 663 -18.762 6.360 -13.789 1148 H GLU 664 H GLU 664 -16.225 4.567 -16.345 1149 HA GLU 664 HA GLU 664 -17.283 2.176 -17.304 1150 1HB GLU 664 1HB GLU 664 -17.264 4.328 -18.563 1151 2HB GLU 664 2HB GLU 664 -15.522 4.227 -18.718 1152 1HG GLU 664 1HG GLU 664 -17.002 3.368 -20.702 1153 2HG GLU 664 2HG GLU 664 -15.615 2.411 -20.220 1154 HE2 GLU 664 HE GLU 664 -16.021 0.439 -19.415 1155 H LEU 665 H LEU 665 -13.885 3.399 -16.996 1156 HA LEU 665 HA LEU 665 -12.831 0.912 -17.971 1157 1HB LEU 665 1HB LEU 665 -11.867 3.221 -18.348 1158 2HB LEU 665 2HB LEU 665 -11.356 3.198 -16.672 1159 HG LEU 665 HG LEU 665 -9.507 2.603 -18.102 1160 1HD1 LEU 665 2HD1 LEU 665 -10.145 1.310 -15.854 1161 2HD1 LEU 665 3HD1 LEU 665 -10.152 -0.074 -16.973 1162 3HD1 LEU 665 1HD1 LEU 665 -8.690 0.928 -16.806 1163 1HD2 LEU 665 3HD2 LEU 665 -10.786 1.781 -20.027 1164 2HD2 LEU 665 1HD2 LEU 665 -9.510 0.638 -19.544 1165 3HD2 LEU 665 2HD2 LEU 665 -11.208 0.309 -19.120 1166 H ASN 666 H ASN 666 -13.788 2.336 -14.905 1167 HA ASN 666 HA ASN 666 -12.128 0.753 -13.301 1168 1HB ASN 666 1HB ASN 666 -13.669 2.909 -12.798 1169 2HB ASN 666 2HB ASN 666 -14.849 1.691 -12.354 1170 1HD2 ASN 666 1HD2 ASN 666 -12.615 3.676 -11.149 1171 2HD2 ASN 666 2HD2 ASN 666 -12.079 2.817 -9.743 1172 H ASN 667 H ASN 667 -15.560 0.542 -14.464 1173 HA ASN 667 HA ASN 667 -16.147 -1.795 -13.063 1174 1HB ASN 667 1HB ASN 667 -18.219 -1.711 -14.193 1175 2HB ASN 667 2HB ASN 667 -17.708 -0.038 -14.295 1176 1HD2 ASN 667 1HD2 ASN 667 -17.918 0.855 -16.188 1177 2HD2 ASN 667 2HD2 ASN 667 -17.824 0.085 -17.736 1178 H ALA 668 H ALA 668 -14.918 -1.030 -16.370 1179 HA ALA 668 HA ALA 668 -15.117 -3.602 -17.441 1180 1HB ALA 668 3HB ALA 668 -14.631 -1.246 -18.506 1181 2HB ALA 668 2HB ALA 668 -13.925 -2.706 -19.238 1182 3HB ALA 668 1HB ALA 668 -12.930 -1.664 -18.192 1183 H LEU 669 H LEU 669 -12.619 -1.963 -15.447 1184 HA LEU 669 HA LEU 669 -10.690 -3.999 -15.747 1185 1HB LEU 669 1HB LEU 669 -11.054 -1.527 -14.224 1186 2HB LEU 669 2HB LEU 669 -10.155 -2.752 -13.349 1187 HG LEU 669 HG LEU 669 -9.420 -1.951 -16.167 1188 1HD1 LEU 669 1HD1 LEU 669 -9.499 0.019 -14.542 1189 2HD1 LEU 669 2HD1 LEU 669 -8.139 -0.767 -13.705 1190 3HD1 LEU 669 3HD1 LEU 669 -7.970 -0.270 -15.405 1191 1HD2 LEU 669 1HD2 LEU 669 -8.582 -4.092 -14.882 1192 2HD2 LEU 669 2HD2 LEU 669 -7.469 -3.113 -15.867 1193 3HD2 LEU 669 3HD2 LEU 669 -7.492 -2.924 -14.097 1194 H GLN 670 H GLN 670 -13.210 -3.287 -13.250 1195 HA GLN 670 HA GLN 670 -12.513 -5.393 -11.597 1196 1HB GLN 670 1HB GLN 670 -14.969 -3.693 -11.991 1197 2HB GLN 670 2HB GLN 670 -15.111 -5.121 -10.984 1198 1HG GLN 670 1HG GLN 670 -12.667 -3.767 -10.254 1199 2HG GLN 670 2HG GLN 670 -13.945 -2.570 -10.311 1200 1HE2 GLN 670 1HE2 GLN 670 -12.686 -3.263 -7.971 1201 2HE2 GLN 670 2HE2 GLN 670 -13.781 -4.080 -6.906 1202 H ASN 671 H ASN 671 -15.115 -5.151 -14.127 1203 HA ASN 671 HA ASN 671 -16.032 -7.713 -13.851 1204 1HB ASN 671 1HB ASN 671 -16.569 -5.527 -15.510 1205 2HB ASN 671 2HB ASN 671 -15.960 -6.707 -16.653 1206 1HD2 ASN 671 1HD2 ASN 671 -17.640 -7.528 -17.652 1207 2HD2 ASN 671 2HD2 ASN 671 -19.063 -8.195 -16.924 1208 H LEU 672 H LEU 672 -13.186 -6.350 -15.513 1209 HA LEU 672 HA LEU 672 -12.660 -8.659 -17.095 1210 1HB LEU 672 1HB LEU 672 -11.871 -6.661 -17.968 1211 2HB LEU 672 2HB LEU 672 -11.220 -6.117 -16.435 1212 HG LEU 672 HG LEU 672 -9.859 -8.527 -17.177 1213 1HD1 LEU 672 1HD1 LEU 672 -10.682 -7.863 -19.479 1214 2HD1 LEU 672 2HD1 LEU 672 -9.653 -6.418 -19.332 1215 3HD1 LEU 672 3HD1 LEU 672 -8.921 -8.040 -19.292 1216 1HD2 LEU 672 2HD2 LEU 672 -9.231 -6.344 -15.810 1217 2HD2 LEU 672 3HD2 LEU 672 -7.993 -7.342 -16.611 1218 3HD2 LEU 672 1HD2 LEU 672 -8.565 -5.844 -17.383 1219 H ALA 673 H ALA 673 -11.469 -7.334 -13.954 1220 HA ALA 673 HA ALA 673 -9.639 -9.482 -13.579 1221 1HB ALA 673 3HB ALA 673 -10.017 -6.953 -12.526 1222 2HB ALA 673 1HB ALA 673 -10.557 -8.005 -11.196 1223 3HB ALA 673 2HB ALA 673 -8.918 -8.188 -11.866 1224 H ARG 674 H ARG 674 -13.076 -9.011 -13.167 1225 HA ARG 674 HA ARG 674 -13.417 -10.814 -11.062 1226 1HB ARG 674 1HB ARG 674 -15.191 -9.523 -13.135 1227 2HB ARG 674 2HB ARG 674 -15.840 -10.899 -12.266 1228 1HG ARG 674 1HG ARG 674 -14.733 -9.436 -10.193 1229 2HG ARG 674 2HG ARG 674 -15.230 -8.156 -11.282 1230 1HD ARG 674 1HD ARG 674 -17.494 -8.633 -11.046 1231 2HD ARG 674 2HD ARG 674 -17.226 -10.353 -10.843 1232 HE ARG 674 HE ARG 674 -16.118 -9.367 -8.546 1233 2HH1 ARG 674 1HH ARG 674 -18.824 -8.498 -6.551 1234 1HH2 ARG 674 2HH2 ARG 674 -19.238 -8.726 -10.099 1235 2HH2 ARG 674 1HH2 ARG 674 -20.049 -8.382 -8.608 1236 H THR 675 H THR 675 -13.091 -11.108 -14.592 1237 HA THR 675 HA THR 675 -13.697 -13.981 -14.397 1238 HB THR 675 HB THR 675 -13.667 -12.009 -16.741 1239 HG1 THR 675 1HG THR 675 -15.633 -13.593 -15.242 1240 1HG2 THR 675 1HG2 THR 675 -13.028 -14.475 -17.292 1241 2HG2 THR 675 2HG2 THR 675 -14.668 -14.892 -16.737 1242 3HG2 THR 675 3HG2 THR 675 -14.448 -13.811 -18.134 1243 H ILE 676 H ILE 676 -11.130 -11.768 -14.375 1244 HA ILE 676 HA ILE 676 -9.356 -13.639 -15.748 1245 HB ILE 676 HB ILE 676 -9.184 -10.746 -14.977 1246 1HG1 ILE 676 1HG1 ILE 676 -8.916 -12.308 -17.555 1247 2HG1 ILE 676 2HG1 ILE 676 -10.170 -11.165 -17.117 1248 1HG2 ILE 676 1HG2 ILE 676 -6.982 -12.662 -15.009 1249 2HG2 ILE 676 2HG2 ILE 676 -6.749 -11.324 -16.158 1250 3HG2 ILE 676 3HG2 ILE 676 -7.034 -10.978 -14.436 1251 1HD1 ILE 676 1HD1 ILE 676 -8.044 -9.528 -16.799 1252 2HD1 ILE 676 2HD1 ILE 676 -7.347 -10.649 -17.992 1253 3HD1 ILE 676 3HD1 ILE 676 -8.837 -9.755 -18.377 1254 H SER 677 H SER 677 -9.573 -11.739 -12.657 1255 HA SER 677 HA SER 677 -7.485 -12.789 -11.365 1256 1HB SER 677 1HB SER 677 -8.619 -12.234 -9.291 1257 2HB SER 677 2HB SER 677 -9.068 -11.043 -10.496 1258 HG SER 677 HG SER 677 -10.807 -12.153 -9.068 1259 H GLU 678 H GLU 678 -10.576 -14.368 -12.144 1260 HA GLU 678 HA GLU 678 -10.455 -16.433 -10.325 1261 1HB GLU 678 1HB GLU 678 -12.002 -17.606 -11.874 1262 2HB GLU 678 2HB GLU 678 -12.462 -15.931 -11.646 1263 1HG GLU 678 1HG GLU 678 -11.038 -15.448 -13.788 1264 2HG GLU 678 2HG GLU 678 -11.082 -17.180 -14.052 1265 HE2 GLU 678 HE GLU 678 -14.012 -16.569 -15.754 1266 H ALA 679 H ALA 679 -8.581 -15.784 -13.223 1267 HA ALA 679 HA ALA 679 -7.869 -18.211 -14.157 1268 1HB ALA 679 3HB ALA 679 -5.903 -15.963 -13.586 1269 2HB ALA 679 1HB ALA 679 -5.838 -17.159 -14.903 1270 3HB ALA 679 2HB ALA 679 -7.103 -15.907 -14.899 1271 H GLY 680 H GLY 680 -7.190 -16.835 -10.978 1272 1HA GLY 680 2HA GLY 680 -6.472 -17.919 -9.115 1273 2HA GLY 680 1HA GLY 680 -4.988 -18.020 -10.042 1274 H GLN 681 H GLN 681 -8.050 -19.732 -9.246 1275 HA GLN 681 HA GLN 681 -6.700 -22.192 -10.048 1276 1HB GLN 681 1HB GLN 681 -6.948 -21.775 -7.522 1277 2HB GLN 681 2HB GLN 681 -8.677 -21.949 -7.746 1278 1HG GLN 681 1HG GLN 681 -8.073 -24.147 -7.209 1279 2HG GLN 681 2HG GLN 681 -8.045 -24.211 -8.960 1280 1HE2 GLN 681 1HE2 GLN 681 -6.349 -25.105 -9.831 1281 2HE2 GLN 681 2HE2 GLN 681 -4.750 -25.198 -9.173 1282 H ALA 682 H ALA 682 -9.767 -20.358 -9.718 1283 HA ALA 682 HA ALA 682 -11.663 -22.077 -10.451 1284 1HB ALA 682 3HB ALA 682 -11.646 -19.559 -12.037 1285 2HB ALA 682 2HB ALA 682 -11.449 -19.369 -10.278 1286 3HB ALA 682 1HB ALA 682 -12.879 -20.206 -10.929 1287 H MET 683 H MET 683 -10.042 -20.107 -13.035 1288 HA MET 683 HA MET 683 -10.841 -21.382 -15.175 1289 1HB MET 683 1HB MET 683 -9.135 -19.489 -15.012 1290 2HB MET 683 2HB MET 683 -7.902 -20.676 -14.636 1291 1HG MET 683 1HG MET 683 -9.579 -20.940 -17.159 1292 2HG MET 683 2HG MET 683 -8.175 -19.893 -17.129 1293 1HE MET 683 3HE MET 683 -8.749 -21.934 -18.951 1294 2HE MET 683 1HE MET 683 -7.143 -22.661 -19.200 1295 3HE MET 683 2HE MET 683 -8.476 -23.647 -18.549 1296 H ALA 684 H ALA 684 -8.578 -22.710 -12.773 1297 HA ALA 684 HA ALA 684 -7.917 -24.959 -14.467 1298 1HB ALA 684 2HB ALA 684 -6.458 -25.589 -12.632 1299 2HB ALA 684 3HB ALA 684 -6.272 -23.844 -12.930 1300 3HB ALA 684 1HB ALA 684 -7.241 -24.413 -11.550 1301 H SER 685 H SER 685 -9.697 -24.291 -11.378 1302 HA SER 685 HA SER 685 -10.443 -26.806 -10.779 1303 1HB SER 685 1HB SER 685 -12.008 -24.206 -10.515 1304 2HB SER 685 2HB SER 685 -12.537 -25.707 -9.780 1305 HG SER 685 HG SER 685 -10.003 -25.514 -9.044 1306 H THR 686 H THR 686 -13.002 -24.633 -12.100 1307 HA THR 686 HA THR 686 -13.464 -26.222 -14.417 1308 HB THR 686 HB THR 686 -14.351 -27.505 -12.212 1309 HG1 THR 686 1HG THR 686 -16.026 -27.024 -14.566 1310 1HG2 THR 686 2HG2 THR 686 -16.623 -25.618 -13.032 1311 2HG2 THR 686 3HG2 THR 686 -16.820 -27.064 -12.013 1312 3HG2 THR 686 1HG2 THR 686 -15.857 -25.686 -11.427 1313 H GLU 687 H GLU 687 -15.163 -25.359 -15.767 1314 HA GLU 687 HA GLU 687 -15.190 -22.622 -15.739 1315 1HB GLU 687 1HB GLU 687 -15.648 -24.032 -17.732 1316 2HB GLU 687 2HB GLU 687 -17.180 -24.533 -17.043 1317 1HG GLU 687 1HG GLU 687 -16.893 -21.597 -17.078 1318 2HG GLU 687 2HG GLU 687 -16.747 -22.288 -18.681 1319 HE2 GLU 687 HE GLU 687 -20.167 -21.791 -17.017 1320 H GLY 688 H GLY 688 -16.114 -21.248 -14.285 1321 1HA GLY 688 2HA GLY 688 -18.897 -21.580 -13.579 1322 2HA GLY 688 1HA GLY 688 -17.833 -20.250 -13.165 1323 H ASN 689 H ASN 689 -15.734 -22.370 -12.233 1324 HA ASN 689 HA ASN 689 -16.648 -23.955 -10.282 1325 1HB ASN 689 1HB ASN 689 -14.193 -23.381 -11.093 1326 2HB ASN 689 2HB ASN 689 -14.204 -22.204 -9.795 1327 1HD2 ASN 689 1HD2 ASN 689 -13.068 -22.958 -8.182 1328 2HD2 ASN 689 2HD2 ASN 689 -13.162 -24.539 -7.481 1329 H VAL 690 H VAL 690 -15.680 -20.453 -9.994 1330 HA VAL 690 HA VAL 690 -17.087 -20.365 -7.422 1331 HB VAL 690 HB VAL 690 -15.750 -18.402 -6.955 1332 1HG1 VAL 690 3HG1 VAL 690 -14.655 -21.049 -7.443 1333 2HG1 VAL 690 1HG1 VAL 690 -13.406 -19.792 -7.612 1334 3HG1 VAL 690 2HG1 VAL 690 -14.345 -19.917 -6.105 1335 1HG2 VAL 690 3HG2 VAL 690 -14.729 -18.787 -9.779 1336 2HG2 VAL 690 1HG2 VAL 690 -15.480 -17.344 -9.057 1337 3HG2 VAL 690 2HG2 VAL 690 -13.844 -17.840 -8.559 1338 H THR 691 H THR 691 -19.162 -19.698 -7.615 1339 HA THR 691 HA THR 691 -19.874 -17.987 -9.855 1340 HB THR 691 HB THR 691 -21.496 -19.389 -7.664 1341 HG1 THR 691 1HG THR 691 -21.124 -19.836 -10.538 1342 1HG2 THR 691 1HG2 THR 691 -22.244 -17.714 -10.083 1343 2HG2 THR 691 2HG2 THR 691 -23.262 -19.103 -9.635 1344 3HG2 THR 691 3HG2 THR 691 -23.020 -17.770 -8.482 1345 H GLY 692 H GLY 692 -18.168 -17.136 -7.413 1346 1HA GLY 692 2HA GLY 692 -18.222 -15.495 -5.801 1347 2HA GLY 692 1HA GLY 692 -19.897 -15.147 -6.180 1348 H MET 693 H MET 693 -16.764 -15.179 -8.041 1349 HA MET 693 HA MET 693 -17.367 -12.426 -8.769 1350 1HB MET 693 1HB MET 693 -14.924 -12.253 -9.213 1351 2HB MET 693 2HB MET 693 -15.187 -12.884 -7.600 1352 1HG MET 693 1HG MET 693 -15.118 -15.092 -9.503 1353 2HG MET 693 2HG MET 693 -13.695 -14.092 -9.718 1354 1HE MET 693 2HE MET 693 -11.834 -14.394 -8.756 1355 2HE MET 693 3HE MET 693 -11.990 -13.502 -7.224 1356 3HE MET 693 1HE MET 693 -11.412 -15.185 -7.218 1357 H PHE 694 H PHE 694 -18.688 -14.706 -10.063 1358 HA PHE 694 HA PHE 694 -17.455 -14.512 -12.722 1359 1HB PHE 694 1HB PHE 694 -18.455 -16.704 -11.028 1360 2HB PHE 694 2HB PHE 694 -19.377 -16.653 -12.518 1361 HD1 PHE 694 1HD PHE 694 -18.362 -17.223 -14.627 1362 HD2 PHE 694 2HD PHE 694 -16.037 -17.149 -11.078 1363 HE1 PHE 694 1HE PHE 694 -16.517 -18.445 -15.811 1364 HE2 PHE 694 2HE PHE 694 -14.191 -18.371 -12.262 1365 HZ PHE 694 HZ PHE 694 -14.453 -19.005 -14.614 1366 H ALA 695 H ALA 695 -18.576 -12.642 -13.422 1367 HA ALA 695 HA ALA 695 -21.416 -12.482 -13.088 1368 1HB ALA 695 2HB ALA 695 -19.614 -10.590 -13.216 1369 2HB ALA 695 3HB ALA 695 -19.762 -10.801 -14.978 1370 3HB ALA 695 1HB ALA 695 -21.185 -10.339 -14.014 No H/Q in entry = 1370 Start of MODEL 20 1 H ALA 1 H ALA 1 -10.448 34.997 0.138 2 HA ALA 1 HA ALA 1 -7.650 34.105 0.044 3 1HB ALA 1 2HB ALA 1 -9.325 32.236 0.391 4 2HB ALA 1 3HB ALA 1 -10.027 32.662 -1.188 5 3HB ALA 1 1HB ALA 1 -8.343 32.093 -1.086 6 H GLU 2 H GLU 2 -6.636 34.259 -2.043 7 HA GLU 2 HA GLU 2 -8.203 35.788 -3.963 8 1HB GLU 2 1HB GLU 2 -5.978 36.748 -2.450 9 2HB GLU 2 2HB GLU 2 -5.399 36.529 -4.090 10 1HG GLU 2 1HG GLU 2 -6.286 38.656 -4.317 11 2HG GLU 2 2HG GLU 2 -7.721 37.731 -4.710 12 HE2 GLU 2 HE GLU 2 -9.476 38.854 -3.422 13 H MET 3 H MET 3 -4.932 34.225 -3.574 14 HA MET 3 HA MET 3 -4.966 33.422 -6.291 15 1HB MET 3 1HB MET 3 -3.161 32.784 -3.897 16 2HB MET 3 2HB MET 3 -2.830 32.177 -5.508 17 1HG MET 3 1HG MET 3 -2.524 34.406 -6.398 18 2HG MET 3 2HG MET 3 -3.222 35.153 -4.975 19 1HE MET 3 2HE MET 3 -0.609 34.423 -6.911 20 2HE MET 3 3HE MET 3 0.587 35.399 -6.025 21 3HE MET 3 1HE MET 3 0.715 33.624 -6.029 22 H LYS 4 H LYS 4 -7.044 32.193 -6.244 23 HA LYS 4 HA LYS 4 -6.814 29.622 -4.871 24 1HB LYS 4 1HB LYS 4 -9.203 29.432 -5.163 25 2HB LYS 4 2HB LYS 4 -8.826 30.979 -4.431 26 1HG LYS 4 1HG LYS 4 -8.737 31.610 -7.133 27 2HG LYS 4 2HG LYS 4 -9.989 30.384 -7.103 28 1HD LYS 4 1HD LYS 4 -10.891 31.775 -5.014 29 2HD LYS 4 2HD LYS 4 -9.933 33.068 -5.705 30 1HE LYS 4 1HE LYS 4 -11.537 33.470 -7.257 31 2HE LYS 4 2HE LYS 4 -11.404 31.829 -7.857 32 H THR 5 H THR 5 -6.935 31.209 -8.049 33 HA THR 5 HA THR 5 -6.781 28.549 -9.303 34 HB THR 5 HB THR 5 -7.694 29.666 -11.289 35 HG1 THR 5 1HG THR 5 -8.050 32.051 -11.007 36 1HG2 THR 5 2HG2 THR 5 -9.149 29.495 -8.896 37 2HG2 THR 5 3HG2 THR 5 -9.359 31.196 -9.377 38 3HG2 THR 5 1HG2 THR 5 -9.836 29.891 -10.490 39 H ASP 6 H ASP 6 -4.855 31.044 -8.170 40 HA ASP 6 HA ASP 6 -3.174 31.853 -9.979 41 1HB ASP 6 1HB ASP 6 -1.282 31.385 -8.306 42 2HB ASP 6 2HB ASP 6 -2.656 32.279 -7.686 43 HD2 ASP 6 HD ASP 6 -4.041 29.390 -7.523 44 H ALA 7 H ALA 7 -1.922 30.935 -11.622 45 HA ALA 7 HA ALA 7 -2.007 28.304 -12.303 46 1HB ALA 7 1HB ALA 7 -0.560 30.697 -13.065 47 2HB ALA 7 2HB ALA 7 0.512 29.278 -13.156 48 3HB ALA 7 3HB ALA 7 -1.021 29.296 -14.061 49 H ALA 8 H ALA 8 -0.054 29.890 -9.820 50 HA ALA 8 HA ALA 8 1.965 27.973 -9.594 51 1HB ALA 8 2HB ALA 8 1.659 28.975 -7.058 52 2HB ALA 8 1HB ALA 8 0.846 30.227 -8.027 53 3HB ALA 8 3HB ALA 8 2.539 29.799 -8.368 54 H THR 9 H THR 9 -1.349 28.217 -8.205 55 HA THR 9 HA THR 9 -1.002 25.874 -6.591 56 HB THR 9 HB THR 9 -2.600 28.037 -6.409 57 HG1 THR 9 1HG THR 9 -3.486 25.287 -5.902 58 1HG2 THR 9 1HG2 THR 9 -3.852 27.263 -8.566 59 2HG2 THR 9 2HG2 THR 9 -4.469 25.923 -7.571 60 3HG2 THR 9 3HG2 THR 9 -4.852 27.606 -7.135 61 H LEU 10 H LEU 10 -2.458 26.635 -9.790 62 HA LEU 10 HA LEU 10 -3.621 24.129 -10.173 63 1HB LEU 10 1HB LEU 10 -2.732 26.359 -11.968 64 2HB LEU 10 2HB LEU 10 -3.281 24.844 -12.658 65 HG LEU 10 HG LEU 10 -4.894 26.616 -10.801 66 1HD1 LEU 10 2HD1 LEU 10 -4.386 27.438 -13.184 67 2HD1 LEU 10 3HD1 LEU 10 -5.465 26.128 -13.718 68 3HD1 LEU 10 1HD1 LEU 10 -6.083 27.408 -12.647 69 1HD2 LEU 10 3HD2 LEU 10 -5.478 23.961 -12.095 70 2HD2 LEU 10 1HD2 LEU 10 -5.698 24.466 -10.403 71 3HD2 LEU 10 2HD2 LEU 10 -6.784 25.092 -11.666 72 H ALA 11 H ALA 11 -0.315 25.397 -10.815 73 HA ALA 11 HA ALA 11 0.534 23.024 -12.128 74 1HB ALA 11 1HB ALA 11 1.730 25.584 -11.144 75 2HB ALA 11 2HB ALA 11 2.834 24.211 -11.392 76 3HB ALA 11 3HB ALA 11 1.843 24.811 -12.743 77 H GLN 12 H GLN 12 0.270 24.146 -8.776 78 HA GLN 12 HA GLN 12 2.111 22.322 -7.719 79 1HB GLN 12 1HB GLN 12 0.983 24.483 -6.693 80 2HB GLN 12 2HB GLN 12 -0.262 23.371 -6.160 81 1HG GLN 12 1HG GLN 12 2.681 22.812 -5.623 82 2HG GLN 12 2HG GLN 12 1.743 23.833 -4.551 83 1HE2 GLN 12 1HE2 GLN 12 2.772 20.765 -5.133 84 2HE2 GLN 12 2HE2 GLN 12 1.613 19.844 -4.234 85 H GLU 13 H GLU 13 -1.335 22.162 -8.606 86 HA GLU 13 HA GLU 13 -1.501 19.541 -7.380 87 1HB GLU 13 1HB GLU 13 -3.704 21.164 -8.725 88 2HB GLU 13 2HB GLU 13 -3.920 19.722 -7.754 89 1HG GLU 13 1HG GLU 13 -2.778 22.374 -6.755 90 2HG GLU 13 2HG GLU 13 -4.399 21.785 -6.443 91 HE2 GLU 13 HE GLU 13 -3.410 22.124 -4.299 92 H ALA 14 H ALA 14 -1.797 21.250 -10.543 93 HA ALA 14 HA ALA 14 -2.568 19.109 -12.099 94 1HB ALA 14 3HB ALA 14 -2.503 21.464 -12.833 95 2HB ALA 14 2HB ALA 14 -1.597 20.420 -13.954 96 3HB ALA 14 1HB ALA 14 -0.724 21.435 -12.782 97 H GLY 15 H GLY 15 0.733 20.180 -11.076 98 1HA GLY 15 2HA GLY 15 2.680 19.063 -10.981 99 2HA GLY 15 1HA GLY 15 2.250 18.400 -12.545 100 H ASN 16 H ASN 16 0.399 17.915 -9.496 101 HA ASN 16 HA ASN 16 1.570 15.406 -8.988 102 1HB ASN 16 1HB ASN 16 -0.723 17.030 -7.895 103 2HB ASN 16 2HB ASN 16 -0.761 15.309 -7.569 104 1HD2 ASN 16 1HD2 ASN 16 -0.571 16.065 -5.348 105 2HD2 ASN 16 2HD2 ASN 16 0.994 16.352 -4.665 106 H PHE 17 H PHE 17 -1.330 16.671 -10.683 107 HA PHE 17 HA PHE 17 -2.702 14.246 -10.931 108 1HB PHE 17 1HB PHE 17 -3.673 16.516 -11.308 109 2HB PHE 17 2HB PHE 17 -2.532 16.822 -12.603 110 HD1 PHE 17 1HD PHE 17 -5.438 14.736 -11.644 111 HD2 PHE 17 2HD PHE 17 -3.009 16.164 -14.818 112 HE1 PHE 17 1HE PHE 17 -7.088 13.841 -13.310 113 HE2 PHE 17 2HE PHE 17 -4.659 15.269 -16.484 114 HZ PHE 17 HZ PHE 17 -6.679 14.118 -15.710 115 H GLU 18 H GLU 18 -0.505 16.007 -13.231 116 HA GLU 18 HA GLU 18 -0.631 14.434 -15.355 117 1HB GLU 18 1HB GLU 18 1.631 15.917 -14.049 118 2HB GLU 18 2HB GLU 18 2.041 14.845 -15.373 119 1HG GLU 18 1HG GLU 18 -0.313 16.351 -16.127 120 2HG GLU 18 2HG GLU 18 0.883 17.476 -15.512 121 HE2 GLU 18 HE GLU 18 1.482 15.727 -19.020 122 H ARG 19 H ARG 19 0.895 13.626 -12.231 123 HA ARG 19 HA ARG 19 2.222 11.357 -13.212 124 1HB ARG 19 1HB ARG 19 2.283 12.823 -10.862 125 2HB ARG 19 2HB ARG 19 1.434 11.385 -10.331 126 1HG ARG 19 1HG ARG 19 3.248 9.938 -10.995 127 2HG ARG 19 2HG ARG 19 4.018 11.204 -11.931 128 1HD ARG 19 1HD ARG 19 3.767 12.263 -9.297 129 2HD ARG 19 2HD ARG 19 4.290 10.604 -9.082 130 HE ARG 19 HE ARG 19 5.801 11.960 -11.175 131 2HH1 ARG 19 1HH ARG 19 8.649 12.429 -9.244 132 1HH2 ARG 19 2HH2 ARG 19 5.573 11.500 -7.669 133 2HH2 ARG 19 1HH2 ARG 19 7.241 11.873 -7.387 134 H ILE 20 H ILE 20 -0.954 12.004 -11.638 135 HA ILE 20 HA ILE 20 -1.656 9.315 -11.245 136 HB ILE 20 HB ILE 20 -3.427 11.734 -11.612 137 1HG1 ILE 20 1HG1 ILE 20 -2.509 10.625 -8.965 138 2HG1 ILE 20 2HG1 ILE 20 -1.529 11.791 -9.832 139 1HG2 ILE 20 2HG2 ILE 20 -4.465 9.405 -11.758 140 2HG2 ILE 20 3HG2 ILE 20 -4.047 9.236 -10.036 141 3HG2 ILE 20 1HG2 ILE 20 -5.149 10.532 -10.562 142 1HD1 ILE 20 3HD1 ILE 20 -4.075 12.919 -9.990 143 2HD1 ILE 20 1HD1 ILE 20 -4.057 12.190 -8.366 144 3HD1 ILE 20 2HD1 ILE 20 -2.811 13.377 -8.823 145 H SER 21 H SER 21 -2.236 11.647 -13.945 146 HA SER 21 HA SER 21 -3.849 9.978 -15.423 147 1HB SER 21 1HB SER 21 -3.896 12.064 -16.358 148 2HB SER 21 2HB SER 21 -2.250 12.428 -15.881 149 HG SER 21 HG SER 21 -1.499 11.750 -17.788 150 H GLY 22 H GLY 22 -0.256 10.509 -15.554 151 1HA GLY 22 2HA GLY 22 1.413 9.230 -16.344 152 2HA GLY 22 1HA GLY 22 0.319 8.732 -17.620 153 H ASP 23 H ASP 23 0.549 8.190 -14.023 154 HA ASP 23 HA ASP 23 1.270 5.584 -14.140 155 1HB ASP 23 1HB ASP 23 -0.269 7.268 -12.171 156 2HB ASP 23 2HB ASP 23 -0.244 5.537 -11.897 157 HD2 ASP 23 HD ASP 23 2.264 5.976 -9.962 158 H LEU 24 H LEU 24 -2.071 7.017 -13.861 159 HA LEU 24 HA LEU 24 -3.531 4.710 -13.795 160 1HB LEU 24 1HB LEU 24 -4.296 7.082 -13.506 161 2HB LEU 24 2HB LEU 24 -4.294 7.243 -15.251 162 HG LEU 24 HG LEU 24 -5.887 5.175 -15.209 163 1HD1 LEU 24 2HD1 LEU 24 -5.408 4.974 -12.643 164 2HD1 LEU 24 3HD1 LEU 24 -6.676 6.216 -12.510 165 3HD1 LEU 24 1HD1 LEU 24 -7.038 4.655 -13.284 166 1HD2 LEU 24 1HD2 LEU 24 -6.667 7.986 -14.416 167 2HD2 LEU 24 2HD2 LEU 24 -6.651 7.257 -16.040 168 3HD2 LEU 24 3HD2 LEU 24 -7.850 6.725 -14.837 169 H LYS 25 H LYS 25 -2.127 6.421 -16.638 170 HA LYS 25 HA LYS 25 -3.326 4.677 -18.518 171 1HB LYS 25 1HB LYS 25 -2.781 6.651 -19.515 172 2HB LYS 25 2HB LYS 25 -1.349 6.895 -18.536 173 1HG LYS 25 1HG LYS 25 0.014 5.705 -19.973 174 2HG LYS 25 2HG LYS 25 -1.234 4.541 -20.371 175 1HD LYS 25 1HD LYS 25 -0.842 5.825 -22.373 176 2HD LYS 25 2HD LYS 25 -2.387 6.358 -21.742 177 1HE LYS 25 1HE LYS 25 -1.540 8.470 -21.882 178 2HE LYS 25 2HE LYS 25 -0.631 8.073 -20.438 179 H THR 26 H THR 26 -0.278 4.708 -16.647 180 HA THR 26 HA THR 26 1.037 2.700 -18.093 181 HB THR 26 HB THR 26 1.185 3.886 -15.300 182 HG1 THR 26 1HG THR 26 2.261 5.078 -16.893 183 1HG2 THR 26 3HG2 THR 26 2.216 1.262 -16.105 184 2HG2 THR 26 1HG2 THR 26 3.553 2.400 -15.813 185 3HG2 THR 26 2HG2 THR 26 2.360 2.080 -14.531 186 H GLN 27 H GLN 27 -1.029 2.480 -15.122 187 HA GLN 27 HA GLN 27 -0.810 -0.250 -14.891 188 1HB GLN 27 1HB GLN 27 -3.040 1.658 -14.075 189 2HB GLN 27 2HB GLN 27 -3.012 -0.029 -13.602 190 1HG GLN 27 1HG GLN 27 -1.828 2.017 -12.173 191 2HG GLN 27 2HG GLN 27 -1.410 0.323 -12.014 192 1HE2 GLN 27 1HE2 GLN 27 0.366 -0.528 -13.158 193 2HE2 GLN 27 2HE2 GLN 27 1.674 0.470 -13.699 194 H ILE 28 H ILE 28 -3.328 1.754 -16.570 195 HA ILE 28 HA ILE 28 -4.954 -0.296 -17.402 196 HB ILE 28 HB ILE 28 -4.355 2.466 -18.302 197 1HG1 ILE 28 1HG1 ILE 28 -7.060 1.229 -17.855 198 2HG1 ILE 28 2HG1 ILE 28 -6.033 1.607 -16.486 199 1HG2 ILE 28 1HG2 ILE 28 -5.404 0.352 -20.095 200 2HG2 ILE 28 2HG2 ILE 28 -6.312 1.883 -20.061 201 3HG2 ILE 28 3HG2 ILE 28 -4.580 1.885 -20.471 202 1HD1 ILE 28 2HD1 ILE 28 -5.824 3.968 -17.306 203 2HD1 ILE 28 3HD1 ILE 28 -6.924 3.571 -18.648 204 3HD1 ILE 28 1HD1 ILE 28 -7.511 3.512 -16.968 205 H ASP 29 H ASP 29 -1.872 0.918 -18.789 206 HA ASP 29 HA ASP 29 -2.031 -0.516 -21.147 207 1HB ASP 29 1HB ASP 29 -0.232 1.242 -19.939 208 2HB ASP 29 2HB ASP 29 0.683 -0.252 -19.973 209 HD2 ASP 29 HD ASP 29 -0.592 2.234 -21.810 210 H GLN 30 H GLN 30 -0.747 -1.263 -17.854 211 HA GLN 30 HA GLN 30 0.545 -3.607 -18.460 212 1HB GLN 30 1HB GLN 30 -0.917 -2.833 -15.897 213 2HB GLN 30 2HB GLN 30 0.244 -4.138 -16.027 214 1HG GLN 30 1HG GLN 30 0.710 -1.161 -16.151 215 2HG GLN 30 2HG GLN 30 1.602 -2.382 -15.266 216 1HE2 GLN 30 1HE2 GLN 30 1.689 -0.330 -17.819 217 2HE2 GLN 30 2HE2 GLN 30 2.888 -1.077 -18.820 218 H VAL 31 H VAL 31 -2.896 -3.014 -17.501 219 HA VAL 31 HA VAL 31 -3.640 -5.708 -17.435 220 HB VAL 31 HB VAL 31 -5.118 -3.112 -17.821 221 1HG1 VAL 31 3HG1 VAL 31 -6.253 -5.921 -17.743 222 2HG1 VAL 31 1HG1 VAL 31 -7.212 -4.468 -17.376 223 3HG1 VAL 31 2HG1 VAL 31 -6.490 -4.673 -18.989 224 1HG2 VAL 31 1HG2 VAL 31 -4.026 -4.323 -15.580 225 2HG2 VAL 31 2HG2 VAL 31 -5.288 -3.069 -15.586 226 3HG2 VAL 31 3HG2 VAL 31 -5.742 -4.788 -15.501 227 H GLU 32 H GLU 32 -4.033 -3.201 -20.040 228 HA GLU 32 HA GLU 32 -5.211 -4.730 -21.900 229 1HB GLU 32 1HB GLU 32 -3.532 -2.321 -21.880 230 2HB GLU 32 2HB GLU 32 -3.345 -3.221 -23.372 231 1HG GLU 32 1HG GLU 32 -6.065 -3.343 -23.116 232 2HG GLU 32 2HG GLU 32 -5.766 -1.831 -22.282 233 HE2 GLU 32 HE GLU 32 -5.615 -0.168 -25.185 234 H SER 33 H SER 33 -1.754 -4.717 -20.948 235 HA SER 33 HA SER 33 -1.051 -6.465 -23.083 236 1HB SER 33 1HB SER 33 0.844 -5.295 -22.564 237 2HB SER 33 2HB SER 33 0.328 -4.989 -20.918 238 HG SER 33 HG SER 33 2.193 -6.373 -20.966 239 H THR 34 H THR 34 -1.230 -6.694 -19.454 240 HA THR 34 HA THR 34 -0.636 -9.389 -19.240 241 HB THR 34 HB THR 34 -1.983 -7.252 -17.621 242 HG1 THR 34 1HG THR 34 -0.019 -9.410 -17.286 243 1HG2 THR 34 3HG2 THR 34 -3.446 -9.381 -17.359 244 2HG2 THR 34 1HG2 THR 34 -1.988 -10.167 -16.706 245 3HG2 THR 34 2HG2 THR 34 -2.691 -8.761 -15.871 246 H ALA 35 H ALA 35 -3.769 -7.775 -19.942 247 HA ALA 35 HA ALA 35 -5.434 -9.930 -19.647 248 1HB ALA 35 3HB ALA 35 -5.708 -7.990 -21.949 249 2HB ALA 35 2HB ALA 35 -5.861 -7.427 -20.267 250 3HB ALA 35 1HB ALA 35 -6.971 -8.669 -20.894 251 H GLY 36 H GLY 36 -3.118 -9.154 -22.261 252 1HA GLY 36 2HA GLY 36 -2.231 -10.503 -23.839 253 2HA GLY 36 1HA GLY 36 -3.902 -10.734 -24.315 254 H SER 37 H SER 37 -1.932 -11.823 -21.452 255 HA SER 37 HA SER 37 -1.773 -14.450 -22.269 256 1HB SER 37 1HB SER 37 -1.775 -13.348 -19.423 257 2HB SER 37 2HB SER 37 -1.172 -14.923 -19.898 258 HG SER 37 HG SER 37 0.686 -14.001 -20.390 259 H LEU 38 H LEU 38 -4.364 -12.603 -20.728 260 HA LEU 38 HA LEU 38 -5.767 -14.929 -19.805 261 1HB LEU 38 1HB LEU 38 -6.242 -11.977 -19.839 262 2HB LEU 38 2HB LEU 38 -7.600 -13.055 -19.584 263 HG LEU 38 HG LEU 38 -7.049 -12.765 -17.417 264 1HD1 LEU 38 2HD1 LEU 38 -6.572 -15.172 -18.001 265 2HD1 LEU 38 3HD1 LEU 38 -4.843 -14.752 -17.989 266 3HD1 LEU 38 1HD1 LEU 38 -5.812 -14.575 -16.507 267 1HD2 LEU 38 3HD2 LEU 38 -5.298 -11.086 -18.015 268 2HD2 LEU 38 1HD2 LEU 38 -4.943 -12.030 -16.548 269 3HD2 LEU 38 2HD2 LEU 38 -4.115 -12.414 -18.077 270 H GLN 39 H GLN 39 -6.721 -12.321 -22.152 271 HA GLN 39 HA GLN 39 -8.726 -13.733 -23.309 272 1HB GLN 39 1HB GLN 39 -7.098 -11.995 -25.124 273 2HB GLN 39 2HB GLN 39 -8.827 -11.997 -24.835 274 1HG GLN 39 1HG GLN 39 -6.644 -10.781 -23.101 275 2HG GLN 39 2HG GLN 39 -8.000 -9.965 -23.853 276 1HE2 GLN 39 1HE2 GLN 39 -6.914 -10.581 -21.004 277 2HE2 GLN 39 2HE2 GLN 39 -8.328 -10.992 -20.093 278 H GLY 40 H GLY 40 -5.212 -13.954 -23.843 279 1HA GLY 40 2HA GLY 40 -3.993 -15.156 -25.343 280 2HA GLY 40 1HA GLY 40 -5.448 -15.537 -26.242 281 H GLN 41 H GLN 41 -6.265 -16.202 -23.077 282 HA GLN 41 HA GLN 41 -5.797 -19.003 -23.535 283 1HB GLN 41 1HB GLN 41 -3.824 -18.030 -22.185 284 2HB GLN 41 2HB GLN 41 -4.964 -17.773 -20.879 285 1HG GLN 41 1HG GLN 41 -4.136 -20.418 -22.137 286 2HG GLN 41 2HG GLN 41 -3.943 -19.916 -20.469 287 1HE2 GLN 41 1HE2 GLN 41 -6.110 -19.170 -19.444 288 2HE2 GLN 41 2HE2 GLN 41 -7.447 -20.255 -19.631 289 H TRP 42 H TRP 42 -7.864 -19.774 -23.427 290 HA TRP 42 HA TRP 42 -9.337 -19.457 -21.008 291 1HB TRP 42 1HB TRP 42 -10.307 -18.037 -23.490 292 2HB TRP 42 2HB TRP 42 -11.355 -18.475 -22.155 293 HD1 TRP 42 HD TRP 42 -9.442 -15.587 -23.296 294 HE1 TRP 42 1HE TRP 42 -8.944 -13.799 -21.421 295 HE3 TRP 42 3HE TRP 42 -10.583 -18.613 -19.373 296 HZ2 TRP 42 2HZ TRP 42 -9.079 -13.850 -18.571 297 HZ3 TRP 42 3HZ TRP 42 -10.374 -17.666 -17.076 298 HH2 TRP 42 HH TRP 42 -9.651 -15.372 -16.643 299 H ARG 43 H ARG 43 -11.715 -20.503 -21.589 300 HA ARG 43 HA ARG 43 -11.093 -22.746 -23.339 301 1HB ARG 43 1HB ARG 43 -12.564 -22.672 -20.669 302 2HB ARG 43 2HB ARG 43 -12.752 -24.020 -21.772 303 1HG ARG 43 1HG ARG 43 -9.922 -23.230 -21.281 304 2HG ARG 43 2HG ARG 43 -10.762 -23.813 -19.858 305 1HD ARG 43 1HD ARG 43 -11.453 -25.557 -22.053 306 2HD ARG 43 2HD ARG 43 -9.713 -25.350 -22.067 307 HE ARG 43 HE ARG 43 -10.406 -25.787 -19.370 308 2HH1 ARG 43 1HH ARG 43 -10.339 -29.259 -19.273 309 1HH2 ARG 43 2HH2 ARG 43 -10.649 -27.578 -22.418 310 2HH2 ARG 43 1HH2 ARG 43 -10.554 -29.131 -21.657 311 H GLY 44 H GLY 44 -13.689 -20.703 -21.846 312 1HA GLY 44 2HA GLY 44 -15.906 -21.578 -23.185 313 2HA GLY 44 1HA GLY 44 -15.100 -20.532 -24.337 314 H ALA 45 H ALA 45 -16.866 -20.714 -21.284 315 HA ALA 45 HA ALA 45 -17.957 -18.234 -21.422 316 1HB ALA 45 3HB ALA 45 -19.005 -19.222 -19.696 317 2HB ALA 45 2HB ALA 45 -17.619 -18.778 -18.672 318 3HB ALA 45 1HB ALA 45 -17.661 -20.368 -19.471 319 H ALA 46 H ALA 46 -15.196 -19.086 -19.206 320 HA ALA 46 HA ALA 46 -14.568 -16.540 -18.455 321 1HB ALA 46 2HB ALA 46 -12.480 -17.457 -17.745 322 2HB ALA 46 3HB ALA 46 -13.659 -18.785 -17.632 323 3HB ALA 46 1HB ALA 46 -12.523 -18.717 -19.001 324 H GLY 47 H GLY 47 -14.104 -18.121 -21.568 325 1HA GLY 47 2HA GLY 47 -13.189 -17.430 -23.502 326 2HA GLY 47 1HA GLY 47 -12.006 -16.533 -22.572 327 H THR 48 H THR 48 -15.496 -16.399 -23.570 328 HA THR 48 HA THR 48 -15.255 -13.841 -24.687 329 HB THR 48 HB THR 48 -17.915 -14.788 -23.678 330 HG1 THR 48 1HG THR 48 -16.295 -16.175 -25.690 331 1HG2 THR 48 1HG2 THR 48 -16.699 -13.609 -26.139 332 2HG2 THR 48 2HG2 THR 48 -17.934 -14.854 -26.441 333 3HG2 THR 48 3HG2 THR 48 -18.342 -13.410 -25.485 334 H ALA 49 H ALA 49 -16.267 -14.939 -21.416 335 HA ALA 49 HA ALA 49 -17.259 -12.581 -20.453 336 1HB ALA 49 1HB ALA 49 -15.690 -14.850 -19.201 337 2HB ALA 49 3HB ALA 49 -17.436 -14.515 -19.107 338 3HB ALA 49 2HB ALA 49 -16.283 -13.483 -18.227 339 H ALA 50 H ALA 50 -13.808 -13.685 -20.584 340 HA ALA 50 HA ALA 50 -12.889 -11.192 -19.513 341 1HB ALA 50 2HB ALA 50 -10.644 -12.320 -20.350 342 2HB ALA 50 1HB ALA 50 -11.678 -13.759 -20.516 343 3HB ALA 50 3HB ALA 50 -11.505 -12.966 -18.932 344 H GLN 51 H GLN 51 -12.355 -12.893 -22.689 345 HA GLN 51 HA GLN 51 -11.169 -10.948 -24.037 346 1HB GLN 51 1HB GLN 51 -11.574 -12.272 -25.842 347 2HB GLN 51 2HB GLN 51 -12.359 -13.341 -24.698 348 1HG GLN 51 1HG GLN 51 -13.970 -13.021 -26.431 349 2HG GLN 51 2HG GLN 51 -14.524 -12.003 -25.116 350 1HE2 GLN 51 1HE2 GLN 51 -15.467 -10.335 -26.038 351 2HE2 GLN 51 2HE2 GLN 51 -14.781 -9.286 -27.234 352 H ALA 52 H ALA 52 -14.635 -11.088 -23.159 353 HA ALA 52 HA ALA 52 -15.370 -8.876 -24.791 354 1HB ALA 52 1HB ALA 52 -16.922 -10.682 -24.059 355 2HB ALA 52 3HB ALA 52 -17.501 -9.061 -23.601 356 3HB ALA 52 2HB ALA 52 -16.753 -10.117 -22.379 357 H ALA 53 H ALA 53 -14.690 -9.359 -21.260 358 HA ALA 53 HA ALA 53 -15.161 -6.774 -20.443 359 1HB ALA 53 3HB ALA 53 -13.011 -8.673 -19.424 360 2HB ALA 53 1HB ALA 53 -13.801 -7.361 -18.516 361 3HB ALA 53 2HB ALA 53 -14.738 -8.791 -19.011 362 H VAL 54 H VAL 54 -11.966 -8.249 -21.380 363 HA VAL 54 HA VAL 54 -10.503 -5.921 -21.244 364 HB VAL 54 HB VAL 54 -9.149 -7.700 -21.463 365 1HG1 VAL 54 1HG1 VAL 54 -11.385 -8.870 -23.066 366 2HG1 VAL 54 2HG1 VAL 54 -9.754 -9.544 -23.291 367 3HG1 VAL 54 3HG1 VAL 54 -10.499 -9.538 -21.675 368 1HG2 VAL 54 2HG2 VAL 54 -8.542 -6.153 -23.306 369 2HG2 VAL 54 3HG2 VAL 54 -8.103 -7.843 -23.651 370 3HG2 VAL 54 1HG2 VAL 54 -9.538 -7.122 -24.419 371 H VAL 55 H VAL 55 -12.598 -7.212 -23.858 372 HA VAL 55 HA VAL 55 -11.818 -5.462 -25.863 373 HB VAL 55 HB VAL 55 -14.109 -7.211 -25.238 374 1HG1 VAL 55 3HG1 VAL 55 -14.399 -4.755 -26.954 375 2HG1 VAL 55 1HG1 VAL 55 -15.270 -6.249 -27.375 376 3HG1 VAL 55 2HG1 VAL 55 -15.545 -5.473 -25.797 377 1HG2 VAL 55 1HG2 VAL 55 -11.893 -7.150 -27.001 378 2HG2 VAL 55 2HG2 VAL 55 -13.140 -8.411 -26.847 379 3HG2 VAL 55 3HG2 VAL 55 -13.355 -7.084 -28.014 380 H ARG 56 H ARG 56 -14.570 -5.177 -23.502 381 HA ARG 56 HA ARG 56 -15.281 -2.648 -24.341 382 1HB ARG 56 1HB ARG 56 -15.667 -4.144 -21.711 383 2HB ARG 56 2HB ARG 56 -16.336 -2.542 -21.952 384 1HG ARG 56 1HG ARG 56 -17.342 -3.562 -24.173 385 2HG ARG 56 2HG ARG 56 -17.021 -5.110 -23.416 386 1HD ARG 56 1HD ARG 56 -18.917 -4.906 -22.186 387 2HD ARG 56 2HD ARG 56 -18.274 -3.466 -21.423 388 HE ARG 56 HE ARG 56 -19.529 -2.118 -22.903 389 2HH1 ARG 56 1HH ARG 56 -21.815 -3.016 -25.359 390 1HH2 ARG 56 2HH2 ARG 56 -19.665 -5.502 -23.943 391 2HH2 ARG 56 1HH2 ARG 56 -20.930 -5.227 -25.094 392 H PHE 57 H PHE 57 -13.243 -3.756 -21.540 393 HA PHE 57 HA PHE 57 -12.680 -1.276 -20.488 394 1HB PHE 57 1HB PHE 57 -11.935 -3.101 -19.190 395 2HB PHE 57 2HB PHE 57 -11.499 -4.044 -20.601 396 HD1 PHE 57 1HD PHE 57 -10.333 -1.685 -18.102 397 HD2 PHE 57 2HD PHE 57 -9.310 -3.701 -21.693 398 HE1 PHE 57 1HE PHE 57 -7.913 -1.142 -17.717 399 HE2 PHE 57 2HE PHE 57 -6.890 -3.158 -21.309 400 HZ PHE 57 HZ PHE 57 -6.220 -1.885 -19.325 401 H GLN 58 H GLN 58 -11.187 -3.024 -23.246 402 HA GLN 58 HA GLN 58 -8.948 -1.421 -23.471 403 1HB GLN 58 1HB GLN 58 -10.510 -3.140 -25.416 404 2HB GLN 58 2HB GLN 58 -9.146 -2.197 -25.981 405 1HG GLN 58 1HG GLN 58 -8.495 -3.629 -23.497 406 2HG GLN 58 2HG GLN 58 -9.046 -4.734 -24.741 407 1HE2 GLN 58 1HE2 GLN 58 -6.744 -5.402 -24.391 408 2HE2 GLN 58 2HE2 GLN 58 -5.528 -4.693 -25.400 409 H GLU 59 H GLU 59 -12.062 -1.279 -25.359 410 HA GLU 59 HA GLU 59 -11.466 0.997 -26.737 411 1HB GLU 59 1HB GLU 59 -14.142 -0.085 -25.764 412 2HB GLU 59 2HB GLU 59 -14.011 1.261 -26.879 413 1HG GLU 59 1HG GLU 59 -12.598 -1.371 -27.447 414 2HG GLU 59 2HG GLU 59 -14.287 -1.154 -27.860 415 HE2 GLU 59 HE GLU 59 -11.109 -0.091 -28.598 416 H ALA 60 H ALA 60 -12.411 0.569 -23.360 417 HA ALA 60 HA ALA 60 -13.135 3.333 -23.014 418 1HB ALA 60 2HB ALA 60 -12.937 0.865 -21.294 419 2HB ALA 60 1HB ALA 60 -14.337 1.920 -21.602 420 3HB ALA 60 3HB ALA 60 -13.030 2.468 -20.526 421 H ALA 61 H ALA 61 -10.267 1.271 -22.816 422 HA ALA 61 HA ALA 61 -8.736 2.826 -21.086 423 1HB ALA 61 3HB ALA 61 -8.328 0.463 -22.009 424 2HB ALA 61 2HB ALA 61 -6.908 1.530 -21.887 425 3HB ALA 61 1HB ALA 61 -7.687 1.261 -23.465 426 H ASN 62 H ASN 62 -9.513 3.123 -24.565 427 HA ASN 62 HA ASN 62 -7.551 5.115 -24.989 428 1HB ASN 62 1HB ASN 62 -9.692 5.274 -26.934 429 2HB ASN 62 2HB ASN 62 -8.074 4.642 -27.162 430 1HD2 ASN 62 1HD2 ASN 62 -7.809 2.459 -25.812 431 2HD2 ASN 62 2HD2 ASN 62 -8.988 1.246 -26.184 432 H LYS 63 H LYS 63 -11.202 5.057 -24.921 433 HA LYS 63 HA LYS 63 -11.660 7.741 -25.123 434 1HB LYS 63 1HB LYS 63 -13.391 6.012 -25.245 435 2HB LYS 63 2HB LYS 63 -13.208 5.671 -23.536 436 1HG LYS 63 1HG LYS 63 -14.738 7.286 -23.103 437 2HG LYS 63 2HG LYS 63 -13.579 8.476 -23.662 438 1HD LYS 63 1HD LYS 63 -15.798 8.593 -24.860 439 2HD LYS 63 2HD LYS 63 -14.434 8.371 -25.937 440 1HE LYS 63 1HE LYS 63 -15.004 6.158 -26.446 441 2HE LYS 63 2HE LYS 63 -15.786 5.886 -24.901 442 H GLN 64 H GLN 64 -10.547 5.839 -22.317 443 HA GLN 64 HA GLN 64 -10.961 7.985 -20.514 444 1HB GLN 64 1HB GLN 64 -9.719 5.248 -20.399 445 2HB GLN 64 2HB GLN 64 -9.278 6.389 -19.144 446 1HG GLN 64 1HG GLN 64 -11.243 5.046 -18.456 447 2HG GLN 64 2HG GLN 64 -11.663 6.743 -18.577 448 1HE2 GLN 64 1HE2 GLN 64 -13.127 4.099 -18.880 449 2HE2 GLN 64 2HE2 GLN 64 -14.031 4.243 -20.351 450 H LYS 65 H LYS 65 -8.195 6.621 -22.374 451 HA LYS 65 HA LYS 65 -6.207 8.182 -21.189 452 1HB LYS 65 1HB LYS 65 -6.490 6.362 -23.445 453 2HB LYS 65 2HB LYS 65 -5.422 7.696 -23.831 454 1HG LYS 65 1HG LYS 65 -4.007 6.047 -22.837 455 2HG LYS 65 2HG LYS 65 -4.242 7.250 -21.585 456 1HD LYS 65 1HD LYS 65 -4.782 5.425 -20.298 457 2HD LYS 65 2HD LYS 65 -6.363 5.632 -21.025 458 1HE LYS 65 1HE LYS 65 -5.846 3.322 -21.349 459 2HE LYS 65 2HE LYS 65 -5.563 4.061 -22.912 460 H GLN 66 H GLN 66 -8.670 8.868 -23.649 461 HA GLN 66 HA GLN 66 -7.394 11.188 -24.604 462 1HB GLN 66 1HB GLN 66 -9.081 9.914 -25.912 463 2HB GLN 66 2HB GLN 66 -10.320 10.333 -24.746 464 1HG GLN 66 1HG GLN 66 -10.707 12.063 -26.217 465 2HG GLN 66 2HG GLN 66 -9.432 12.837 -25.297 466 1HE2 GLN 66 1HE2 GLN 66 -8.273 13.962 -26.671 467 2HE2 GLN 66 2HE2 GLN 66 -7.577 13.400 -28.154 468 H GLU 67 H GLU 67 -10.254 10.646 -22.419 469 HA GLU 67 HA GLU 67 -10.508 13.350 -21.799 470 1HB GLU 67 1HB GLU 67 -12.458 12.415 -21.127 471 2HB GLU 67 2HB GLU 67 -11.746 10.817 -21.035 472 1HG GLU 67 1HG GLU 67 -11.322 12.940 -18.884 473 2HG GLU 67 2HG GLU 67 -12.631 11.777 -18.824 474 HE2 GLU 67 HE GLU 67 -10.135 9.849 -20.051 475 H LEU 68 H LEU 68 -8.384 10.797 -20.637 476 HA LEU 68 HA LEU 68 -7.801 12.009 -18.132 477 1HB LEU 68 1HB LEU 68 -7.588 9.591 -18.661 478 2HB LEU 68 2HB LEU 68 -6.238 9.964 -19.714 479 HG LEU 68 HG LEU 68 -5.059 10.955 -17.705 480 1HD1 LEU 68 3HD1 LEU 68 -7.609 10.458 -16.493 481 2HD1 LEU 68 1HD1 LEU 68 -6.364 9.499 -15.657 482 3HD1 LEU 68 2HD1 LEU 68 -6.173 11.262 -15.814 483 1HD2 LEU 68 1HD2 LEU 68 -5.476 8.194 -18.444 484 2HD2 LEU 68 2HD2 LEU 68 -3.996 9.016 -17.894 485 3HD2 LEU 68 3HD2 LEU 68 -5.131 8.335 -16.704 486 H ASP 69 H ASP 69 -6.342 12.044 -21.427 487 HA ASP 69 HA ASP 69 -4.165 13.624 -20.570 488 1HB ASP 69 1HB ASP 69 -4.520 12.055 -22.703 489 2HB ASP 69 2HB ASP 69 -5.138 13.523 -23.435 490 HD2 ASP 69 HD ASP 69 -2.047 13.568 -24.606 491 H GLU 70 H GLU 70 -7.218 14.151 -22.480 492 HA GLU 70 HA GLU 70 -6.940 16.734 -23.142 493 1HB GLU 70 1HB GLU 70 -9.228 16.722 -23.568 494 2HB GLU 70 2HB GLU 70 -8.909 15.001 -23.477 495 1HG GLU 70 1HG GLU 70 -9.626 14.969 -21.096 496 2HG GLU 70 2HG GLU 70 -9.886 16.702 -21.134 497 HE2 GLU 70 HE GLU 70 -10.962 15.380 -24.104 498 H ILE 71 H ILE 71 -8.144 15.431 -19.984 499 HA ILE 71 HA ILE 71 -8.643 17.959 -18.862 500 HB ILE 71 HB ILE 71 -8.335 15.168 -17.830 501 1HG1 ILE 71 1HG1 ILE 71 -10.653 17.066 -17.478 502 2HG1 ILE 71 2HG1 ILE 71 -10.431 16.174 -18.970 503 1HG2 ILE 71 1HG2 ILE 71 -7.893 17.609 -16.284 504 2HG2 ILE 71 2HG2 ILE 71 -9.214 16.604 -15.641 505 3HG2 ILE 71 3HG2 ILE 71 -7.591 15.906 -15.861 506 1HD1 ILE 71 3HD1 ILE 71 -10.308 14.036 -17.592 507 2HD1 ILE 71 1HD1 ILE 71 -10.761 15.008 -16.171 508 3HD1 ILE 71 2HD1 ILE 71 -11.885 14.860 -17.543 509 H SER 72 H SER 72 -5.758 15.844 -19.056 510 HA SER 72 HA SER 72 -4.274 17.304 -17.194 511 1HB SER 72 1HB SER 72 -2.598 15.796 -17.659 512 2HB SER 72 2HB SER 72 -3.929 14.915 -18.382 513 HG SER 72 HG SER 72 -3.290 16.250 -20.412 514 H THR 73 H THR 73 -5.109 17.773 -20.585 515 HA THR 73 HA THR 73 -2.988 19.743 -20.951 516 HB THR 73 HB THR 73 -4.997 18.287 -22.707 517 HG1 THR 73 1HG THR 73 -2.936 17.698 -23.632 518 1HG2 THR 73 2HG2 THR 73 -4.717 20.890 -23.252 519 2HG2 THR 73 3HG2 THR 73 -3.106 20.382 -23.812 520 3HG2 THR 73 1HG2 THR 73 -4.566 19.689 -24.557 521 H ASN 74 H ASN 74 -6.406 19.501 -20.152 522 HA ASN 74 HA ASN 74 -7.232 21.962 -21.027 523 1HB ASN 74 1HB ASN 74 -8.085 19.986 -18.953 524 2HB ASN 74 2HB ASN 74 -8.638 21.621 -18.652 525 1HD2 ASN 74 1HD2 ASN 74 -8.958 18.787 -20.533 526 2HD2 ASN 74 2HD2 ASN 74 -10.236 19.292 -21.589 527 H ILE 75 H ILE 75 -5.130 20.978 -18.365 528 HA ILE 75 HA ILE 75 -5.478 23.271 -16.746 529 HB ILE 75 HB ILE 75 -3.095 21.427 -16.868 530 1HG1 ILE 75 1HG1 ILE 75 -5.170 20.104 -16.774 531 2HG1 ILE 75 2HG1 ILE 75 -4.221 19.967 -15.307 532 1HG2 ILE 75 3HG2 ILE 75 -3.091 23.620 -15.505 533 2HG2 ILE 75 1HG2 ILE 75 -4.230 22.777 -14.428 534 3HG2 ILE 75 2HG2 ILE 75 -2.602 22.111 -14.698 535 1HD1 ILE 75 1HD1 ILE 75 -6.496 21.974 -15.584 536 2HD1 ILE 75 2HD1 ILE 75 -6.741 20.317 -14.981 537 3HD1 ILE 75 3HD1 ILE 75 -5.687 21.441 -14.091 538 H ARG 76 H ARG 76 -2.925 22.278 -19.132 539 HA ARG 76 HA ARG 76 -1.386 24.481 -18.940 540 1HB ARG 76 1HB ARG 76 -2.014 23.227 -21.643 541 2HB ARG 76 2HB ARG 76 -0.481 23.867 -21.084 542 1HG ARG 76 1HG ARG 76 -0.853 21.952 -19.184 543 2HG ARG 76 2HG ARG 76 -1.770 21.221 -20.486 544 1HD ARG 76 1HD ARG 76 0.739 22.261 -21.542 545 2HD ARG 76 2HD ARG 76 1.071 21.241 -20.157 546 HE ARG 76 HE ARG 76 -0.874 19.991 -21.903 547 2HH1 ARG 76 1HH ARG 76 1.366 17.847 -23.469 548 1HH2 ARG 76 2HH2 ARG 76 2.597 20.628 -21.582 549 2HH2 ARG 76 1HH2 ARG 76 3.062 19.265 -22.544 550 H GLN 77 H GLN 77 -4.590 24.126 -20.387 551 HA GLN 77 HA GLN 77 -4.395 26.476 -21.963 552 1HB GLN 77 1HB GLN 77 -6.645 24.599 -21.185 553 2HB GLN 77 2HB GLN 77 -6.996 26.100 -22.019 554 1HG GLN 77 1HG GLN 77 -4.764 24.762 -23.330 555 2HG GLN 77 2HG GLN 77 -6.100 23.639 -23.163 556 1HE2 GLN 77 1HE2 GLN 77 -7.545 23.643 -24.697 557 2HE2 GLN 77 2HE2 GLN 77 -7.937 24.943 -25.772 558 H ALA 78 H ALA 78 -5.194 25.677 -18.630 559 HA ALA 78 HA ALA 78 -6.809 27.897 -18.048 560 1HB ALA 78 3HB ALA 78 -4.992 26.729 -15.976 561 2HB ALA 78 1HB ALA 78 -6.735 27.081 -15.899 562 3HB ALA 78 2HB ALA 78 -6.156 25.633 -16.758 563 H GLY 79 H GLY 79 -3.372 27.500 -18.635 564 1HA GLY 79 2HA GLY 79 -2.957 30.305 -17.787 565 2HA GLY 79 1HA GLY 79 -2.208 29.557 -19.184 566 H VAL 80 H VAL 80 -2.033 26.941 -17.423 567 HA VAL 80 HA VAL 80 -0.006 27.755 -15.521 568 HB VAL 80 HB VAL 80 -0.752 24.920 -16.127 569 1HG1 VAL 80 1HG1 VAL 80 0.712 26.318 -14.105 570 2HG1 VAL 80 2HG1 VAL 80 -0.715 25.570 -13.348 571 3HG1 VAL 80 3HG1 VAL 80 0.431 24.568 -14.271 572 1HG2 VAL 80 1HG2 VAL 80 -2.512 26.967 -14.758 573 2HG2 VAL 80 2HG2 VAL 80 -2.926 25.851 -16.082 574 3HG2 VAL 80 3HG2 VAL 80 -2.650 25.221 -14.440 575 H GLN 81 H GLN 81 1.728 28.507 -16.791 576 HA GLN 81 HA GLN 81 3.132 26.353 -18.112 577 1HB GLN 81 1HB GLN 81 1.728 27.903 -19.744 578 2HB GLN 81 2HB GLN 81 3.034 29.043 -19.490 579 1HG GLN 81 1HG GLN 81 4.676 27.549 -20.400 580 2HG GLN 81 2HG GLN 81 3.617 26.160 -20.260 581 1HE2 GLN 81 1HE2 GLN 81 5.065 27.589 -22.515 582 2HE2 GLN 81 2HE2 GLN 81 3.882 27.788 -23.765 583 H TYR 82 H TYR 82 3.124 28.387 -15.651 584 HA TYR 82 HA TYR 82 5.983 28.606 -15.594 585 1HB TYR 82 1HB TYR 82 5.920 31.091 -15.366 586 2HB TYR 82 2HB TYR 82 5.169 30.649 -16.886 587 HD1 TYR 82 1HD TYR 82 4.824 32.631 -14.017 588 HD2 TYR 82 2HD TYR 82 2.517 30.240 -16.713 589 HE1 TYR 82 1HE TYR 82 2.722 33.899 -13.356 590 HE2 TYR 82 2HE TYR 82 0.424 31.516 -16.043 591 HH TYR 82 HH TYR 82 0.599 34.393 -14.141 592 H SER 83 H SER 83 5.656 27.191 -13.764 593 HA SER 83 HA SER 83 4.895 28.719 -11.432 594 1HB SER 83 1HB SER 83 2.850 27.583 -11.702 595 2HB SER 83 2HB SER 83 3.611 26.143 -12.349 596 HG SER 83 HG SER 83 4.080 25.413 -10.340 597 H ARG 84 H ARG 84 5.976 25.440 -12.596 598 HA ARG 84 HA ARG 84 7.693 25.255 -10.310 599 1HB ARG 84 1HB ARG 84 8.186 22.964 -11.190 600 2HB ARG 84 2HB ARG 84 6.462 23.243 -11.047 601 1HG ARG 84 1HG ARG 84 7.283 24.144 -13.664 602 2HG ARG 84 2HG ARG 84 7.971 22.553 -13.407 603 1HD ARG 84 1HD ARG 84 5.789 21.582 -12.949 604 2HD ARG 84 2HD ARG 84 5.035 23.160 -12.839 605 HE ARG 84 HE ARG 84 4.923 23.254 -15.179 606 2HH1 ARG 84 1HH ARG 84 6.146 21.127 -17.637 607 1HH2 ARG 84 2HH2 ARG 84 7.174 20.686 -14.237 608 2HH2 ARG 84 1HH2 ARG 84 7.346 20.075 -15.849 609 H ALA 85 H ALA 85 8.046 27.223 -12.697 610 HA ALA 85 HA ALA 85 10.435 26.294 -13.988 611 1HB ALA 85 2HB ALA 85 8.723 28.779 -14.029 612 2HB ALA 85 1HB ALA 85 9.121 27.659 -15.355 613 3HB ALA 85 3HB ALA 85 10.346 28.805 -14.760 614 H ASP 86 H ASP 86 11.110 25.913 -11.461 615 HA ASP 86 HA ASP 86 12.440 28.354 -10.609 616 1HB ASP 86 1HB ASP 86 10.902 26.588 -9.163 617 2HB ASP 86 2HB ASP 86 12.494 25.911 -8.884 618 HD2 ASP 86 HD ASP 86 10.907 29.206 -8.218 619 H GLU 87 H GLU 87 13.505 26.954 -12.863 620 HA GLU 87 HA GLU 87 15.160 24.909 -12.540 621 1HB GLU 87 1HB GLU 87 15.198 27.367 -14.220 622 2HB GLU 87 2HB GLU 87 16.738 26.539 -14.102 623 1HG GLU 87 1HG GLU 87 14.585 24.600 -14.490 624 2HG GLU 87 2HG GLU 87 14.519 25.829 -15.738 625 HE2 GLU 87 HE GLU 87 17.119 25.296 -17.334 626 H GLU 88 H GLU 88 15.944 28.353 -11.713 627 HA GLU 88 HA GLU 88 18.515 28.067 -10.991 628 1HB GLU 88 1HB GLU 88 16.332 29.915 -10.399 629 2HB GLU 88 2HB GLU 88 17.398 29.768 -9.016 630 1HG GLU 88 1HG GLU 88 18.254 31.552 -10.433 631 2HG GLU 88 2HG GLU 88 19.371 30.205 -10.530 632 HE2 GLU 88 HE GLU 88 19.402 30.497 -13.746 633 H GLN 89 H GLN 89 15.588 27.176 -9.100 634 HA GLN 89 HA GLN 89 17.177 26.462 -6.839 635 1HB GLN 89 1HB GLN 89 14.891 27.391 -6.577 636 2HB GLN 89 2HB GLN 89 14.218 26.021 -7.438 637 1HG GLN 89 1HG GLN 89 15.774 24.805 -5.449 638 2HG GLN 89 2HG GLN 89 15.123 26.211 -4.630 639 1HE2 GLN 89 1HE2 GLN 89 14.619 23.127 -4.875 640 2HE2 GLN 89 2HE2 GLN 89 12.892 22.993 -4.883 641 H GLN 90 H GLN 90 15.851 24.932 -9.734 642 HA GLN 90 HA GLN 90 16.152 22.302 -8.659 643 1HB GLN 90 1HB GLN 90 14.561 23.353 -10.620 644 2HB GLN 90 2HB GLN 90 15.851 22.693 -11.606 645 1HG GLN 90 1HG GLN 90 15.567 20.468 -10.565 646 2HG GLN 90 2HG GLN 90 14.364 21.105 -9.461 647 1HE2 GLN 90 1HE2 GLN 90 13.148 19.303 -10.447 648 2HE2 GLN 90 2HE2 GLN 90 12.216 19.602 -11.876 649 H GLN 91 H GLN 91 18.275 24.664 -9.781 650 HA GLN 91 HA GLN 91 19.924 23.555 -11.552 651 1HB GLN 91 1HB GLN 91 20.282 25.783 -10.608 652 2HB GLN 91 2HB GLN 91 20.663 25.109 -9.036 653 1HG GLN 91 1HG GLN 91 22.839 24.943 -9.638 654 2HG GLN 91 2HG GLN 91 22.400 23.809 -10.900 655 1HE2 GLN 91 1HE2 GLN 91 24.126 24.684 -12.124 656 2HE2 GLN 91 2HE2 GLN 91 23.952 26.156 -13.019 657 H ALA 92 H ALA 92 20.308 23.132 -7.953 658 HA ALA 92 HA ALA 92 21.507 20.516 -8.545 659 1HB ALA 92 3HB ALA 92 22.369 22.580 -6.478 660 2HB ALA 92 1HB ALA 92 23.019 20.927 -6.605 661 3HB ALA 92 2HB ALA 92 23.275 22.088 -7.929 662 H LEU 93 H LEU 93 20.721 22.253 -5.475 663 HA LEU 93 HA LEU 93 18.706 20.171 -4.986 664 1HB LEU 93 1HB LEU 93 19.359 20.472 -2.551 665 2HB LEU 93 2HB LEU 93 20.433 19.552 -3.586 666 HG LEU 93 HG LEU 93 21.320 22.252 -3.675 667 1HD1 LEU 93 3HD1 LEU 93 20.000 21.725 -1.209 668 2HD1 LEU 93 1HD1 LEU 93 21.752 21.781 -0.897 669 3HD1 LEU 93 2HD1 LEU 93 20.944 23.156 -1.688 670 1HD2 LEU 93 2HD2 LEU 93 22.412 19.750 -3.575 671 2HD2 LEU 93 3HD2 LEU 93 23.321 21.273 -3.428 672 3HD2 LEU 93 1HD2 LEU 93 22.824 20.389 -1.965 673 H SER 94 H SER 94 19.690 23.119 -3.148 674 HA SER 94 HA SER 94 17.265 24.405 -4.009 675 1HB SER 94 1HB SER 94 16.525 24.853 -1.670 676 2HB SER 94 2HB SER 94 16.482 23.146 -2.066 677 HG SER 94 HG SER 94 18.740 24.380 -0.747 678 H SER 95 H SER 95 20.149 24.831 -4.425 679 HA SER 95 HA SER 95 21.486 26.442 -2.848 680 1HB SER 95 1HB SER 95 21.524 25.855 -5.574 681 2HB SER 95 2HB SER 95 21.343 27.598 -5.566 682 HG SER 95 HG SER 95 23.498 25.992 -4.616 683 H GLN 96 H GLN 96 18.423 27.219 -4.453 684 HA GLN 96 HA GLN 96 18.679 30.010 -3.874 685 1HB GLN 96 1HB GLN 96 17.449 28.882 -5.891 686 2HB GLN 96 2HB GLN 96 16.136 28.613 -4.762 687 1HG GLN 96 1HG GLN 96 15.624 30.705 -5.790 688 2HG GLN 96 2HG GLN 96 16.256 31.131 -4.212 689 1HE2 GLN 96 1HE2 GLN 96 16.199 32.908 -6.309 690 2HE2 GLN 96 2HE2 GLN 96 17.806 33.295 -6.825 691 H MET 97 H MET 97 18.843 28.101 -1.614 692 HA MET 97 HA MET 97 16.314 28.335 -0.296 693 1HB MET 97 1HB MET 97 18.728 26.745 -0.081 694 2HB MET 97 2HB MET 97 18.486 27.534 1.465 695 1HG MET 97 1HG MET 97 15.902 26.648 0.740 696 2HG MET 97 2HG MET 97 16.956 25.340 0.241 697 1HE MET 97 2HE MET 97 18.405 24.150 1.389 698 2HE MET 97 3HE MET 97 18.715 24.073 3.140 699 3HE MET 97 1HE MET 97 17.253 23.318 2.460 700 H GLY 98 H GLY 98 16.105 29.333 1.904 701 1HA GLY 98 2HA GLY 98 16.128 31.679 2.520 702 2HA GLY 98 1HA GLY 98 17.834 31.724 2.121 703 H PHE 99 H PHE 99 18.987 29.554 3.286 704 HA PHE 99 HA PHE 99 18.101 29.636 6.078 705 1HB PHE 99 1HB PHE 99 18.871 27.581 4.215 706 2HB PHE 99 2HB PHE 99 20.207 27.705 5.342 707 HD1 PHE 99 1HD PHE 99 20.128 26.137 7.015 708 HD2 PHE 99 2HD PHE 99 16.475 27.790 5.625 709 HE1 PHE 99 1HE PHE 99 18.864 24.732 8.667 710 HE2 PHE 99 2HE PHE 99 15.211 26.385 7.278 711 HZ PHE 99 HZ PHE 99 16.421 24.873 8.779 712 H MET 601 H MET 601 4.240 -27.999 -13.335 713 HA MET 601 HA MET 601 3.710 -26.525 -15.756 714 1HB MET 601 1HB MET 601 5.050 -29.189 -15.078 715 2HB MET 601 2HB MET 601 4.720 -28.746 -16.742 716 1HG MET 601 1HG MET 601 6.327 -27.001 -14.813 717 2HG MET 601 2HG MET 601 7.055 -28.133 -15.935 718 1HE MET 601 3HE MET 601 7.886 -25.354 -15.820 719 2HE MET 601 1HE MET 601 7.334 -24.248 -17.100 720 3HE MET 601 2HE MET 601 6.384 -24.424 -15.605 721 H THR 602 H THR 602 1.374 -27.169 -14.226 722 HA THR 602 HA THR 602 0.099 -29.518 -14.774 723 HB THR 602 HB THR 602 -0.848 -27.839 -13.290 724 HG1 THR 602 1HG THR 602 -2.970 -27.575 -14.557 725 1HG2 THR 602 3HG2 THR 602 -0.022 -25.949 -15.171 726 2HG2 THR 602 1HG2 THR 602 -1.780 -26.013 -15.438 727 3HG2 THR 602 2HG2 THR 602 -1.139 -25.619 -13.825 728 H GLU 603 H GLU 603 0.488 -26.680 -16.949 729 HA GLU 603 HA GLU 603 -0.168 -28.477 -19.114 730 1HB GLU 603 1HB GLU 603 -1.654 -25.922 -18.454 731 2HB GLU 603 2HB GLU 603 -1.524 -26.450 -20.120 732 1HG GLU 603 1HG GLU 603 -2.415 -28.436 -18.016 733 2HG GLU 603 2HG GLU 603 -3.563 -27.250 -18.605 734 HE2 GLU 603 HE GLU 603 -4.213 -29.623 -21.026 735 H GLN 604 H GLN 604 1.613 -28.401 -20.410 736 HA GLN 604 HA GLN 604 3.336 -26.151 -20.274 737 1HB GLN 604 1HB GLN 604 3.886 -28.705 -20.649 738 2HB GLN 604 2HB GLN 604 3.567 -28.356 -22.337 739 1HG GLN 604 1HG GLN 604 5.343 -26.748 -22.464 740 2HG GLN 604 2HG GLN 604 5.462 -26.612 -20.721 741 1HE2 GLN 604 1HE2 GLN 604 7.051 -27.638 -19.790 742 2HE2 GLN 604 2HE2 GLN 604 7.893 -29.033 -20.379 743 H GLN 605 H GLN 605 0.871 -27.442 -22.522 744 HA GLN 605 HA GLN 605 1.438 -26.149 -24.794 745 1HB GLN 605 1HB GLN 605 -1.161 -25.950 -25.017 746 2HB GLN 605 2HB GLN 605 -0.448 -27.543 -24.860 747 1HG GLN 605 1HG GLN 605 -1.168 -27.808 -22.636 748 2HG GLN 605 2HG GLN 605 -1.233 -26.082 -22.337 749 1HE2 GLN 605 1HE2 GLN 605 -3.271 -25.858 -21.670 750 2HE2 GLN 605 2HE2 GLN 605 -4.687 -26.203 -22.606 751 H TRP 606 H TRP 606 0.103 -24.757 -21.779 752 HA TRP 606 HA TRP 606 0.636 -22.109 -22.881 753 1HB TRP 606 1HB TRP 606 -1.993 -23.176 -22.509 754 2HB TRP 606 2HB TRP 606 -1.731 -21.910 -21.326 755 HD1 TRP 606 HD TRP 606 -2.066 -22.407 -25.118 756 HE1 TRP 606 1HE TRP 606 -2.371 -20.105 -26.371 757 HE3 TRP 606 3HE TRP 606 -1.112 -19.479 -21.072 758 HZ2 TRP 606 2HZ TRP 606 -2.184 -17.379 -25.548 759 HZ3 TRP 606 3HZ TRP 606 -1.193 -17.007 -21.382 760 HH2 TRP 606 HH TRP 606 -1.707 -15.950 -23.526 761 H ASN 607 H ASN 607 2.487 -22.017 -21.519 762 HA ASN 607 HA ASN 607 2.836 -22.919 -19.070 763 1HB ASN 607 1HB ASN 607 4.330 -20.934 -18.659 764 2HB ASN 607 2HB ASN 607 4.548 -21.602 -20.265 765 1HD2 ASN 607 1HD2 ASN 607 3.607 -20.568 -22.069 766 2HD2 ASN 607 2HD2 ASN 607 3.222 -18.879 -22.057 767 H PHE 608 H PHE 608 1.081 -22.932 -17.582 768 HA PHE 608 HA PHE 608 -0.646 -20.741 -17.245 769 1HB PHE 608 1HB PHE 608 -1.611 -22.205 -15.618 770 2HB PHE 608 2HB PHE 608 -0.781 -23.339 -16.664 771 HD1 PHE 608 1HD PHE 608 -1.406 -22.658 -13.378 772 HD2 PHE 608 2HD PHE 608 1.871 -23.546 -15.924 773 HE1 PHE 608 1HE PHE 608 -0.112 -23.527 -11.411 774 HE2 PHE 608 2HE PHE 608 3.164 -24.415 -13.957 775 HZ PHE 608 HZ PHE 608 2.158 -24.395 -11.723 776 H ALA 609 H ALA 609 2.558 -21.473 -16.030 777 HA ALA 609 HA ALA 609 2.398 -20.041 -13.609 778 1HB ALA 609 1HB ALA 609 4.707 -20.818 -15.432 779 2HB ALA 609 3HB ALA 609 4.137 -21.676 -13.980 780 3HB ALA 609 2HB ALA 609 4.915 -20.083 -13.824 781 H GLY 610 H GLY 610 2.159 -19.037 -16.859 782 1HA GLY 610 2HA GLY 610 2.887 -17.063 -17.892 783 2HA GLY 610 1HA GLY 610 3.362 -16.409 -16.337 784 H ILE 611 H ILE 611 0.367 -17.697 -17.960 785 HA ILE 611 HA ILE 611 -1.031 -15.313 -17.787 786 HB ILE 611 HB ILE 611 -1.658 -17.026 -19.315 787 1HG1 ILE 611 1HG1 ILE 611 -3.635 -16.140 -17.269 788 2HG1 ILE 611 2HG1 ILE 611 -3.546 -15.778 -18.981 789 1HG2 ILE 611 2HG2 ILE 611 -1.063 -18.826 -17.363 790 2HG2 ILE 611 3HG2 ILE 611 -2.842 -18.884 -17.356 791 3HG2 ILE 611 1HG2 ILE 611 -1.948 -19.205 -18.861 792 1HD1 ILE 611 2HD1 ILE 611 -4.020 -18.421 -19.199 793 2HD1 ILE 611 3HD1 ILE 611 -4.751 -18.158 -17.598 794 3HD1 ILE 611 1HD1 ILE 611 -5.342 -17.244 -19.007 795 H GLU 612 H GLU 612 -0.556 -17.955 -15.437 796 HA GLU 612 HA GLU 612 -2.615 -17.368 -13.736 797 1HB GLU 612 1HB GLU 612 -1.274 -19.375 -13.470 798 2HB GLU 612 2HB GLU 612 0.182 -18.441 -13.188 799 1HG GLU 612 1HG GLU 612 -1.474 -17.420 -11.227 800 2HG GLU 612 2HG GLU 612 -2.056 -19.071 -11.322 801 HE2 GLU 612 HE GLU 612 -0.371 -17.705 -9.319 802 H ALA 613 H ALA 613 0.537 -15.761 -14.208 803 HA ALA 613 HA ALA 613 0.184 -14.126 -11.854 804 1HB ALA 613 3HB ALA 613 2.412 -14.958 -12.569 805 2HB ALA 613 2HB ALA 613 2.346 -13.180 -12.532 806 3HB ALA 613 1HB ALA 613 2.254 -14.042 -14.087 807 H ALA 614 H ALA 614 -0.797 -14.162 -15.181 808 HA ALA 614 HA ALA 614 -0.786 -11.424 -15.732 809 1HB ALA 614 1HB ALA 614 -2.793 -13.478 -16.724 810 2HB ALA 614 2HB ALA 614 -2.218 -12.015 -17.559 811 3HB ALA 614 3HB ALA 614 -1.117 -13.392 -17.318 812 H ALA 615 H ALA 615 -3.392 -13.587 -14.415 813 HA ALA 615 HA ALA 615 -5.299 -11.606 -14.093 814 1HB ALA 615 3HB ALA 615 -6.497 -13.255 -13.005 815 2HB ALA 615 1HB ALA 615 -5.282 -14.263 -13.827 816 3HB ALA 615 2HB ALA 615 -5.078 -13.848 -12.108 817 H SER 616 H SER 616 -2.742 -12.807 -11.824 818 HA SER 616 HA SER 616 -3.462 -11.296 -9.671 819 1HB SER 616 1HB SER 616 -1.322 -12.980 -10.398 820 2HB SER 616 2HB SER 616 -0.546 -11.462 -9.991 821 HG SER 616 HG SER 616 -0.711 -12.340 -8.006 822 H ALA 617 H ALA 617 -1.839 -10.380 -12.689 823 HA ALA 617 HA ALA 617 -0.825 -7.904 -11.702 824 1HB ALA 617 1HB ALA 617 -0.788 -9.495 -14.153 825 2HB ALA 617 3HB ALA 617 0.384 -8.293 -13.563 826 3HB ALA 617 2HB ALA 617 -1.038 -7.766 -14.495 827 H ILE 618 H ILE 618 -3.759 -9.027 -13.466 828 HA ILE 618 HA ILE 618 -4.777 -6.501 -14.044 829 HB ILE 618 HB ILE 618 -6.213 -9.110 -13.541 830 1HG1 ILE 618 1HG1 ILE 618 -4.450 -9.255 -15.265 831 2HG1 ILE 618 2HG1 ILE 618 -6.060 -9.486 -15.915 832 1HG2 ILE 618 3HG2 ILE 618 -7.120 -6.515 -14.798 833 2HG2 ILE 618 1HG2 ILE 618 -7.936 -8.072 -15.078 834 3HG2 ILE 618 2HG2 ILE 618 -7.843 -7.399 -13.433 835 1HD1 ILE 618 2HD1 ILE 618 -5.589 -6.682 -16.043 836 2HD1 ILE 618 3HD1 ILE 618 -4.091 -7.464 -16.604 837 3HD1 ILE 618 1HD1 ILE 618 -5.639 -7.832 -17.401 838 H GLN 619 H GLN 619 -5.129 -8.633 -11.153 839 HA GLN 619 HA GLN 619 -7.014 -7.130 -9.856 840 1HB GLN 619 1HB GLN 619 -5.113 -9.254 -9.198 841 2HB GLN 619 2HB GLN 619 -5.299 -8.151 -7.849 842 1HG GLN 619 1HG GLN 619 -7.657 -9.388 -9.345 843 2HG GLN 619 2HG GLN 619 -6.963 -10.084 -7.894 844 1HE2 GLN 619 1HE2 GLN 619 -9.483 -8.435 -8.902 845 2HE2 GLN 619 2HE2 GLN 619 -9.831 -7.396 -7.560 846 H GLY 620 H GLY 620 -3.392 -6.961 -9.595 847 1HA GLY 620 2HA GLY 620 -2.028 -5.329 -8.869 848 2HA GLY 620 1HA GLY 620 -3.308 -4.819 -7.786 849 H ASN 621 H ASN 621 -3.419 -4.965 -11.395 850 HA ASN 621 HA ASN 621 -2.913 -2.239 -11.724 851 1HB ASN 621 1HB ASN 621 -4.087 -4.442 -13.458 852 2HB ASN 621 2HB ASN 621 -4.141 -2.787 -14.032 853 1HD2 ASN 621 1HD2 ASN 621 -1.916 -1.611 -13.401 854 2HD2 ASN 621 2HD2 ASN 621 -0.504 -2.407 -14.011 855 H VAL 622 H VAL 622 -5.836 -4.279 -11.284 856 HA VAL 622 HA VAL 622 -7.762 -2.425 -12.058 857 HB VAL 622 HB VAL 622 -7.727 -4.779 -10.183 858 1HG1 VAL 622 3HG1 VAL 622 -9.984 -2.860 -10.747 859 2HG1 VAL 622 1HG1 VAL 622 -10.309 -4.573 -10.385 860 3HG1 VAL 622 2HG1 VAL 622 -9.456 -3.558 -9.197 861 1HG2 VAL 622 3HG2 VAL 622 -7.678 -4.708 -12.887 862 2HG2 VAL 622 1HG2 VAL 622 -8.448 -6.010 -11.949 863 3HG2 VAL 622 2HG2 VAL 622 -9.436 -4.686 -12.611 864 H THR 623 H THR 623 -6.414 -3.177 -8.768 865 HA THR 623 HA THR 623 -7.851 -1.152 -7.462 866 HB THR 623 HB THR 623 -6.168 -1.624 -5.651 867 HG1 THR 623 1HG THR 623 -4.501 -3.243 -6.392 868 1HG2 THR 623 1HG2 THR 623 -7.320 -3.946 -7.244 869 2HG2 THR 623 2HG2 THR 623 -6.276 -4.257 -5.836 870 3HG2 THR 623 3HG2 THR 623 -7.801 -3.360 -5.634 871 H SER 624 H SER 624 -4.696 -1.157 -9.162 872 HA SER 624 HA SER 624 -3.718 1.196 -8.247 873 1HB SER 624 1HB SER 624 -3.294 -0.555 -10.516 874 2HB SER 624 2HB SER 624 -3.195 1.108 -11.063 875 HG SER 624 HG SER 624 -1.488 1.517 -9.686 876 H ILE 625 H ILE 625 -6.048 0.625 -10.964 877 HA ILE 625 HA ILE 625 -6.281 3.393 -11.563 878 HB ILE 625 HB ILE 625 -7.551 0.851 -12.441 879 1HG1 ILE 625 1HG1 ILE 625 -7.030 2.401 -14.643 880 2HG1 ILE 625 2HG1 ILE 625 -5.798 2.960 -13.529 881 1HG2 ILE 625 3HG2 ILE 625 -8.812 3.576 -12.722 882 2HG2 ILE 625 1HG2 ILE 625 -9.094 2.278 -13.906 883 3HG2 ILE 625 2HG2 ILE 625 -9.553 2.043 -12.203 884 1HD1 ILE 625 2HD1 ILE 625 -5.084 0.604 -13.122 885 2HD1 ILE 625 3HD1 ILE 625 -6.328 0.044 -14.266 886 3HD1 ILE 625 1HD1 ILE 625 -4.971 1.040 -14.845 887 H HIS 626 H HIS 626 -7.839 1.109 -9.340 888 HA HIS 626 HA HIS 626 -10.173 2.537 -8.884 889 1HB HIS 626 1HB HIS 626 -9.515 0.161 -8.180 890 2HB HIS 626 2HB HIS 626 -8.705 0.899 -6.813 891 HD1 HIS 626 1HD HIS 626 -10.545 -0.571 -5.436 892 HD2 HIS 626 2HD HIS 626 -11.995 2.724 -7.588 893 HE1 HIS 626 1HE HIS 626 -12.865 -0.070 -4.499 894 H SER 627 H SER 627 -6.919 2.707 -7.314 895 HA SER 627 HA SER 627 -7.807 4.801 -5.603 896 1HB SER 627 1HB SER 627 -5.157 3.424 -6.121 897 2HB SER 627 2HB SER 627 -5.208 4.889 -5.161 898 HG SER 627 HG SER 627 -7.114 3.522 -4.062 899 H LEU 628 H LEU 628 -5.628 4.449 -8.480 900 HA LEU 628 HA LEU 628 -4.639 6.946 -8.704 901 1HB LEU 628 1HB LEU 628 -5.406 4.812 -10.607 902 2HB LEU 628 2HB LEU 628 -5.148 6.402 -11.296 903 HG LEU 628 HG LEU 628 -3.063 5.316 -9.443 904 1HD1 LEU 628 3HD1 LEU 628 -3.924 3.961 -11.862 905 2HD1 LEU 628 1HD1 LEU 628 -2.232 4.501 -11.977 906 3HD1 LEU 628 2HD1 LEU 628 -2.745 3.461 -10.626 907 1HD2 LEU 628 1HD2 LEU 628 -2.931 7.614 -10.360 908 2HD2 LEU 628 2HD2 LEU 628 -1.559 6.586 -10.839 909 3HD2 LEU 628 3HD2 LEU 628 -2.863 6.927 -12.001 910 H LEU 629 H LEU 629 -7.853 5.846 -9.991 911 HA LEU 629 HA LEU 629 -8.665 8.269 -10.992 912 1HB LEU 629 1HB LEU 629 -9.823 5.716 -10.326 913 2HB LEU 629 2HB LEU 629 -10.935 7.004 -9.911 914 HG LEU 629 HG LEU 629 -11.246 6.055 -12.195 915 1HD1 LEU 629 3HD1 LEU 629 -10.808 8.948 -11.631 916 2HD1 LEU 629 1HD1 LEU 629 -11.062 8.460 -13.324 917 3HD1 LEU 629 2HD1 LEU 629 -12.288 8.074 -12.093 918 1HD2 LEU 629 1HD2 LEU 629 -8.682 5.850 -12.524 919 2HD2 LEU 629 2HD2 LEU 629 -9.707 6.275 -13.916 920 3HD2 LEU 629 3HD2 LEU 629 -8.783 7.541 -13.071 921 H ASP 630 H ASP 630 -8.884 6.984 -7.629 922 HA ASP 630 HA ASP 630 -10.358 9.129 -6.660 923 1HB ASP 630 1HB ASP 630 -10.088 6.963 -5.471 924 2HB ASP 630 2HB ASP 630 -8.378 7.275 -5.255 925 HD2 ASP 630 HD ASP 630 -11.079 7.238 -3.712 926 H GLU 631 H GLU 631 -6.952 8.628 -7.453 927 HA GLU 631 HA GLU 631 -5.961 10.673 -5.773 928 1HB GLU 631 1HB GLU 631 -4.902 8.703 -7.655 929 2HB GLU 631 2HB GLU 631 -4.121 10.255 -7.885 930 1HG GLU 631 1HG GLU 631 -3.400 10.355 -5.585 931 2HG GLU 631 2HG GLU 631 -4.471 9.051 -5.110 932 HE2 GLU 631 HE GLU 631 -0.885 8.376 -6.598 933 H GLY 632 H GLY 632 -6.797 10.387 -9.281 934 1HA GLY 632 2HA GLY 632 -6.975 11.951 -10.900 935 2HA GLY 632 1HA GLY 632 -6.031 13.057 -9.922 936 H LYS 633 H LYS 633 -9.067 11.424 -8.883 937 HA LYS 633 HA LYS 633 -10.849 13.424 -9.552 938 1HB LYS 633 1HB LYS 633 -11.198 11.009 -8.646 939 2HB LYS 633 2HB LYS 633 -11.133 11.753 -7.061 940 1HG LYS 633 1HG LYS 633 -13.466 11.659 -7.790 941 2HG LYS 633 2HG LYS 633 -12.960 13.336 -7.739 942 1HD LYS 633 1HD LYS 633 -12.284 12.526 -10.348 943 2HD LYS 633 2HD LYS 633 -13.805 11.709 -10.048 944 1HE LYS 633 1HE LYS 633 -14.896 13.835 -9.453 945 2HE LYS 633 2HE LYS 633 -13.370 14.692 -9.552 946 H GLN 634 H GLN 634 -8.510 13.171 -6.880 947 HA GLN 634 HA GLN 634 -9.665 15.271 -5.399 948 1HB GLN 634 1HB GLN 634 -6.978 13.859 -5.334 949 2HB GLN 634 2HB GLN 634 -7.304 15.224 -4.285 950 1HG GLN 634 1HG GLN 634 -9.474 13.197 -4.298 951 2HG GLN 634 2HG GLN 634 -7.941 12.575 -3.719 952 1HE2 GLN 634 1HE2 GLN 634 -10.709 13.710 -2.668 953 2HE2 GLN 634 2HE2 GLN 634 -10.259 14.580 -1.239 954 H SER 635 H SER 635 -7.507 15.052 -8.168 955 HA SER 635 HA SER 635 -6.559 17.736 -7.779 956 1HB SER 635 1HB SER 635 -5.744 15.399 -9.305 957 2HB SER 635 2HB SER 635 -5.866 16.780 -10.378 958 HG SER 635 HG SER 635 -4.113 17.638 -9.493 959 H LEU 636 H LEU 636 -9.211 16.055 -9.256 960 HA LEU 636 HA LEU 636 -9.665 17.727 -11.462 961 1HB LEU 636 1HB LEU 636 -10.931 15.519 -10.113 962 2HB LEU 636 2HB LEU 636 -12.127 16.733 -10.522 963 HG LEU 636 HG LEU 636 -11.802 14.928 -12.229 964 1HD1 LEU 636 3HD1 LEU 636 -11.415 17.827 -12.980 965 2HD1 LEU 636 1HD1 LEU 636 -11.672 16.545 -14.188 966 3HD1 LEU 636 2HD1 LEU 636 -12.916 16.872 -12.957 967 1HD2 LEU 636 2HD2 LEU 636 -9.346 14.727 -11.986 968 2HD2 LEU 636 3HD2 LEU 636 -9.867 14.944 -13.674 969 3HD2 LEU 636 1HD2 LEU 636 -9.163 16.311 -12.777 970 H THR 637 H THR 637 -10.998 17.743 -8.087 971 HA THR 637 HA THR 637 -12.447 20.153 -8.523 972 HB THR 637 HB THR 637 -13.308 18.730 -6.832 973 HG1 THR 637 1HG THR 637 -11.435 20.451 -5.385 974 1HG2 THR 637 2HG2 THR 637 -10.389 18.368 -6.095 975 2HG2 THR 637 3HG2 THR 637 -11.629 18.170 -4.833 976 3HG2 THR 637 1HG2 THR 637 -11.657 17.132 -6.279 977 H LYS 638 H LYS 638 -9.130 19.368 -7.579 978 HA LYS 638 HA LYS 638 -8.651 22.018 -6.574 979 1HB LYS 638 1HB LYS 638 -6.878 19.617 -7.074 980 2HB LYS 638 2HB LYS 638 -6.262 21.154 -6.502 981 1HG LYS 638 1HG LYS 638 -8.064 20.991 -4.630 982 2HG LYS 638 2HG LYS 638 -8.260 19.319 -5.118 983 1HD LYS 638 1HD LYS 638 -5.700 20.637 -4.105 984 2HD LYS 638 2HD LYS 638 -6.651 19.419 -3.278 985 1HE LYS 638 1HE LYS 638 -6.176 18.064 -5.587 986 2HE LYS 638 2HE LYS 638 -4.769 19.108 -5.602 987 H LEU 639 H LEU 639 -8.620 20.332 -9.649 988 HA LEU 639 HA LEU 639 -7.042 22.487 -10.837 989 1HB LEU 639 1HB LEU 639 -7.892 19.779 -11.864 990 2HB LEU 639 2HB LEU 639 -7.081 20.984 -12.844 991 HG LEU 639 HG LEU 639 -5.836 20.051 -10.268 992 1HD1 LEU 639 2HD1 LEU 639 -6.528 18.073 -11.726 993 2HD1 LEU 639 3HD1 LEU 639 -5.328 18.664 -12.900 994 3HD1 LEU 639 1HD1 LEU 639 -4.812 18.186 -11.265 995 1HD2 LEU 639 1HD2 LEU 639 -5.072 22.040 -11.821 996 2HD2 LEU 639 2HD2 LEU 639 -3.886 20.950 -11.063 997 3HD2 LEU 639 3HD2 LEU 639 -4.340 20.724 -12.769 998 H ALA 640 H ALA 640 -10.243 21.667 -10.090 999 HA ALA 640 HA ALA 640 -11.733 22.167 -12.292 1000 1HB ALA 640 2HB ALA 640 -13.478 22.591 -10.801 1001 2HB ALA 640 3HB ALA 640 -12.327 21.710 -9.769 1002 3HB ALA 640 1HB ALA 640 -12.433 23.484 -9.670 1003 H ALA 641 H ALA 641 -10.199 24.609 -10.097 1004 HA ALA 641 HA ALA 641 -11.192 26.878 -11.282 1005 1HB ALA 641 3HB ALA 641 -8.959 26.103 -9.539 1006 2HB ALA 641 2HB ALA 641 -10.010 27.537 -9.475 1007 3HB ALA 641 1HB ALA 641 -8.587 27.524 -10.545 1008 H ALA 642 H ALA 642 -8.676 24.615 -12.382 1009 HA ALA 642 HA ALA 642 -7.375 26.213 -14.217 1010 1HB ALA 642 2HB ALA 642 -6.988 23.755 -13.382 1011 2HB ALA 642 1HB ALA 642 -6.497 24.205 -15.033 1012 3HB ALA 642 3HB ALA 642 -8.015 23.315 -14.767 1013 H TRP 643 H TRP 643 -10.624 24.818 -14.247 1014 HA TRP 643 HA TRP 643 -10.924 25.331 -17.087 1015 1HB TRP 643 1HB TRP 643 -12.635 24.057 -14.969 1016 2HB TRP 643 2HB TRP 643 -13.314 24.537 -16.511 1017 HD1 TRP 643 HD TRP 643 -12.835 22.922 -18.576 1018 HE1 TRP 643 1HE TRP 643 -11.616 20.614 -18.966 1019 HE3 TRP 643 3HE TRP 643 -10.537 22.771 -14.042 1020 HZ2 TRP 643 2HZ TRP 643 -9.867 19.020 -17.371 1021 HZ3 TRP 643 3HZ TRP 643 -9.091 20.804 -13.538 1022 HH2 TRP 643 HH TRP 643 -8.739 18.971 -15.116 1023 H GLY 644 H GLY 644 -11.455 26.788 -13.923 1024 1HA GLY 644 2HA GLY 644 -13.352 28.747 -14.968 1025 2HA GLY 644 1HA GLY 644 -11.754 29.334 -14.551 1026 H GLY 645 H GLY 645 -13.120 26.563 -12.805 1027 1HA GLY 645 2HA GLY 645 -14.373 28.039 -10.722 1028 2HA GLY 645 1HA GLY 645 -12.729 27.621 -10.281 1029 H SER 646 H SER 646 -14.395 26.459 -8.630 1030 HA SER 646 HA SER 646 -14.578 23.737 -9.645 1031 1HB SER 646 1HB SER 646 -14.834 23.478 -6.928 1032 2HB SER 646 2HB SER 646 -13.308 23.382 -7.785 1033 HG SER 646 HG SER 646 -12.819 24.952 -6.366 1034 H GLY 647 H GLY 647 -16.681 24.633 -10.679 1035 1HA GLY 647 2HA GLY 647 -18.862 25.296 -8.955 1036 2HA GLY 647 1HA GLY 647 -18.911 23.614 -9.443 1037 H SER 648 H SER 648 -17.463 26.173 -11.480 1038 HA SER 648 HA SER 648 -19.650 26.925 -12.904 1039 1HB SER 648 1HB SER 648 -16.723 26.927 -13.286 1040 2HB SER 648 2HB SER 648 -17.596 26.864 -14.804 1041 HG SER 648 HG SER 648 -18.925 28.713 -13.812 1042 H GLU 649 H GLU 649 -20.658 26.192 -14.869 1043 HA GLU 649 HA GLU 649 -21.059 23.525 -15.079 1044 1HB GLU 649 1HB GLU 649 -22.549 25.162 -16.103 1045 2HB GLU 649 2HB GLU 649 -21.295 25.694 -17.205 1046 1HG GLU 649 1HG GLU 649 -21.860 24.077 -18.687 1047 2HG GLU 649 2HG GLU 649 -21.554 22.834 -17.490 1048 HE2 GLU 649 HE GLU 649 -24.900 23.414 -18.950 1049 H ALA 650 H ALA 650 -18.522 25.542 -16.592 1050 HA ALA 650 HA ALA 650 -17.630 23.849 -18.553 1051 1HB ALA 650 1HB ALA 650 -16.640 26.118 -16.996 1052 2HB ALA 650 3HB ALA 650 -16.359 25.703 -18.704 1053 3HB ALA 650 2HB ALA 650 -15.332 24.994 -17.435 1054 H TYR 651 H TYR 651 -15.960 24.146 -15.343 1055 HA TYR 651 HA TYR 651 -14.544 21.810 -15.533 1056 1HB TYR 651 1HB TYR 651 -14.034 23.329 -13.748 1057 2HB TYR 651 2HB TYR 651 -15.725 23.591 -13.370 1058 HD1 TYR 651 1HD TYR 651 -16.429 22.788 -11.319 1059 HD2 TYR 651 2HD TYR 651 -13.320 20.697 -13.384 1060 HE1 TYR 651 1HE TYR 651 -16.246 21.141 -9.390 1061 HE2 TYR 651 2HE TYR 651 -13.146 19.058 -11.448 1062 HH TYR 651 HH TYR 651 -14.914 19.591 -8.472 1063 H GLN 652 H GLN 652 -17.947 22.320 -14.563 1064 HA GLN 652 HA GLN 652 -18.348 19.905 -13.314 1065 1HB GLN 652 1HB GLN 652 -20.201 21.734 -14.883 1066 2HB GLN 652 2HB GLN 652 -20.794 20.283 -14.100 1067 1HG GLN 652 1HG GLN 652 -19.221 21.532 -12.116 1068 2HG GLN 652 2HG GLN 652 -20.038 22.864 -12.909 1069 1HE2 GLN 652 1HE2 GLN 652 -20.619 22.396 -10.354 1070 2HE2 GLN 652 2HE2 GLN 652 -22.199 21.716 -10.149 1071 H GLY 653 H GLY 653 -18.902 20.822 -16.789 1072 1HA GLY 653 2HA GLY 653 -18.949 19.579 -18.659 1073 2HA GLY 653 1HA GLY 653 -19.775 18.359 -17.711 1074 H VAL 654 H VAL 654 -16.539 19.438 -16.740 1075 HA VAL 654 HA VAL 654 -15.211 17.337 -18.179 1076 HB VAL 654 HB VAL 654 -14.370 19.432 -16.181 1077 1HG1 VAL 654 2HG1 VAL 654 -13.023 17.409 -15.784 1078 2HG1 VAL 654 3HG1 VAL 654 -12.591 17.359 -17.510 1079 3HG1 VAL 654 1HG1 VAL 654 -12.050 18.718 -16.496 1080 1HG2 VAL 654 2HG2 VAL 654 -14.825 19.585 -18.894 1081 2HG2 VAL 654 3HG2 VAL 654 -13.786 20.684 -17.955 1082 3HG2 VAL 654 1HG2 VAL 654 -13.070 19.299 -18.815 1083 H GLN 655 H GLN 655 -16.170 18.069 -14.772 1084 HA GLN 655 HA GLN 655 -14.963 15.973 -13.554 1085 1HB GLN 655 1HB GLN 655 -17.139 17.819 -12.980 1086 2HB GLN 655 2HB GLN 655 -17.519 16.239 -12.327 1087 1HG GLN 655 1HG GLN 655 -14.704 17.094 -11.872 1088 2HG GLN 655 2HG GLN 655 -15.896 18.114 -11.091 1089 1HE2 GLN 655 1HE2 GLN 655 -14.427 16.972 -9.365 1090 2HE2 GLN 655 2HE2 GLN 655 -15.127 15.582 -8.604 1091 H GLN 656 H GLN 656 -18.229 16.046 -15.131 1092 HA GLN 656 HA GLN 656 -18.846 13.413 -14.525 1093 1HB GLN 656 1HB GLN 656 -19.819 15.419 -16.564 1094 2HB GLN 656 2HB GLN 656 -20.374 13.761 -16.675 1095 1HG GLN 656 1HG GLN 656 -21.741 13.978 -14.861 1096 2HG GLN 656 2HG GLN 656 -20.498 14.764 -13.909 1097 1HE2 GLN 656 1HE2 GLN 656 -19.878 16.955 -15.416 1098 2HE2 GLN 656 2HE2 GLN 656 -21.221 18.045 -15.511 1099 H LYS 657 H LYS 657 -16.988 14.920 -17.181 1100 HA LYS 657 HA LYS 657 -16.929 12.623 -18.821 1101 1HB LYS 657 1HB LYS 657 -15.333 15.180 -18.689 1102 2HB LYS 657 2HB LYS 657 -14.904 13.901 -19.807 1103 1HG LYS 657 1HG LYS 657 -17.166 13.962 -20.808 1104 2HG LYS 657 2HG LYS 657 -17.687 15.149 -19.629 1105 1HD LYS 657 1HD LYS 657 -15.527 16.475 -20.593 1106 2HD LYS 657 2HD LYS 657 -15.875 15.496 -22.005 1107 1HE LYS 657 1HE LYS 657 -18.265 16.316 -21.942 1108 2HE LYS 657 2HE LYS 657 -17.850 17.351 -20.591 1109 H TRP 658 H TRP 658 -15.075 13.750 -16.007 1110 HA TRP 658 HA TRP 658 -12.932 11.913 -16.400 1111 1HB TRP 658 1HB TRP 658 -12.502 13.920 -15.203 1112 2HB TRP 658 2HB TRP 658 -13.820 13.629 -14.085 1113 HD1 TRP 658 HD TRP 658 -13.318 11.949 -12.028 1114 HE1 TRP 658 1HE TRP 658 -11.157 10.868 -10.969 1115 HE3 TRP 658 3HE TRP 658 -10.241 12.995 -15.939 1116 HZ2 TRP 658 2HZ TRP 658 -8.463 10.577 -11.865 1117 HZ3 TRP 658 3HZ TRP 658 -7.860 12.278 -15.766 1118 HH2 TRP 658 HH TRP 658 -6.959 11.108 -13.819 1119 H ASP 659 H ASP 659 -15.762 12.125 -14.117 1120 HA ASP 659 HA ASP 659 -15.335 9.637 -13.002 1121 1HB ASP 659 1HB ASP 659 -16.881 11.562 -12.231 1122 2HB ASP 659 2HB ASP 659 -18.049 10.970 -13.394 1123 HD2 ASP 659 HD ASP 659 -17.541 10.909 -10.294 1124 H ALA 660 H ALA 660 -17.037 10.772 -15.940 1125 HA ALA 660 HA ALA 660 -18.606 8.552 -16.470 1126 1HB ALA 660 1HB ALA 660 -18.994 10.508 -17.731 1127 2HB ALA 660 3HB ALA 660 -18.261 9.388 -18.904 1128 3HB ALA 660 2HB ALA 660 -17.277 10.677 -18.170 1129 H THR 661 H THR 661 -15.721 9.267 -18.509 1130 HA THR 661 HA THR 661 -15.311 6.658 -19.284 1131 HB THR 661 HB THR 661 -12.896 7.638 -19.687 1132 HG1 THR 661 1HG THR 661 -12.728 9.776 -18.985 1133 1HG2 THR 661 1HG2 THR 661 -15.407 8.141 -20.999 1134 2HG2 THR 661 2HG2 THR 661 -14.535 9.691 -20.917 1135 3HG2 THR 661 3HG2 THR 661 -13.775 8.281 -21.693 1136 H ALA 662 H ALA 662 -14.589 8.176 -16.208 1137 HA ALA 662 HA ALA 662 -12.508 6.513 -15.386 1138 1HB ALA 662 3HB ALA 662 -12.843 8.383 -14.048 1139 2HB ALA 662 2HB ALA 662 -13.616 7.121 -13.059 1140 3HB ALA 662 1HB ALA 662 -14.614 8.206 -14.057 1141 H THR 663 H THR 663 -15.790 6.304 -13.905 1142 HA THR 663 HA THR 663 -15.603 3.726 -13.061 1143 HB THR 663 HB THR 663 -17.441 5.037 -12.303 1144 HG1 THR 663 1HG THR 663 -18.519 3.119 -12.631 1145 1HG2 THR 663 3HG2 THR 663 -17.466 6.025 -15.030 1146 2HG2 THR 663 1HG2 THR 663 -19.077 5.373 -14.646 1147 3HG2 THR 663 2HG2 THR 663 -18.367 6.649 -13.628 1148 H GLU 664 H GLU 664 -15.912 4.852 -16.363 1149 HA GLU 664 HA GLU 664 -17.069 2.552 -17.413 1150 1HB GLU 664 1HB GLU 664 -17.039 4.577 -18.721 1151 2HB GLU 664 2HB GLU 664 -15.295 4.710 -18.615 1152 1HG GLU 664 1HG GLU 664 -15.976 3.843 -20.834 1153 2HG GLU 664 2HG GLU 664 -15.019 2.656 -19.971 1154 HE2 GLU 664 HE GLU 664 -16.842 0.926 -21.495 1155 H LEU 665 H LEU 665 -13.607 3.589 -17.084 1156 HA LEU 665 HA LEU 665 -12.680 1.074 -18.098 1157 1HB LEU 665 1HB LEU 665 -11.574 3.304 -18.429 1158 2HB LEU 665 2HB LEU 665 -11.128 3.275 -16.735 1159 HG LEU 665 HG LEU 665 -9.244 2.583 -18.040 1160 1HD1 LEU 665 1HD1 LEU 665 -10.084 1.262 -15.879 1161 2HD1 LEU 665 2HD1 LEU 665 -10.107 -0.086 -17.042 1162 3HD1 LEU 665 3HD1 LEU 665 -8.601 0.821 -16.760 1163 1HD2 LEU 665 1HD2 LEU 665 -11.103 0.549 -19.293 1164 2HD2 LEU 665 2HD2 LEU 665 -10.270 1.905 -20.090 1165 3HD2 LEU 665 3HD2 LEU 665 -9.332 0.528 -19.466 1166 H ASN 666 H ASN 666 -13.434 2.543 -14.961 1167 HA ASN 666 HA ASN 666 -11.930 0.812 -13.404 1168 1HB ASN 666 1HB ASN 666 -13.695 2.970 -12.982 1169 2HB ASN 666 2HB ASN 666 -14.515 1.628 -12.209 1170 1HD2 ASN 666 1HD2 ASN 666 -13.429 3.886 -10.911 1171 2HD2 ASN 666 2HD2 ASN 666 -12.169 3.374 -9.837 1172 H ASN 667 H ASN 667 -15.396 0.797 -14.507 1173 HA ASN 667 HA ASN 667 -16.072 -1.555 -13.198 1174 1HB ASN 667 1HB ASN 667 -18.133 -1.369 -14.347 1175 2HB ASN 667 2HB ASN 667 -17.563 0.288 -14.372 1176 1HD2 ASN 667 1HD2 ASN 667 -17.725 1.268 -16.226 1177 2HD2 ASN 667 2HD2 ASN 667 -17.644 0.562 -17.806 1178 H ALA 668 H ALA 668 -14.789 -0.767 -16.477 1179 HA ALA 668 HA ALA 668 -15.101 -3.301 -17.613 1180 1HB ALA 668 2HB ALA 668 -14.530 -0.968 -18.644 1181 2HB ALA 668 1HB ALA 668 -13.822 -2.428 -19.375 1182 3HB ALA 668 3HB ALA 668 -12.843 -1.411 -18.291 1183 H LEU 669 H LEU 669 -12.590 -1.847 -15.512 1184 HA LEU 669 HA LEU 669 -10.737 -3.958 -15.872 1185 1HB LEU 669 1HB LEU 669 -10.954 -1.471 -14.397 1186 2HB LEU 669 2HB LEU 669 -10.243 -2.733 -13.411 1187 HG LEU 669 HG LEU 669 -9.216 -2.190 -16.192 1188 1HD1 LEU 669 1HD1 LEU 669 -9.318 -0.088 -14.682 1189 2HD1 LEU 669 2HD1 LEU 669 -8.001 -0.872 -13.777 1190 3HD1 LEU 669 3HD1 LEU 669 -7.791 -0.492 -15.503 1191 1HD2 LEU 669 2HD2 LEU 669 -8.643 -4.213 -14.525 1192 2HD2 LEU 669 3HD2 LEU 669 -7.459 -3.511 -15.654 1193 3HD2 LEU 669 1HD2 LEU 669 -7.460 -3.017 -13.944 1194 H GLN 670 H GLN 670 -13.401 -3.260 -13.563 1195 HA GLN 670 HA GLN 670 -12.780 -5.354 -11.837 1196 1HB GLN 670 1HB GLN 670 -15.263 -3.712 -12.385 1197 2HB GLN 670 2HB GLN 670 -15.349 -5.072 -11.283 1198 1HG GLN 670 1HG GLN 670 -14.277 -3.924 -9.637 1199 2HG GLN 670 2HG GLN 670 -12.980 -3.447 -10.716 1200 1HE2 GLN 670 1HE2 GLN 670 -12.746 -1.355 -10.362 1201 2HE2 GLN 670 2HE2 GLN 670 -13.973 -0.141 -10.507 1202 H ASN 671 H ASN 671 -15.135 -5.085 -14.587 1203 HA ASN 671 HA ASN 671 -16.126 -7.642 -14.347 1204 1HB ASN 671 1HB ASN 671 -16.908 -5.625 -15.836 1205 2HB ASN 671 2HB ASN 671 -15.751 -6.208 -17.015 1206 1HD2 ASN 671 1HD2 ASN 671 -16.566 -7.444 -18.508 1207 2HD2 ASN 671 2HD2 ASN 671 -17.895 -8.545 -18.361 1208 H LEU 672 H LEU 672 -13.170 -6.295 -15.821 1209 HA LEU 672 HA LEU 672 -12.561 -8.609 -17.367 1210 1HB LEU 672 1HB LEU 672 -11.751 -6.545 -18.145 1211 2HB LEU 672 2HB LEU 672 -11.078 -6.113 -16.586 1212 HG LEU 672 HG LEU 672 -9.665 -8.387 -17.137 1213 1HD1 LEU 672 2HD1 LEU 672 -10.528 -7.186 -19.741 1214 2HD1 LEU 672 3HD1 LEU 672 -8.881 -7.842 -19.585 1215 3HD1 LEU 672 1HD1 LEU 672 -10.289 -8.891 -19.288 1216 1HD2 LEU 672 3HD2 LEU 672 -9.202 -5.578 -16.967 1217 2HD2 LEU 672 1HD2 LEU 672 -8.067 -6.920 -16.688 1218 3HD2 LEU 672 2HD2 LEU 672 -8.239 -6.225 -18.317 1219 H ALA 673 H ALA 673 -11.433 -7.238 -14.210 1220 HA ALA 673 HA ALA 673 -9.694 -9.424 -13.712 1221 1HB ALA 673 2HB ALA 673 -10.077 -6.875 -12.710 1222 2HB ALA 673 3HB ALA 673 -10.690 -7.901 -11.391 1223 3HB ALA 673 1HB ALA 673 -9.027 -8.118 -11.988 1224 H ARG 674 H ARG 674 -13.134 -8.920 -13.503 1225 HA ARG 674 HA ARG 674 -13.609 -10.668 -11.374 1226 1HB ARG 674 1HB ARG 674 -15.250 -9.387 -13.556 1227 2HB ARG 674 2HB ARG 674 -15.963 -10.754 -12.724 1228 1HG ARG 674 1HG ARG 674 -14.781 -9.043 -10.727 1229 2HG ARG 674 2HG ARG 674 -15.716 -8.026 -11.805 1230 1HD ARG 674 1HD ARG 674 -17.074 -10.566 -11.032 1231 2HD ARG 674 2HD ARG 674 -16.778 -9.470 -9.697 1232 HE ARG 674 HE ARG 674 -17.820 -7.761 -11.554 1233 2HH1 ARG 674 1HH ARG 674 -21.221 -8.461 -11.620 1234 1HH2 ARG 674 2HH2 ARG 674 -18.924 -10.936 -10.435 1235 2HH2 ARG 674 1HH2 ARG 674 -20.596 -10.597 -10.732 1236 H THR 675 H THR 675 -13.160 -11.032 -14.895 1237 HA THR 675 HA THR 675 -13.773 -13.899 -14.660 1238 HB THR 675 HB THR 675 -13.586 -12.034 -17.086 1239 HG1 THR 675 1HG THR 675 -15.431 -11.759 -15.590 1240 1HG2 THR 675 2HG2 THR 675 -13.299 -14.778 -17.140 1241 2HG2 THR 675 3HG2 THR 675 -15.072 -14.627 -17.172 1242 3HG2 THR 675 1HG2 THR 675 -14.090 -13.846 -18.434 1243 H ILE 676 H ILE 676 -11.200 -11.664 -14.657 1244 HA ILE 676 HA ILE 676 -9.383 -13.564 -15.917 1245 HB ILE 676 HB ILE 676 -9.229 -10.673 -15.137 1246 1HG1 ILE 676 1HG1 ILE 676 -8.903 -12.246 -17.698 1247 2HG1 ILE 676 2HG1 ILE 676 -10.121 -11.047 -17.310 1248 1HG2 ILE 676 2HG2 ILE 676 -7.041 -12.592 -15.055 1249 2HG2 ILE 676 3HG2 ILE 676 -6.750 -11.285 -16.228 1250 3HG2 ILE 676 1HG2 ILE 676 -7.100 -10.893 -14.528 1251 1HD1 ILE 676 3HD1 ILE 676 -8.006 -9.457 -16.954 1252 2HD1 ILE 676 1HD1 ILE 676 -7.217 -10.648 -18.015 1253 3HD1 ILE 676 2HD1 ILE 676 -8.651 -9.761 -18.585 1254 H SER 677 H SER 677 -9.699 -11.663 -12.834 1255 HA SER 677 HA SER 677 -7.675 -12.697 -11.457 1256 1HB SER 677 1HB SER 677 -8.911 -12.191 -9.431 1257 2HB SER 677 2HB SER 677 -9.337 -10.998 -10.641 1258 HG SER 677 HG SER 677 -10.893 -13.214 -9.671 1259 H GLU 678 H GLU 678 -10.738 -14.315 -12.321 1260 HA GLU 678 HA GLU 678 -10.522 -16.432 -10.540 1261 1HB GLU 678 1HB GLU 678 -12.010 -17.595 -12.355 1262 2HB GLU 678 2HB GLU 678 -12.639 -16.191 -11.516 1263 1HG GLU 678 1HG GLU 678 -12.730 -14.966 -13.432 1264 2HG GLU 678 2HG GLU 678 -11.082 -15.378 -13.861 1265 HE2 GLU 678 HE GLU 678 -14.063 -17.270 -15.632 1266 H ALA 679 H ALA 679 -9.020 -15.753 -13.692 1267 HA ALA 679 HA ALA 679 -8.300 -18.169 -14.621 1268 1HB ALA 679 1HB ALA 679 -6.358 -15.846 -14.370 1269 2HB ALA 679 2HB ALA 679 -6.455 -17.060 -15.668 1270 3HB ALA 679 3HB ALA 679 -7.737 -15.838 -15.495 1271 H GLY 680 H GLY 680 -7.217 -16.604 -11.628 1272 1HA GLY 680 2HA GLY 680 -6.206 -17.558 -9.835 1273 2HA GLY 680 1HA GLY 680 -4.883 -17.734 -10.971 1274 H GLN 681 H GLN 681 -7.771 -19.362 -9.583 1275 HA GLN 681 HA GLN 681 -6.513 -21.882 -10.348 1276 1HB GLN 681 1HB GLN 681 -7.656 -20.909 -7.780 1277 2HB GLN 681 2HB GLN 681 -8.134 -22.537 -8.216 1278 1HG GLN 681 1HG GLN 681 -5.363 -22.430 -8.797 1279 2HG GLN 681 2HG GLN 681 -5.530 -21.557 -7.287 1280 1HE2 GLN 681 1HE2 GLN 681 -4.274 -24.098 -7.768 1281 2HE2 GLN 681 2HE2 GLN 681 -5.071 -25.288 -6.794 1282 H ALA 682 H ALA 682 -9.452 -19.906 -10.207 1283 HA ALA 682 HA ALA 682 -11.485 -21.608 -10.512 1284 1HB ALA 682 2HB ALA 682 -11.375 -19.430 -12.545 1285 2HB ALA 682 1HB ALA 682 -11.123 -18.942 -10.852 1286 3HB ALA 682 3HB ALA 682 -12.615 -19.792 -11.321 1287 H MET 683 H MET 683 -9.806 -20.297 -13.457 1288 HA MET 683 HA MET 683 -10.804 -21.898 -15.293 1289 1HB MET 683 1HB MET 683 -8.492 -20.268 -14.993 1290 2HB MET 683 2HB MET 683 -7.864 -21.796 -15.579 1291 1HG MET 683 1HG MET 683 -10.006 -20.066 -16.898 1292 2HG MET 683 2HG MET 683 -8.401 -20.408 -17.512 1293 1HE MET 683 1HE MET 683 -11.778 -20.967 -17.297 1294 2HE MET 683 2HE MET 683 -12.075 -22.143 -18.600 1295 3HE MET 683 3HE MET 683 -12.039 -22.683 -16.904 1296 H ALA 684 H ALA 684 -8.589 -22.892 -12.715 1297 HA ALA 684 HA ALA 684 -8.073 -25.447 -13.975 1298 1HB ALA 684 2HB ALA 684 -6.507 -25.764 -12.233 1299 2HB ALA 684 3HB ALA 684 -6.423 -24.020 -12.580 1300 3HB ALA 684 1HB ALA 684 -7.328 -24.603 -11.163 1301 H SER 685 H SER 685 -9.820 -24.075 -11.116 1302 HA SER 685 HA SER 685 -10.673 -26.406 -10.028 1303 1HB SER 685 1HB SER 685 -11.988 -23.672 -10.217 1304 2HB SER 685 2HB SER 685 -12.724 -24.975 -9.304 1305 HG SER 685 HG SER 685 -11.441 -24.379 -7.705 1306 H THR 686 H THR 686 -13.186 -24.383 -11.615 1307 HA THR 686 HA THR 686 -13.755 -26.113 -13.743 1308 HB THR 686 HB THR 686 -14.964 -26.760 -11.061 1309 HG1 THR 686 1HG THR 686 -13.437 -28.121 -12.281 1310 1HG2 THR 686 1HG2 THR 686 -16.427 -27.154 -13.725 1311 2HG2 THR 686 2HG2 THR 686 -16.942 -27.776 -12.139 1312 3HG2 THR 686 3HG2 THR 686 -16.949 -26.024 -12.453 1313 H GLU 687 H GLU 687 -15.714 -25.484 -14.913 1314 HA GLU 687 HA GLU 687 -16.069 -22.682 -14.625 1315 1HB GLU 687 1HB GLU 687 -15.999 -24.217 -16.792 1316 2HB GLU 687 2HB GLU 687 -17.717 -24.392 -16.495 1317 1HG GLU 687 1HG GLU 687 -18.151 -22.087 -16.816 1318 2HG GLU 687 2HG GLU 687 -16.498 -21.621 -16.465 1319 HE2 GLU 687 HE GLU 687 -15.490 -21.187 -19.085 1320 H GLY 688 H GLY 688 -17.615 -21.666 -13.423 1321 1HA GLY 688 2HA GLY 688 -20.264 -22.761 -13.182 1322 2HA GLY 688 1HA GLY 688 -19.653 -21.265 -12.503 1323 H ASN 689 H ASN 689 -17.271 -23.257 -11.545 1324 HA ASN 689 HA ASN 689 -18.673 -24.648 -9.481 1325 1HB ASN 689 1HB ASN 689 -16.191 -24.948 -10.810 1326 2HB ASN 689 2HB ASN 689 -15.740 -24.474 -9.185 1327 1HD2 ASN 689 1HD2 ASN 689 -15.855 -25.883 -7.567 1328 2HD2 ASN 689 2HD2 ASN 689 -16.485 -27.493 -7.660 1329 H VAL 690 H VAL 690 -16.105 -22.075 -9.765 1330 HA VAL 690 HA VAL 690 -16.290 -21.440 -6.977 1331 HB VAL 690 HB VAL 690 -14.569 -19.876 -7.427 1332 1HG1 VAL 690 2HG1 VAL 690 -14.238 -22.358 -9.141 1333 2HG1 VAL 690 3HG1 VAL 690 -12.909 -21.259 -8.700 1334 3HG1 VAL 690 1HG1 VAL 690 -13.785 -22.152 -7.432 1335 1HG2 VAL 690 1HG2 VAL 690 -15.285 -20.176 -10.361 1336 2HG2 VAL 690 2HG2 VAL 690 -15.455 -18.722 -9.348 1337 3HG2 VAL 690 3HG2 VAL 690 -13.836 -19.336 -9.759 1338 H THR 691 H THR 691 -17.828 -20.183 -6.072 1339 HA THR 691 HA THR 691 -19.074 -18.149 -7.801 1340 HB THR 691 HB THR 691 -20.293 -20.148 -5.843 1341 HG1 THR 691 1HG THR 691 -20.713 -19.201 -8.592 1342 1HG2 THR 691 3HG2 THR 691 -21.369 -17.500 -6.887 1343 2HG2 THR 691 1HG2 THR 691 -22.470 -18.873 -6.620 1344 3HG2 THR 691 2HG2 THR 691 -21.539 -18.201 -5.260 1345 H GLY 692 H GLY 692 -18.221 -19.149 -4.440 1346 1HA GLY 692 2HA GLY 692 -17.507 -17.905 -2.704 1347 2HA GLY 692 1HA GLY 692 -18.870 -16.868 -3.077 1348 H MET 693 H MET 693 -15.611 -17.591 -4.539 1349 HA MET 693 HA MET 693 -14.460 -15.212 -3.990 1350 1HB MET 693 1HB MET 693 -13.783 -17.498 -5.381 1351 2HB MET 693 2HB MET 693 -13.916 -16.369 -6.714 1352 1HG MET 693 1HG MET 693 -12.469 -14.912 -4.799 1353 2HG MET 693 2HG MET 693 -11.851 -16.541 -4.605 1354 1HE MET 693 3HE MET 693 -9.882 -16.843 -5.362 1355 2HE MET 693 1HE MET 693 -9.182 -16.538 -6.970 1356 3HE MET 693 2HE MET 693 -9.291 -15.217 -5.782 1357 H PHE 694 H PHE 694 -16.395 -16.081 -6.932 1358 HA PHE 694 HA PHE 694 -16.087 -13.586 -8.169 1359 1HB PHE 694 1HB PHE 694 -18.024 -15.948 -8.262 1360 2HB PHE 694 2HB PHE 694 -18.369 -14.533 -9.236 1361 HD1 PHE 694 1HD PHE 694 -15.305 -16.550 -8.489 1362 HD2 PHE 694 2HD PHE 694 -17.803 -14.805 -11.443 1363 HE1 PHE 694 1HE PHE 694 -13.784 -17.417 -10.287 1364 HE2 PHE 694 2HE PHE 694 -16.282 -15.672 -13.241 1365 HZ PHE 694 HZ PHE 694 -14.291 -16.968 -12.642 1366 H ALA 695 H ALA 695 -17.914 -12.023 -8.629 1367 HA ALA 695 HA ALA 695 -18.974 -11.109 -6.166 1368 1HB ALA 695 3HB ALA 695 -19.098 -9.196 -7.343 1369 2HB ALA 695 2HB ALA 695 -20.189 -9.937 -8.538 1370 3HB ALA 695 1HB ALA 695 -18.426 -10.083 -8.732 No H/Q in entry = 1370 Start of MODEL 21 1 H ALA 1 H ALA 1 -8.205 38.275 -3.529 2 HA ALA 1 HA ALA 1 -8.344 35.566 -2.470 3 1HB ALA 1 3HB ALA 1 -9.846 35.359 -4.306 4 2HB ALA 1 2HB ALA 1 -8.285 34.746 -4.903 5 3HB ALA 1 1HB ALA 1 -8.830 36.380 -5.353 6 H GLU 2 H GLU 2 -6.393 34.291 -3.072 7 HA GLU 2 HA GLU 2 -4.213 36.053 -3.871 8 1HB GLU 2 1HB GLU 2 -4.554 35.132 -1.292 9 2HB GLU 2 2HB GLU 2 -3.521 33.883 -1.958 10 1HG GLU 2 1HG GLU 2 -1.913 35.640 -2.744 11 2HG GLU 2 2HG GLU 2 -2.944 36.883 -2.061 12 HE2 GLU 2 HE GLU 2 -0.585 34.374 -0.417 13 H MET 3 H MET 3 -4.798 32.544 -3.075 14 HA MET 3 HA MET 3 -3.709 31.958 -5.719 15 1HB MET 3 1HB MET 3 -3.266 30.533 -3.041 16 2HB MET 3 2HB MET 3 -2.827 29.807 -4.574 17 1HG MET 3 1HG MET 3 -0.853 30.926 -4.510 18 2HG MET 3 2HG MET 3 -1.727 32.440 -4.630 19 1HE MET 3 3HE MET 3 0.542 33.120 -3.489 20 2HE MET 3 1HE MET 3 0.843 33.010 -1.738 21 3HE MET 3 2HE MET 3 1.142 31.600 -2.783 22 H LYS 4 H LYS 4 -5.853 31.795 -6.611 23 HA LYS 4 HA LYS 4 -7.510 29.687 -5.438 24 1HB LYS 4 1HB LYS 4 -8.640 31.802 -5.666 25 2HB LYS 4 2HB LYS 4 -8.147 31.957 -7.340 26 1HG LYS 4 1HG LYS 4 -9.844 30.624 -8.075 27 2HG LYS 4 2HG LYS 4 -9.513 29.398 -6.867 28 1HD LYS 4 1HD LYS 4 -10.659 31.812 -5.644 29 2HD LYS 4 2HD LYS 4 -11.703 31.183 -6.903 30 1HE LYS 4 1HE LYS 4 -12.462 29.744 -5.299 31 2HE LYS 4 2HE LYS 4 -10.986 28.849 -5.600 32 H THR 5 H THR 5 -6.706 30.915 -8.767 33 HA THR 5 HA THR 5 -6.427 28.089 -9.558 34 HB THR 5 HB THR 5 -8.361 28.708 -10.718 35 HG1 THR 5 1HG THR 5 -7.543 29.450 -12.848 36 1HG2 THR 5 1HG2 THR 5 -7.204 31.525 -10.604 37 2HG2 THR 5 2HG2 THR 5 -8.493 31.113 -11.760 38 3HG2 THR 5 3HG2 THR 5 -8.783 30.957 -10.011 39 H ASP 6 H ASP 6 -4.760 30.890 -8.886 40 HA ASP 6 HA ASP 6 -3.193 31.594 -10.833 41 1HB ASP 6 1HB ASP 6 -1.213 31.226 -9.033 42 2HB ASP 6 2HB ASP 6 -2.426 32.476 -8.846 43 HD2 ASP 6 HD ASP 6 -4.058 29.772 -6.783 44 H ALA 7 H ALA 7 -1.650 30.676 -12.247 45 HA ALA 7 HA ALA 7 -1.569 28.013 -12.754 46 1HB ALA 7 2HB ALA 7 -0.012 30.406 -13.441 47 2HB ALA 7 3HB ALA 7 0.959 28.916 -13.491 48 3HB ALA 7 1HB ALA 7 -0.523 29.045 -14.468 49 H ALA 8 H ALA 8 0.293 29.881 -10.340 50 HA ALA 8 HA ALA 8 2.212 27.949 -9.761 51 1HB ALA 8 1HB ALA 8 2.731 29.970 -8.809 52 2HB ALA 8 3HB ALA 8 1.927 29.232 -7.404 53 3HB ALA 8 2HB ALA 8 1.032 30.360 -8.449 54 H THR 9 H THR 9 -1.120 28.505 -8.477 55 HA THR 9 HA THR 9 -0.933 26.341 -6.623 56 HB THR 9 HB THR 9 -2.486 28.583 -6.865 57 HG1 THR 9 1HG THR 9 -3.551 27.527 -5.104 58 1HG2 THR 9 3HG2 THR 9 -4.153 26.200 -7.833 59 2HG2 THR 9 1HG2 THR 9 -4.835 27.728 -7.226 60 3HG2 THR 9 2HG2 THR 9 -3.875 27.715 -8.725 61 H LEU 10 H LEU 10 -2.543 26.786 -9.836 62 HA LEU 10 HA LEU 10 -3.657 24.266 -9.971 63 1HB LEU 10 1HB LEU 10 -2.712 26.231 -12.039 64 2HB LEU 10 2HB LEU 10 -3.383 24.681 -12.506 65 HG LEU 10 HG LEU 10 -4.808 26.784 -10.851 66 1HD1 LEU 10 1HD1 LEU 10 -4.451 27.469 -13.189 67 2HD1 LEU 10 2HD1 LEU 10 -5.247 25.975 -13.739 68 3HD1 LEU 10 3HD1 LEU 10 -6.170 27.188 -12.820 69 1HD2 LEU 10 3HD2 LEU 10 -5.666 24.060 -11.835 70 2HD2 LEU 10 1HD2 LEU 10 -5.671 24.697 -10.172 71 3HD2 LEU 10 2HD2 LEU 10 -6.825 25.329 -11.371 72 H ALA 11 H ALA 11 -0.403 25.405 -11.096 73 HA ALA 11 HA ALA 11 0.420 22.917 -12.058 74 1HB ALA 11 1HB ALA 11 1.841 25.411 -11.085 75 2HB ALA 11 2HB ALA 11 2.740 23.990 -11.670 76 3HB ALA 11 3HB ALA 11 1.614 24.840 -12.755 77 H GLN 12 H GLN 12 0.160 24.273 -8.801 78 HA GLN 12 HA GLN 12 1.994 22.569 -7.583 79 1HB GLN 12 1HB GLN 12 0.872 24.725 -6.678 80 2HB GLN 12 2HB GLN 12 -0.489 23.708 -6.249 81 1HG GLN 12 1HG GLN 12 2.271 22.826 -5.397 82 2HG GLN 12 2HG GLN 12 1.521 24.150 -4.527 83 1HE2 GLN 12 1HE2 GLN 12 1.811 20.836 -4.826 84 2HE2 GLN 12 2HE2 GLN 12 0.483 20.314 -3.843 85 H GLU 13 H GLU 13 -1.502 22.285 -8.360 86 HA GLU 13 HA GLU 13 -1.519 19.677 -7.104 87 1HB GLU 13 1HB GLU 13 -3.790 21.301 -8.336 88 2HB GLU 13 2HB GLU 13 -3.984 19.773 -7.500 89 1HG GLU 13 1HG GLU 13 -2.803 22.301 -6.252 90 2HG GLU 13 2HG GLU 13 -4.454 21.757 -6.030 91 HE2 GLU 13 HE GLU 13 -1.989 21.143 -3.593 92 H ALA 14 H ALA 14 -1.973 21.315 -10.283 93 HA ALA 14 HA ALA 14 -2.755 19.140 -11.779 94 1HB ALA 14 2HB ALA 14 -2.774 21.431 -12.611 95 2HB ALA 14 1HB ALA 14 -1.765 20.429 -13.681 96 3HB ALA 14 3HB ALA 14 -1.000 21.520 -12.502 97 H GLY 15 H GLY 15 0.588 20.308 -10.993 98 1HA GLY 15 2HA GLY 15 2.543 19.200 -10.905 99 2HA GLY 15 1HA GLY 15 2.060 18.493 -12.434 100 H ASN 16 H ASN 16 0.229 18.030 -9.390 101 HA ASN 16 HA ASN 16 1.490 15.566 -8.818 102 1HB ASN 16 1HB ASN 16 -0.746 17.220 -7.699 103 2HB ASN 16 2HB ASN 16 -0.879 15.499 -7.397 104 1HD2 ASN 16 1HD2 ASN 16 -0.638 16.173 -5.167 105 2HD2 ASN 16 2HD2 ASN 16 0.940 16.376 -4.484 106 H PHE 17 H PHE 17 -1.453 16.736 -10.504 107 HA PHE 17 HA PHE 17 -2.759 14.254 -10.675 108 1HB PHE 17 1HB PHE 17 -3.810 16.507 -11.013 109 2HB PHE 17 2HB PHE 17 -2.754 16.818 -12.377 110 HD1 PHE 17 1HD PHE 17 -5.557 14.703 -11.213 111 HD2 PHE 17 2HD PHE 17 -3.318 16.070 -14.549 112 HE1 PHE 17 1HE PHE 17 -7.273 13.728 -12.764 113 HE2 PHE 17 2HE PHE 17 -5.033 15.095 -16.100 114 HZ PHE 17 HZ PHE 17 -6.990 13.936 -15.189 115 H GLU 18 H GLU 18 -0.817 16.126 -13.121 116 HA GLU 18 HA GLU 18 -0.925 14.535 -15.210 117 1HB GLU 18 1HB GLU 18 1.245 16.200 -14.020 118 2HB GLU 18 2HB GLU 18 1.767 15.063 -15.248 119 1HG GLU 18 1HG GLU 18 0.810 16.274 -16.924 120 2HG GLU 18 2HG GLU 18 -0.704 16.429 -16.056 121 HE2 GLU 18 HE GLU 18 2.390 17.908 -16.483 122 H ARG 19 H ARG 19 0.761 13.802 -12.153 123 HA ARG 19 HA ARG 19 2.176 11.614 -13.173 124 1HB ARG 19 1HB ARG 19 2.282 13.048 -10.850 125 2HB ARG 19 2HB ARG 19 1.385 11.659 -10.271 126 1HG ARG 19 1HG ARG 19 3.173 10.213 -10.525 127 2HG ARG 19 2HG ARG 19 3.763 11.019 -11.966 128 1HD ARG 19 1HD ARG 19 4.032 12.892 -9.804 129 2HD ARG 19 2HD ARG 19 4.639 11.356 -9.219 130 HE ARG 19 HE ARG 19 5.633 11.894 -11.885 131 2HH1 ARG 19 1HH ARG 19 8.762 13.029 -10.891 132 1HH2 ARG 19 2HH2 ARG 19 6.119 12.781 -8.490 133 2HH2 ARG 19 1HH2 ARG 19 7.780 13.219 -8.713 134 H ILE 20 H ILE 20 -0.921 11.990 -11.324 135 HA ILE 20 HA ILE 20 -1.489 9.298 -11.018 136 HB ILE 20 HB ILE 20 -3.369 11.641 -11.334 137 1HG1 ILE 20 1HG1 ILE 20 -2.498 10.447 -8.715 138 2HG1 ILE 20 2HG1 ILE 20 -1.480 11.626 -9.518 139 1HG2 ILE 20 3HG2 ILE 20 -4.399 9.364 -11.623 140 2HG2 ILE 20 1HG2 ILE 20 -3.902 9.004 -9.952 141 3HG2 ILE 20 2HG2 ILE 20 -5.046 10.329 -10.275 142 1HD1 ILE 20 3HD1 ILE 20 -4.002 12.795 -9.716 143 2HD1 ILE 20 1HD1 ILE 20 -4.049 12.012 -8.118 144 3HD1 ILE 20 2HD1 ILE 20 -2.772 13.194 -8.492 145 H SER 21 H SER 21 -2.341 11.584 -13.694 146 HA SER 21 HA SER 21 -3.835 9.800 -15.144 147 1HB SER 21 1HB SER 21 -2.237 12.268 -15.798 148 2HB SER 21 2HB SER 21 -2.838 11.306 -17.134 149 HG SER 21 HG SER 21 -4.330 13.005 -16.455 150 H GLY 22 H GLY 22 -0.294 10.593 -15.378 151 1HA GLY 22 2HA GLY 22 1.449 9.389 -16.129 152 2HA GLY 22 1HA GLY 22 0.402 8.914 -17.452 153 H ASP 23 H ASP 23 0.547 8.194 -13.883 154 HA ASP 23 HA ASP 23 1.370 5.608 -14.160 155 1HB ASP 23 1HB ASP 23 -0.197 7.125 -12.069 156 2HB ASP 23 2HB ASP 23 -0.049 5.389 -11.889 157 HD2 ASP 23 HD ASP 23 2.160 7.940 -12.760 158 H LEU 24 H LEU 24 -1.949 7.056 -14.019 159 HA LEU 24 HA LEU 24 -3.454 4.773 -13.888 160 1HB LEU 24 1HB LEU 24 -4.116 7.242 -13.807 161 2HB LEU 24 2HB LEU 24 -4.184 7.170 -15.557 162 HG LEU 24 HG LEU 24 -5.838 5.252 -15.301 163 1HD1 LEU 24 2HD1 LEU 24 -5.094 5.103 -12.747 164 2HD1 LEU 24 3HD1 LEU 24 -6.459 6.229 -12.556 165 3HD1 LEU 24 1HD1 LEU 24 -6.720 4.633 -13.299 166 1HD2 LEU 24 3HD2 LEU 24 -6.378 8.108 -14.557 167 2HD2 LEU 24 1HD2 LEU 24 -6.800 7.214 -16.037 168 3HD2 LEU 24 2HD2 LEU 24 -7.699 6.915 -14.531 169 H LYS 25 H LYS 25 -1.775 6.251 -16.689 170 HA LYS 25 HA LYS 25 -2.971 4.491 -18.574 171 1HB LYS 25 1HB LYS 25 -0.393 6.024 -18.938 172 2HB LYS 25 2HB LYS 25 -1.541 5.518 -20.161 173 1HG LYS 25 1HG LYS 25 -2.873 7.139 -18.118 174 2HG LYS 25 2HG LYS 25 -1.494 7.997 -18.777 175 1HD LYS 25 1HD LYS 25 -3.341 6.597 -20.710 176 2HD LYS 25 2HD LYS 25 -3.905 8.080 -19.965 177 1HE LYS 25 1HE LYS 25 -1.155 7.949 -21.255 178 2HE LYS 25 2HE LYS 25 -2.583 8.231 -22.230 179 H THR 26 H THR 26 0.070 4.547 -16.651 180 HA THR 26 HA THR 26 1.338 2.405 -17.879 181 HB THR 26 HB THR 26 1.361 3.670 -15.113 182 HG1 THR 26 1HG THR 26 2.464 4.775 -16.803 183 1HG2 THR 26 1HG2 THR 26 2.341 1.004 -15.774 184 2HG2 THR 26 2HG2 THR 26 3.719 2.103 -15.522 185 3HG2 THR 26 3HG2 THR 26 2.501 1.893 -14.240 186 H GLN 27 H GLN 27 -0.975 2.397 -15.094 187 HA GLN 27 HA GLN 27 -0.857 -0.353 -14.762 188 1HB GLN 27 1HB GLN 27 -3.024 1.674 -14.066 189 2HB GLN 27 2HB GLN 27 -3.075 0.001 -13.547 190 1HG GLN 27 1HG GLN 27 -1.851 2.048 -12.144 191 2HG GLN 27 2HG GLN 27 -1.520 0.343 -11.912 192 1HE2 GLN 27 1HE2 GLN 27 0.248 -0.632 -12.973 193 2HE2 GLN 27 2HE2 GLN 27 1.620 0.286 -13.499 194 H ILE 28 H ILE 28 -3.204 1.748 -16.565 195 HA ILE 28 HA ILE 28 -4.905 -0.233 -17.421 196 HB ILE 28 HB ILE 28 -4.061 2.396 -18.614 197 1HG1 ILE 28 1HG1 ILE 28 -6.631 1.526 -17.260 198 2HG1 ILE 28 2HG1 ILE 28 -5.318 2.368 -16.460 199 1HG2 ILE 28 3HG2 ILE 28 -5.576 0.242 -19.884 200 2HG2 ILE 28 1HG2 ILE 28 -6.474 1.777 -19.800 201 3HG2 ILE 28 2HG2 ILE 28 -4.875 1.723 -20.579 202 1HD1 ILE 28 2HD1 ILE 28 -5.561 4.149 -18.361 203 2HD1 ILE 28 3HD1 ILE 28 -7.138 3.380 -18.667 204 3HD1 ILE 28 1HD1 ILE 28 -6.797 4.111 -17.080 205 H ASP 29 H ASP 29 -1.765 0.871 -18.804 206 HA ASP 29 HA ASP 29 -1.921 -0.654 -21.099 207 1HB ASP 29 1HB ASP 29 -0.226 1.204 -20.353 208 2HB ASP 29 2HB ASP 29 0.664 -0.101 -19.596 209 HD2 ASP 29 HD ASP 29 -0.764 0.769 -22.517 210 H GLN 30 H GLN 30 -0.706 -1.305 -17.763 211 HA GLN 30 HA GLN 30 0.580 -3.669 -18.232 212 1HB GLN 30 1HB GLN 30 -0.979 -2.718 -15.793 213 2HB GLN 30 2HB GLN 30 0.024 -4.154 -15.785 214 1HG GLN 30 1HG GLN 30 0.825 -1.288 -15.795 215 2HG GLN 30 2HG GLN 30 1.651 -2.673 -15.110 216 1HE2 GLN 30 1HE2 GLN 30 1.707 -0.372 -17.477 217 2HE2 GLN 30 2HE2 GLN 30 2.807 -1.087 -18.609 218 H VAL 31 H VAL 31 -2.890 -3.118 -17.304 219 HA VAL 31 HA VAL 31 -3.600 -5.818 -17.333 220 HB VAL 31 HB VAL 31 -5.138 -3.246 -17.675 221 1HG1 VAL 31 3HG1 VAL 31 -6.235 -6.068 -17.440 222 2HG1 VAL 31 1HG1 VAL 31 -7.197 -4.580 -17.271 223 3HG1 VAL 31 2HG1 VAL 31 -6.414 -4.962 -18.823 224 1HG2 VAL 31 2HG2 VAL 31 -3.971 -4.440 -15.447 225 2HG2 VAL 31 3HG2 VAL 31 -5.231 -3.183 -15.439 226 3HG2 VAL 31 1HG2 VAL 31 -5.686 -4.900 -15.331 227 H GLU 32 H GLU 32 -4.150 -3.240 -19.843 228 HA GLU 32 HA GLU 32 -5.250 -4.768 -21.746 229 1HB GLU 32 1HB GLU 32 -3.540 -2.323 -21.742 230 2HB GLU 32 2HB GLU 32 -3.670 -3.141 -23.286 231 1HG GLU 32 1HG GLU 32 -6.269 -3.189 -22.731 232 2HG GLU 32 2HG GLU 32 -5.870 -1.901 -21.612 233 HE2 GLU 32 HE GLU 32 -7.276 -0.788 -23.273 234 H SER 33 H SER 33 -1.808 -4.631 -20.786 235 HA SER 33 HA SER 33 -1.017 -6.232 -23.010 236 1HB SER 33 1HB SER 33 0.318 -4.431 -21.504 237 2HB SER 33 2HB SER 33 0.748 -5.871 -20.602 238 HG SER 33 HG SER 33 1.872 -6.685 -22.314 239 H THR 34 H THR 34 -1.165 -6.623 -19.393 240 HA THR 34 HA THR 34 -0.424 -9.288 -19.297 241 HB THR 34 HB THR 34 -1.848 -7.288 -17.582 242 HG1 THR 34 1HG THR 34 0.270 -7.579 -16.978 243 1HG2 THR 34 1HG2 THR 34 -1.852 -10.285 -16.947 244 2HG2 THR 34 2HG2 THR 34 -2.367 -8.979 -15.854 245 3HG2 THR 34 3HG2 THR 34 -3.311 -9.336 -17.319 246 H ALA 35 H ALA 35 -3.662 -7.823 -19.863 247 HA ALA 35 HA ALA 35 -5.178 -10.101 -19.681 248 1HB ALA 35 3HB ALA 35 -5.798 -8.208 -21.899 249 2HB ALA 35 2HB ALA 35 -5.625 -7.495 -20.277 250 3HB ALA 35 1HB ALA 35 -6.824 -8.779 -20.561 251 H GLY 36 H GLY 36 -2.715 -9.233 -22.018 252 1HA GLY 36 2HA GLY 36 -1.843 -10.366 -23.752 253 2HA GLY 36 1HA GLY 36 -3.496 -10.593 -24.286 254 H SER 37 H SER 37 -1.581 -11.854 -21.458 255 HA SER 37 HA SER 37 -1.407 -14.425 -22.487 256 1HB SER 37 1HB SER 37 -1.431 -13.963 -19.511 257 2HB SER 37 2HB SER 37 -0.363 -14.973 -20.465 258 HG SER 37 HG SER 37 0.787 -13.120 -19.753 259 H LEU 38 H LEU 38 -4.011 -12.665 -20.972 260 HA LEU 38 HA LEU 38 -5.362 -15.001 -19.989 261 1HB LEU 38 1HB LEU 38 -5.996 -12.069 -20.159 262 2HB LEU 38 2HB LEU 38 -7.235 -13.235 -19.739 263 HG LEU 38 HG LEU 38 -6.556 -12.664 -17.649 264 1HD1 LEU 38 1HD1 LEU 38 -6.157 -15.077 -17.896 265 2HD1 LEU 38 2HD1 LEU 38 -4.456 -14.748 -18.306 266 3HD1 LEU 38 3HD1 LEU 38 -5.078 -14.338 -16.689 267 1HD2 LEU 38 2HD2 LEU 38 -4.170 -11.713 -19.031 268 2HD2 LEU 38 3HD2 LEU 38 -4.980 -11.092 -17.573 269 3HD2 LEU 38 1HD2 LEU 38 -3.804 -12.421 -17.440 270 H GLN 39 H GLN 39 -6.323 -12.477 -22.424 271 HA GLN 39 HA GLN 39 -8.290 -13.986 -23.558 272 1HB GLN 39 1HB GLN 39 -7.789 -12.478 -25.634 273 2HB GLN 39 2HB GLN 39 -8.294 -11.712 -24.141 274 1HG GLN 39 1HG GLN 39 -5.425 -12.017 -24.045 275 2HG GLN 39 2HG GLN 39 -5.836 -11.331 -25.604 276 1HE2 GLN 39 1HE2 GLN 39 -7.535 -11.024 -22.510 277 2HE2 GLN 39 2HE2 GLN 39 -7.373 -9.309 -22.330 278 H GLY 40 H GLY 40 -4.819 -14.314 -23.803 279 1HA GLY 40 2HA GLY 40 -3.504 -15.417 -25.336 280 2HA GLY 40 1HA GLY 40 -4.916 -15.820 -26.292 281 H GLN 41 H GLN 41 -5.757 -16.459 -23.096 282 HA GLN 41 HA GLN 41 -5.371 -19.264 -23.558 283 1HB GLN 41 1HB GLN 41 -4.421 -18.157 -20.899 284 2HB GLN 41 2HB GLN 41 -4.132 -19.745 -21.581 285 1HG GLN 41 1HG GLN 41 -2.637 -18.828 -23.282 286 2HG GLN 41 2HG GLN 41 -3.068 -17.184 -22.854 287 1HE2 GLN 41 1HE2 GLN 41 -1.271 -16.328 -22.092 288 2HE2 GLN 41 2HE2 GLN 41 -0.304 -16.942 -20.792 289 H TRP 42 H TRP 42 -7.423 -20.027 -23.299 290 HA TRP 42 HA TRP 42 -8.778 -19.586 -20.826 291 1HB TRP 42 1HB TRP 42 -9.817 -18.263 -23.330 292 2HB TRP 42 2HB TRP 42 -10.849 -18.670 -21.973 293 HD1 TRP 42 HD TRP 42 -9.001 -15.793 -23.210 294 HE1 TRP 42 1HE TRP 42 -8.477 -13.959 -21.386 295 HE3 TRP 42 3HE TRP 42 -9.994 -18.751 -19.195 296 HZ2 TRP 42 2HZ TRP 42 -8.535 -13.952 -18.533 297 HZ3 TRP 42 3HZ TRP 42 -9.736 -17.753 -16.925 298 HH2 TRP 42 HH TRP 42 -9.034 -15.441 -16.559 299 H ARG 43 H ARG 43 -10.609 -21.088 -20.643 300 HA ARG 43 HA ARG 43 -10.897 -22.869 -22.896 301 1HB ARG 43 1HB ARG 43 -10.038 -23.697 -20.088 302 2HB ARG 43 2HB ARG 43 -10.788 -24.836 -21.187 303 1HG ARG 43 1HG ARG 43 -8.593 -25.218 -21.792 304 2HG ARG 43 2HG ARG 43 -8.907 -23.876 -22.874 305 1HD ARG 43 1HD ARG 43 -7.410 -22.540 -21.794 306 2HD ARG 43 2HD ARG 43 -8.122 -22.887 -20.231 307 HE ARG 43 HE ARG 43 -6.428 -24.447 -19.853 308 2HH1 ARG 43 1HH ARG 43 -4.104 -25.955 -21.948 309 1HH2 ARG 43 2HH2 ARG 43 -6.684 -23.905 -23.345 310 2HH2 ARG 43 1HH2 ARG 43 -5.307 -24.885 -23.724 311 H GLY 44 H GLY 44 -12.994 -21.651 -22.942 312 1HA GLY 44 2HA GLY 44 -14.837 -22.497 -20.788 313 2HA GLY 44 1HA GLY 44 -15.245 -22.647 -22.485 314 H ALA 45 H ALA 45 -16.690 -21.074 -20.483 315 HA ALA 45 HA ALA 45 -17.087 -18.740 -21.947 316 1HB ALA 45 1HB ALA 45 -18.125 -20.059 -19.575 317 2HB ALA 45 3HB ALA 45 -18.939 -18.932 -20.687 318 3HB ALA 45 2HB ALA 45 -18.001 -18.303 -19.311 319 H ALA 46 H ALA 46 -14.738 -19.606 -19.477 320 HA ALA 46 HA ALA 46 -14.172 -17.170 -18.351 321 1HB ALA 46 3HB ALA 46 -11.950 -19.040 -19.138 322 2HB ALA 46 2HB ALA 46 -13.218 -19.623 -18.033 323 3HB ALA 46 1HB ALA 46 -12.237 -18.204 -17.593 324 H GLY 47 H GLY 47 -13.440 -18.427 -21.605 325 1HA GLY 47 2HA GLY 47 -12.350 -17.515 -23.361 326 2HA GLY 47 1HA GLY 47 -11.526 -16.418 -22.271 327 H THR 48 H THR 48 -14.830 -17.017 -23.665 328 HA THR 48 HA THR 48 -15.072 -14.528 -24.843 329 HB THR 48 HB THR 48 -17.565 -15.162 -24.769 330 HG1 THR 48 1HG THR 48 -17.935 -16.566 -23.100 331 1HG2 THR 48 2HG2 THR 48 -15.372 -16.609 -26.014 332 2HG2 THR 48 3HG2 THR 48 -16.617 -17.773 -25.499 333 3HG2 THR 48 1HG2 THR 48 -17.047 -16.435 -26.592 334 H ALA 49 H ALA 49 -15.437 -15.468 -21.463 335 HA ALA 49 HA ALA 49 -16.971 -13.206 -20.714 336 1HB ALA 49 3HB ALA 49 -15.249 -15.215 -19.223 337 2HB ALA 49 1HB ALA 49 -16.136 -13.909 -18.401 338 3HB ALA 49 2HB ALA 49 -17.025 -15.146 -19.321 339 H ALA 50 H ALA 50 -13.442 -14.039 -20.554 340 HA ALA 50 HA ALA 50 -12.794 -11.410 -19.616 341 1HB ALA 50 3HB ALA 50 -11.122 -12.715 -18.843 342 2HB ALA 50 1HB ALA 50 -11.491 -14.010 -20.007 343 3HB ALA 50 2HB ALA 50 -10.453 -12.648 -20.492 344 H GLN 51 H GLN 51 -12.010 -13.298 -22.630 345 HA GLN 51 HA GLN 51 -10.808 -11.430 -24.059 346 1HB GLN 51 1HB GLN 51 -11.110 -12.894 -25.767 347 2HB GLN 51 2HB GLN 51 -11.978 -13.876 -24.604 348 1HG GLN 51 1HG GLN 51 -13.487 -13.670 -26.434 349 2HG GLN 51 2HG GLN 51 -14.091 -12.529 -25.248 350 1HE2 GLN 51 1HE2 GLN 51 -14.926 -10.915 -26.348 351 2HE2 GLN 51 2HE2 GLN 51 -14.151 -9.995 -27.595 352 H ALA 52 H ALA 52 -14.290 -11.537 -23.268 353 HA ALA 52 HA ALA 52 -14.910 -9.365 -25.049 354 1HB ALA 52 2HB ALA 52 -16.490 -11.228 -24.531 355 2HB ALA 52 1HB ALA 52 -17.163 -9.626 -24.143 356 3HB ALA 52 3HB ALA 52 -16.549 -10.673 -22.841 357 H ALA 53 H ALA 53 -14.465 -9.913 -21.504 358 HA ALA 53 HA ALA 53 -15.179 -7.394 -20.638 359 1HB ALA 53 2HB ALA 53 -12.892 -8.970 -19.441 360 2HB ALA 53 1HB ALA 53 -14.562 -9.581 -19.363 361 3HB ALA 53 3HB ALA 53 -14.150 -8.018 -18.617 362 H VAL 54 H VAL 54 -11.835 -8.622 -21.387 363 HA VAL 54 HA VAL 54 -10.558 -6.196 -21.095 364 HB VAL 54 HB VAL 54 -9.076 -7.885 -21.227 365 1HG1 VAL 54 3HG1 VAL 54 -11.054 -9.144 -23.092 366 2HG1 VAL 54 1HG1 VAL 54 -9.368 -9.713 -23.126 367 3HG1 VAL 54 2HG1 VAL 54 -10.303 -9.790 -21.613 368 1HG2 VAL 54 3HG2 VAL 54 -8.790 -6.161 -23.244 369 2HG2 VAL 54 1HG2 VAL 54 -7.690 -7.542 -23.017 370 3HG2 VAL 54 2HG2 VAL 54 -9.011 -7.643 -24.206 371 H VAL 55 H VAL 55 -12.384 -7.566 -23.859 372 HA VAL 55 HA VAL 55 -11.574 -5.744 -25.789 373 HB VAL 55 HB VAL 55 -13.834 -7.602 -25.333 374 1HG1 VAL 55 2HG1 VAL 55 -13.988 -5.358 -27.373 375 2HG1 VAL 55 3HG1 VAL 55 -15.020 -6.808 -27.377 376 3HG1 VAL 55 1HG1 VAL 55 -15.104 -5.660 -26.020 377 1HG2 VAL 55 3HG2 VAL 55 -11.461 -7.665 -26.733 378 2HG2 VAL 55 1HG2 VAL 55 -12.834 -8.773 -26.971 379 3HG2 VAL 55 2HG2 VAL 55 -12.654 -7.342 -28.014 380 H ARG 56 H ARG 56 -14.479 -5.657 -23.603 381 HA ARG 56 HA ARG 56 -15.299 -3.170 -24.463 382 1HB ARG 56 1HB ARG 56 -15.737 -4.717 -21.873 383 2HB ARG 56 2HB ARG 56 -16.485 -3.154 -22.131 384 1HG ARG 56 1HG ARG 56 -18.060 -4.026 -23.524 385 2HG ARG 56 2HG ARG 56 -16.859 -4.881 -24.471 386 1HD ARG 56 1HD ARG 56 -16.778 -6.681 -22.711 387 2HD ARG 56 2HD ARG 56 -18.017 -5.835 -21.806 388 HE ARG 56 HE ARG 56 -18.438 -7.498 -24.131 389 2HH1 ARG 56 1HH ARG 56 -21.744 -6.580 -24.672 390 1HH2 ARG 56 2HH2 ARG 56 -19.675 -4.585 -22.539 391 2HH2 ARG 56 1HH2 ARG 56 -21.262 -4.739 -23.215 392 H PHE 57 H PHE 57 -13.331 -4.179 -21.579 393 HA PHE 57 HA PHE 57 -12.996 -1.695 -20.452 394 1HB PHE 57 1HB PHE 57 -12.131 -3.447 -19.148 395 2HB PHE 57 2HB PHE 57 -11.649 -4.373 -20.556 396 HD1 PHE 57 1HD PHE 57 -10.649 -1.593 -18.337 397 HD2 PHE 57 2HD PHE 57 -9.419 -4.303 -21.363 398 HE1 PHE 57 1HE PHE 57 -8.256 -0.944 -17.946 399 HE2 PHE 57 2HE PHE 57 -7.027 -3.653 -20.972 400 HZ PHE 57 HZ PHE 57 -6.474 -1.982 -19.268 401 H GLN 58 H GLN 58 -11.274 -3.242 -23.195 402 HA GLN 58 HA GLN 58 -9.161 -1.457 -23.285 403 1HB GLN 58 1HB GLN 58 -10.488 -3.245 -25.344 404 2HB GLN 58 2HB GLN 58 -9.161 -2.197 -25.803 405 1HG GLN 58 1HG GLN 58 -8.555 -3.641 -23.317 406 2HG GLN 58 2HG GLN 58 -8.964 -4.753 -24.608 407 1HE2 GLN 58 1HE2 GLN 58 -6.734 -5.406 -24.386 408 2HE2 GLN 58 2HE2 GLN 58 -5.484 -4.554 -25.229 409 H GLU 59 H GLU 59 -12.265 -1.515 -25.183 410 HA GLU 59 HA GLU 59 -11.804 0.803 -26.565 411 1HB GLU 59 1HB GLU 59 -14.412 -0.461 -25.625 412 2HB GLU 59 2HB GLU 59 -14.353 0.885 -26.745 413 1HG GLU 59 1HG GLU 59 -12.582 -1.426 -27.431 414 2HG GLU 59 2HG GLU 59 -14.303 -1.750 -27.514 415 HE2 GLU 59 HE GLU 59 -11.995 0.701 -28.817 416 H ALA 60 H ALA 60 -12.737 0.283 -23.199 417 HA ALA 60 HA ALA 60 -13.675 2.979 -22.837 418 1HB ALA 60 1HB ALA 60 -13.195 0.577 -21.054 419 2HB ALA 60 3HB ALA 60 -14.738 1.352 -21.487 420 3HB ALA 60 2HB ALA 60 -13.610 2.171 -20.380 421 H ALA 61 H ALA 61 -10.655 1.137 -22.606 422 HA ALA 61 HA ALA 61 -9.249 2.783 -20.874 423 1HB ALA 61 2HB ALA 61 -8.774 0.482 -22.289 424 2HB ALA 61 3HB ALA 61 -7.751 1.645 -23.165 425 3HB ALA 61 1HB ALA 61 -7.526 1.403 -21.417 426 H ASN 62 H ASN 62 -9.718 2.956 -24.459 427 HA ASN 62 HA ASN 62 -8.025 5.075 -24.880 428 1HB ASN 62 1HB ASN 62 -10.647 4.722 -26.395 429 2HB ASN 62 2HB ASN 62 -9.112 5.286 -27.023 430 1HD2 ASN 62 1HD2 ASN 62 -10.906 2.521 -25.828 431 2HD2 ASN 62 2HD2 ASN 62 -9.941 1.275 -26.545 432 H LYS 63 H LYS 63 -11.614 4.951 -24.276 433 HA LYS 63 HA LYS 63 -12.194 7.612 -24.458 434 1HB LYS 63 1HB LYS 63 -13.354 5.485 -22.638 435 2HB LYS 63 2HB LYS 63 -14.061 7.073 -22.854 436 1HG LYS 63 1HG LYS 63 -13.414 5.727 -25.416 437 2HG LYS 63 2HG LYS 63 -14.575 4.842 -24.447 438 1HD LYS 63 1HD LYS 63 -14.801 7.761 -25.317 439 2HD LYS 63 2HD LYS 63 -15.750 6.421 -25.929 440 1HE LYS 63 1HE LYS 63 -16.365 6.093 -23.340 441 2HE LYS 63 2HE LYS 63 -15.904 7.781 -23.234 442 H GLN 64 H GLN 64 -10.751 5.792 -21.708 443 HA GLN 64 HA GLN 64 -10.845 7.994 -19.972 444 1HB GLN 64 1HB GLN 64 -10.002 5.231 -19.898 445 2HB GLN 64 2HB GLN 64 -8.719 6.216 -19.225 446 1HG GLN 64 1HG GLN 64 -11.425 7.024 -18.312 447 2HG GLN 64 2HG GLN 64 -10.998 5.386 -17.857 448 1HE2 GLN 64 1HE2 GLN 64 -10.260 8.767 -17.552 449 2HE2 GLN 64 2HE2 GLN 64 -9.161 8.671 -16.216 450 H LYS 65 H LYS 65 -8.369 6.641 -22.214 451 HA LYS 65 HA LYS 65 -6.234 8.212 -21.425 452 1HB LYS 65 1HB LYS 65 -6.955 6.501 -23.675 453 2HB LYS 65 2HB LYS 65 -5.966 7.855 -24.183 454 1HG LYS 65 1HG LYS 65 -4.342 6.270 -23.557 455 2HG LYS 65 2HG LYS 65 -4.459 7.259 -22.115 456 1HD LYS 65 1HD LYS 65 -4.783 5.271 -21.032 457 2HD LYS 65 2HD LYS 65 -6.434 5.413 -21.603 458 1HE LYS 65 1HE LYS 65 -5.512 4.233 -23.788 459 2HE LYS 65 2HE LYS 65 -4.174 3.755 -22.763 460 H GLN 66 H GLN 66 -9.075 8.943 -23.460 461 HA GLN 66 HA GLN 66 -8.020 11.338 -24.466 462 1HB GLN 66 1HB GLN 66 -10.144 9.797 -25.125 463 2HB GLN 66 2HB GLN 66 -10.987 10.996 -24.164 464 1HG GLN 66 1HG GLN 66 -9.004 12.042 -26.161 465 2HG GLN 66 2HG GLN 66 -10.463 11.324 -26.815 466 1HE2 GLN 66 1HE2 GLN 66 -11.203 13.280 -27.586 467 2HE2 GLN 66 2HE2 GLN 66 -11.860 14.520 -26.570 468 H GLU 67 H GLU 67 -10.467 10.639 -21.864 469 HA GLU 67 HA GLU 67 -10.745 13.272 -21.087 470 1HB GLU 67 1HB GLU 67 -11.348 10.590 -19.897 471 2HB GLU 67 2HB GLU 67 -11.327 11.944 -18.785 472 1HG GLU 67 1HG GLU 67 -13.593 11.438 -19.871 473 2HG GLU 67 2HG GLU 67 -13.057 13.103 -19.980 474 HE2 GLU 67 HE GLU 67 -14.327 13.287 -21.921 475 H LEU 68 H LEU 68 -8.196 10.922 -20.500 476 HA LEU 68 HA LEU 68 -7.181 12.106 -18.139 477 1HB LEU 68 1HB LEU 68 -6.793 9.772 -19.506 478 2HB LEU 68 2HB LEU 68 -5.320 10.643 -19.885 479 HG LEU 68 HG LEU 68 -4.692 10.802 -17.596 480 1HD1 LEU 68 2HD1 LEU 68 -7.550 10.454 -17.111 481 2HD1 LEU 68 3HD1 LEU 68 -6.539 9.459 -16.036 482 3HD1 LEU 68 1HD1 LEU 68 -6.296 11.221 -16.106 483 1HD2 LEU 68 3HD2 LEU 68 -5.451 8.194 -18.714 484 2HD2 LEU 68 1HD2 LEU 68 -3.916 8.742 -17.998 485 3HD2 LEU 68 2HD2 LEU 68 -5.245 8.200 -16.946 486 H ASP 69 H ASP 69 -6.125 12.234 -21.615 487 HA ASP 69 HA ASP 69 -4.180 14.155 -21.115 488 1HB ASP 69 1HB ASP 69 -4.887 12.583 -23.247 489 2HB ASP 69 2HB ASP 69 -5.525 14.122 -23.792 490 HD2 ASP 69 HD ASP 69 -2.965 14.822 -25.300 491 H GLU 70 H GLU 70 -7.533 14.320 -22.532 492 HA GLU 70 HA GLU 70 -7.698 16.926 -23.104 493 1HB GLU 70 1HB GLU 70 -9.974 16.578 -23.251 494 2HB GLU 70 2HB GLU 70 -9.462 14.907 -23.124 495 1HG GLU 70 1HG GLU 70 -9.859 14.944 -20.671 496 2HG GLU 70 2HG GLU 70 -10.299 16.639 -20.749 497 HE2 GLU 70 HE GLU 70 -12.971 15.188 -23.060 498 H ILE 71 H ILE 71 -8.213 15.410 -19.855 499 HA ILE 71 HA ILE 71 -8.735 17.919 -18.613 500 HB ILE 71 HB ILE 71 -8.243 15.119 -17.632 501 1HG1 ILE 71 1HG1 ILE 71 -10.698 16.871 -17.380 502 2HG1 ILE 71 2HG1 ILE 71 -10.422 15.807 -18.745 503 1HG2 ILE 71 2HG2 ILE 71 -7.801 17.535 -16.154 504 2HG2 ILE 71 3HG2 ILE 71 -9.237 16.704 -15.509 505 3HG2 ILE 71 1HG2 ILE 71 -7.683 15.843 -15.614 506 1HD1 ILE 71 3HD1 ILE 71 -10.148 14.668 -15.962 507 2HD1 ILE 71 1HD1 ILE 71 -11.776 14.952 -16.624 508 3HD1 ILE 71 2HD1 ILE 71 -10.651 13.861 -17.467 509 H SER 72 H SER 72 -5.888 15.771 -19.059 510 HA SER 72 HA SER 72 -4.232 17.137 -17.309 511 1HB SER 72 1HB SER 72 -3.148 15.217 -17.865 512 2HB SER 72 2HB SER 72 -3.981 15.087 -19.402 513 HG SER 72 HG SER 72 -1.505 15.529 -19.287 514 H THR 73 H THR 73 -5.354 17.825 -20.588 515 HA THR 73 HA THR 73 -3.299 19.860 -20.974 516 HB THR 73 HB THR 73 -5.287 18.341 -22.645 517 HG1 THR 73 1HG THR 73 -3.180 17.757 -23.068 518 1HG2 THR 73 3HG2 THR 73 -4.554 21.239 -23.042 519 2HG2 THR 73 1HG2 THR 73 -4.455 20.171 -24.463 520 3HG2 THR 73 2HG2 THR 73 -5.998 20.357 -23.595 521 H ASN 74 H ASN 74 -6.718 19.494 -20.100 522 HA ASN 74 HA ASN 74 -7.647 21.958 -20.688 523 1HB ASN 74 1HB ASN 74 -8.258 19.847 -18.690 524 2HB ASN 74 2HB ASN 74 -8.749 21.443 -18.156 525 1HD2 ASN 74 1HD2 ASN 74 -9.400 18.792 -20.176 526 2HD2 ASN 74 2HD2 ASN 74 -10.775 19.408 -21.030 527 H ILE 75 H ILE 75 -5.364 20.904 -18.171 528 HA ILE 75 HA ILE 75 -5.587 23.194 -16.526 529 HB ILE 75 HB ILE 75 -3.248 21.307 -16.782 530 1HG1 ILE 75 1HG1 ILE 75 -5.288 19.987 -16.576 531 2HG1 ILE 75 2HG1 ILE 75 -4.331 19.898 -15.111 532 1HG2 ILE 75 1HG2 ILE 75 -3.123 23.493 -15.417 533 2HG2 ILE 75 2HG2 ILE 75 -4.221 22.674 -14.282 534 3HG2 ILE 75 3HG2 ILE 75 -2.625 21.972 -14.639 535 1HD1 ILE 75 1HD1 ILE 75 -6.651 21.845 -15.474 536 2HD1 ILE 75 2HD1 ILE 75 -6.812 20.242 -14.717 537 3HD1 ILE 75 3HD1 ILE 75 -5.780 21.482 -13.965 538 H ARG 76 H ARG 76 -3.196 22.174 -19.062 539 HA ARG 76 HA ARG 76 -1.630 24.385 -18.926 540 1HB ARG 76 1HB ARG 76 -2.349 23.016 -21.557 541 2HB ARG 76 2HB ARG 76 -0.821 23.760 -21.128 542 1HG ARG 76 1HG ARG 76 -0.948 21.938 -19.123 543 2HG ARG 76 2HG ARG 76 -1.940 21.094 -20.296 544 1HD ARG 76 1HD ARG 76 0.464 22.196 -21.570 545 2HD ARG 76 2HD ARG 76 0.893 21.174 -20.212 546 HE ARG 76 HE ARG 76 -1.152 19.946 -21.882 547 2HH1 ARG 76 1HH ARG 76 1.010 17.725 -23.450 548 1HH2 ARG 76 2HH2 ARG 76 2.338 20.488 -21.602 549 2HH2 ARG 76 1HH2 ARG 76 2.755 19.103 -22.556 550 H GLN 77 H GLN 77 -4.896 24.025 -20.168 551 HA GLN 77 HA GLN 77 -4.760 26.319 -21.845 552 1HB GLN 77 1HB GLN 77 -6.952 24.441 -20.936 553 2HB GLN 77 2HB GLN 77 -7.376 25.941 -21.736 554 1HG GLN 77 1HG GLN 77 -5.223 24.693 -23.219 555 2HG GLN 77 2HG GLN 77 -6.466 23.492 -22.934 556 1HE2 GLN 77 1HE2 GLN 77 -6.504 23.727 -25.336 557 2HE2 GLN 77 2HE2 GLN 77 -7.600 24.875 -26.030 558 H ALA 78 H ALA 78 -5.414 25.611 -18.460 559 HA ALA 78 HA ALA 78 -6.976 27.886 -17.890 560 1HB ALA 78 1HB ALA 78 -5.129 26.352 -16.025 561 2HB ALA 78 2HB ALA 78 -6.583 27.283 -15.592 562 3HB ALA 78 3HB ALA 78 -6.737 25.769 -16.516 563 H GLY 79 H GLY 79 -3.610 27.405 -18.643 564 1HA GLY 79 2HA GLY 79 -3.052 30.172 -17.759 565 2HA GLY 79 1HA GLY 79 -2.407 29.429 -19.209 566 H VAL 80 H VAL 80 -2.296 26.799 -17.380 567 HA VAL 80 HA VAL 80 -0.050 27.533 -15.697 568 HB VAL 80 HB VAL 80 -1.106 24.754 -16.065 569 1HG1 VAL 80 2HG1 VAL 80 0.659 26.127 -14.250 570 2HG1 VAL 80 3HG1 VAL 80 -0.722 25.457 -13.349 571 3HG1 VAL 80 1HG1 VAL 80 0.283 24.391 -14.359 572 1HG2 VAL 80 1HG2 VAL 80 -2.644 27.074 -15.106 573 2HG2 VAL 80 2HG2 VAL 80 -3.196 25.463 -15.624 574 3HG2 VAL 80 3HG2 VAL 80 -2.600 25.709 -13.964 575 H GLN 81 H GLN 81 1.597 28.070 -17.186 576 HA GLN 81 HA GLN 81 2.653 25.726 -18.527 577 1HB GLN 81 1HB GLN 81 2.983 26.827 -20.610 578 2HB GLN 81 2HB GLN 81 1.339 27.223 -20.151 579 1HG GLN 81 1HG GLN 81 1.848 29.426 -20.271 580 2HG GLN 81 2HG GLN 81 2.987 29.225 -18.954 581 1HE2 GLN 81 1HE2 GLN 81 3.620 31.106 -20.632 582 2HE2 GLN 81 2HE2 GLN 81 4.899 30.675 -21.717 583 H TYR 82 H TYR 82 3.080 27.825 -16.135 584 HA TYR 82 HA TYR 82 5.970 27.816 -16.458 585 1HB TYR 82 1HB TYR 82 6.006 30.254 -15.861 586 2HB TYR 82 2HB TYR 82 5.066 30.024 -17.322 587 HD1 TYR 82 1HD TYR 82 2.492 29.856 -17.070 588 HD2 TYR 82 2HD TYR 82 5.072 31.352 -14.003 589 HE1 TYR 82 1HE TYR 82 0.523 31.039 -15.981 590 HE2 TYR 82 2HE TYR 82 3.094 32.530 -12.924 591 HH TYR 82 HH TYR 82 0.638 33.408 -14.144 592 H SER 83 H SER 83 6.105 26.276 -14.777 593 HA SER 83 HA SER 83 5.506 27.429 -12.186 594 1HB SER 83 1HB SER 83 3.635 25.982 -12.421 595 2HB SER 83 2HB SER 83 4.573 24.742 -13.230 596 HG SER 83 HG SER 83 4.854 25.517 -10.450 597 H ARG 84 H ARG 84 7.077 24.794 -14.107 598 HA ARG 84 HA ARG 84 8.967 24.385 -11.996 599 1HB ARG 84 1HB ARG 84 8.281 23.048 -14.604 600 2HB ARG 84 2HB ARG 84 9.926 22.848 -14.034 601 1HG ARG 84 1HG ARG 84 9.289 21.613 -12.166 602 2HG ARG 84 2HG ARG 84 7.752 22.440 -12.003 603 1HD ARG 84 1HD ARG 84 6.659 20.938 -13.349 604 2HD ARG 84 2HD ARG 84 7.959 20.898 -14.524 605 HE ARG 84 HE ARG 84 8.650 19.551 -12.019 606 2HH1 ARG 84 1HH ARG 84 8.402 16.353 -13.352 607 1HH2 ARG 84 2HH2 ARG 84 7.093 19.141 -15.176 608 2HH2 ARG 84 1HH2 ARG 84 7.314 17.423 -15.200 609 H ALA 85 H ALA 85 8.670 26.928 -13.842 610 HA ALA 85 HA ALA 85 10.757 27.166 -15.583 611 1HB ALA 85 1HB ALA 85 10.670 29.655 -14.596 612 2HB ALA 85 3HB ALA 85 9.204 29.020 -13.812 613 3HB ALA 85 2HB ALA 85 9.348 28.991 -15.586 614 H ASP 86 H ASP 86 10.819 26.817 -12.089 615 HA ASP 86 HA ASP 86 13.483 27.861 -11.916 616 1HB ASP 86 1HB ASP 86 11.718 26.434 -9.870 617 2HB ASP 86 2HB ASP 86 13.274 27.152 -9.502 618 HD2 ASP 86 HD ASP 86 10.029 29.405 -10.033 619 H GLU 87 H GLU 87 13.294 25.699 -13.760 620 HA GLU 87 HA GLU 87 13.950 23.293 -12.361 621 1HB GLU 87 1HB GLU 87 12.990 23.996 -14.969 622 2HB GLU 87 2HB GLU 87 14.502 23.140 -15.197 623 1HG GLU 87 1HG GLU 87 13.631 21.330 -13.626 624 2HG GLU 87 2HG GLU 87 12.088 22.158 -13.606 625 HE2 GLU 87 HE GLU 87 11.836 19.661 -16.129 626 H GLU 88 H GLU 88 15.641 26.016 -12.622 627 HA GLU 88 HA GLU 88 17.967 25.354 -13.947 628 1HB GLU 88 1HB GLU 88 17.147 27.350 -11.876 629 2HB GLU 88 2HB GLU 88 18.869 27.059 -12.017 630 1HG GLU 88 1HG GLU 88 18.213 28.895 -13.518 631 2HG GLU 88 2HG GLU 88 18.762 27.526 -14.465 632 HE2 GLU 88 HE GLU 88 16.548 26.640 -15.986 633 H GLN 89 H GLN 89 16.718 24.428 -10.766 634 HA GLN 89 HA GLN 89 19.303 23.456 -9.957 635 1HB GLN 89 1HB GLN 89 16.577 23.458 -8.594 636 2HB GLN 89 2HB GLN 89 18.010 22.752 -7.872 637 1HG GLN 89 1HG GLN 89 17.796 25.015 -7.017 638 2HG GLN 89 2HG GLN 89 19.176 24.986 -8.097 639 1HE2 GLN 89 1HE2 GLN 89 15.653 25.493 -8.136 640 2HE2 GLN 89 2HE2 GLN 89 15.631 26.810 -9.262 641 H GLN 90 H GLN 90 17.732 22.358 -12.342 642 HA GLN 90 HA GLN 90 16.820 19.817 -11.505 643 1HB GLN 90 1HB GLN 90 15.941 20.997 -13.517 644 2HB GLN 90 2HB GLN 90 17.507 20.856 -14.290 645 1HG GLN 90 1HG GLN 90 16.760 18.230 -13.366 646 2HG GLN 90 2HG GLN 90 15.373 18.910 -14.193 647 1HE2 GLN 90 1HE2 GLN 90 16.517 16.770 -15.274 648 2HE2 GLN 90 2HE2 GLN 90 17.406 17.146 -16.712 649 H GLN 91 H GLN 91 19.922 21.210 -12.052 650 HA GLN 91 HA GLN 91 21.372 19.318 -13.272 651 1HB GLN 91 1HB GLN 91 21.865 21.455 -11.347 652 2HB GLN 91 2HB GLN 91 22.960 20.118 -11.060 653 1HG GLN 91 1HG GLN 91 24.214 20.997 -12.748 654 2HG GLN 91 2HG GLN 91 23.026 20.295 -13.827 655 1HE2 GLN 91 1HE2 GLN 91 24.439 23.129 -12.615 656 2HE2 GLN 91 2HE2 GLN 91 23.449 24.310 -13.404 657 H ALA 92 H ALA 92 21.524 19.477 -9.656 658 HA ALA 92 HA ALA 92 21.175 16.561 -9.631 659 1HB ALA 92 3HB ALA 92 23.484 18.178 -8.857 660 2HB ALA 92 2HB ALA 92 23.341 16.413 -9.030 661 3HB ALA 92 1HB ALA 92 22.878 17.197 -7.501 662 H LEU 93 H LEU 93 21.799 18.975 -7.021 663 HA LEU 93 HA LEU 93 19.076 18.431 -6.064 664 1HB LEU 93 1HB LEU 93 20.659 17.213 -4.717 665 2HB LEU 93 2HB LEU 93 21.640 18.647 -4.486 666 HG LEU 93 HG LEU 93 20.164 17.921 -2.548 667 1HD1 LEU 93 2HD1 LEU 93 21.232 20.227 -2.971 668 2HD1 LEU 93 3HD1 LEU 93 19.584 20.756 -3.386 669 3HD1 LEU 93 1HD1 LEU 93 19.928 20.104 -1.766 670 1HD2 LEU 93 3HD2 LEU 93 18.175 17.650 -4.281 671 2HD2 LEU 93 1HD2 LEU 93 17.890 18.097 -2.582 672 3HD2 LEU 93 2HD2 LEU 93 17.886 19.351 -3.845 673 H SER 94 H SER 94 21.663 20.642 -4.870 674 HA SER 94 HA SER 94 19.924 22.833 -5.694 675 1HB SER 94 1HB SER 94 21.149 22.215 -3.031 676 2HB SER 94 2HB SER 94 21.170 23.898 -3.519 677 HG SER 94 HG SER 94 18.698 22.857 -4.063 678 H SER 95 H SER 95 22.254 21.564 -7.060 679 HA SER 95 HA SER 95 24.643 22.632 -6.722 680 1HB SER 95 1HB SER 95 23.157 21.540 -8.928 681 2HB SER 95 2HB SER 95 24.044 22.925 -9.533 682 HG SER 95 HG SER 95 25.165 20.689 -8.068 683 H GLN 96 H GLN 96 21.765 24.305 -8.091 684 HA GLN 96 HA GLN 96 23.349 26.694 -8.445 685 1HB GLN 96 1HB GLN 96 21.653 25.855 -10.171 686 2HB GLN 96 2HB GLN 96 20.388 26.296 -9.041 687 1HG GLN 96 1HG GLN 96 20.690 28.158 -10.571 688 2HG GLN 96 2HG GLN 96 21.296 28.656 -9.004 689 1HE2 GLN 96 1HE2 GLN 96 22.262 30.210 -10.676 690 2HE2 GLN 96 2HE2 GLN 96 23.859 29.849 -11.240 691 H MET 97 H MET 97 21.030 25.204 -6.252 692 HA MET 97 HA MET 97 20.183 27.632 -5.080 693 1HB MET 97 1HB MET 97 19.658 24.766 -4.868 694 2HB MET 97 2HB MET 97 19.901 25.412 -3.257 695 1HG MET 97 1HG MET 97 18.265 27.350 -4.145 696 2HG MET 97 2HG MET 97 17.767 26.111 -5.280 697 1HE MET 97 2HE MET 97 15.619 26.560 -4.451 698 2HE MET 97 3HE MET 97 15.310 24.816 -4.272 699 3HE MET 97 1HE MET 97 14.878 25.935 -2.957 700 H GLY 98 H GLY 98 20.443 27.811 -2.510 701 1HA GLY 98 2HA GLY 98 21.898 28.506 -0.926 702 2HA GLY 98 1HA GLY 98 23.226 28.239 -2.038 703 H PHE 99 H PHE 99 24.545 27.268 -0.386 704 HA PHE 99 HA PHE 99 24.445 24.516 -0.284 705 1HB PHE 99 1HB PHE 99 26.444 25.930 0.184 706 2HB PHE 99 2HB PHE 99 25.642 26.669 1.556 707 HD1 PHE 99 1HD PHE 99 26.996 23.446 0.315 708 HD2 PHE 99 2HD PHE 99 25.815 25.721 3.697 709 HE1 PHE 99 1HE PHE 99 27.985 21.707 1.831 710 HE2 PHE 99 2HE PHE 99 26.804 23.982 5.213 711 HZ PHE 99 HZ PHE 99 27.877 21.995 4.262 712 H MET 601 H MET 601 5.897 -20.902 -19.837 713 HA MET 601 HA MET 601 7.997 -21.592 -19.837 714 1HB MET 601 1HB MET 601 7.401 -22.047 -16.890 715 2HB MET 601 2HB MET 601 8.833 -22.788 -17.576 716 1HG MET 601 1HG MET 601 8.224 -19.812 -17.882 717 2HG MET 601 2HG MET 601 9.152 -20.450 -16.539 718 1HE MET 601 3HE MET 601 9.924 -18.354 -18.162 719 2HE MET 601 1HE MET 601 11.653 -18.755 -18.034 720 3HE MET 601 2HE MET 601 10.895 -18.586 -19.635 721 H THR 602 H THR 602 6.319 -23.897 -17.568 722 HA THR 602 HA THR 602 7.309 -26.217 -18.619 723 HB THR 602 HB THR 602 5.842 -25.757 -16.526 724 HG1 THR 602 1HG THR 602 5.242 -27.893 -18.451 725 1HG2 THR 602 3HG2 THR 602 3.907 -24.995 -18.354 726 2HG2 THR 602 1HG2 THR 602 3.505 -26.713 -18.116 727 3HG2 THR 602 2HG2 THR 602 3.546 -25.606 -16.722 728 H GLU 603 H GLU 603 4.993 -24.013 -20.067 729 HA GLU 603 HA GLU 603 5.082 -25.625 -22.422 730 1HB GLU 603 1HB GLU 603 2.476 -25.152 -20.924 731 2HB GLU 603 2HB GLU 603 2.510 -25.530 -22.635 732 1HG GLU 603 1HG GLU 603 4.072 -27.547 -21.859 733 2HG GLU 603 2HG GLU 603 3.334 -27.264 -20.295 734 HE2 GLU 603 HE GLU 603 1.941 -29.728 -21.316 735 H GLN 604 H GLN 604 5.597 -24.152 -23.976 736 HA GLN 604 HA GLN 604 5.310 -21.425 -23.542 737 1HB GLN 604 1HB GLN 604 6.246 -23.206 -25.720 738 2HB GLN 604 2HB GLN 604 5.619 -21.671 -26.288 739 1HG GLN 604 1HG GLN 604 7.117 -20.499 -24.605 740 2HG GLN 604 2HG GLN 604 7.805 -22.056 -24.189 741 1HE2 GLN 604 1HE2 GLN 604 7.930 -19.390 -26.232 742 2HE2 GLN 604 2HE2 GLN 604 9.053 -19.966 -27.418 743 H GLN 605 H GLN 605 3.232 -23.874 -25.077 744 HA GLN 605 HA GLN 605 1.652 -22.293 -26.619 745 1HB GLN 605 1HB GLN 605 0.740 -24.649 -24.909 746 2HB GLN 605 2HB GLN 605 -0.081 -24.037 -26.331 747 1HG GLN 605 1HG GLN 605 2.499 -24.435 -27.293 748 2HG GLN 605 2HG GLN 605 2.340 -25.745 -26.140 749 1HE2 GLN 605 1HE2 GLN 605 2.345 -27.271 -27.777 750 2HE2 GLN 605 2HE2 GLN 605 0.978 -27.569 -28.800 751 H TRP 606 H TRP 606 1.843 -22.517 -23.097 752 HA TRP 606 HA TRP 606 0.340 -20.166 -22.761 753 1HB TRP 606 1HB TRP 606 -1.674 -20.868 -21.866 754 2HB TRP 606 2HB TRP 606 -1.481 -21.861 -23.297 755 HD1 TRP 606 HD TRP 606 -0.697 -24.516 -22.794 756 HE1 TRP 606 1HE TRP 606 -1.211 -26.160 -20.795 757 HE3 TRP 606 3HE TRP 606 -2.049 -20.903 -19.481 758 HZ2 TRP 606 2HZ TRP 606 -2.105 -25.773 -18.112 759 HZ3 TRP 606 3HZ TRP 606 -2.729 -21.621 -17.193 760 HH2 TRP 606 HH TRP 606 -2.770 -23.962 -16.489 761 H ASN 607 H ASN 607 2.158 -19.563 -21.521 762 HA ASN 607 HA ASN 607 3.347 -21.258 -19.678 763 1HB ASN 607 1HB ASN 607 4.220 -18.975 -18.723 764 2HB ASN 607 2HB ASN 607 4.657 -19.392 -20.368 765 1HD2 ASN 607 1HD2 ASN 607 4.057 -18.139 -22.010 766 2HD2 ASN 607 2HD2 ASN 607 3.055 -16.731 -21.902 767 H PHE 608 H PHE 608 1.631 -22.149 -18.318 768 HA PHE 608 HA PHE 608 -0.400 -20.800 -17.126 769 1HB PHE 608 1HB PHE 608 -0.260 -23.195 -16.915 770 2HB PHE 608 2HB PHE 608 1.415 -23.139 -16.402 771 HD1 PHE 608 1HD PHE 608 -2.044 -22.413 -15.283 772 HD2 PHE 608 2HD PHE 608 1.973 -23.126 -14.117 773 HE1 PHE 608 1HE PHE 608 -2.772 -22.593 -12.888 774 HE2 PHE 608 2HE PHE 608 1.246 -23.306 -11.721 775 HZ PHE 608 HZ PHE 608 -1.118 -23.037 -11.135 776 H ALA 609 H ALA 609 2.914 -21.368 -15.738 777 HA ALA 609 HA ALA 609 2.479 -19.988 -13.372 778 1HB ALA 609 1HB ALA 609 4.941 -20.606 -15.033 779 2HB ALA 609 3HB ALA 609 4.372 -21.413 -13.552 780 3HB ALA 609 2HB ALA 609 5.042 -19.766 -13.467 781 H GLY 610 H GLY 610 2.663 -18.855 -16.640 782 1HA GLY 610 2HA GLY 610 3.212 -16.784 -17.502 783 2HA GLY 610 1HA GLY 610 3.556 -16.181 -15.893 784 H ILE 611 H ILE 611 0.720 -17.600 -17.687 785 HA ILE 611 HA ILE 611 -0.814 -15.283 -17.503 786 HB ILE 611 HB ILE 611 -1.399 -16.764 -19.171 787 1HG1 ILE 611 1HG1 ILE 611 -3.305 -15.966 -17.395 788 2HG1 ILE 611 2HG1 ILE 611 -3.628 -16.718 -18.944 789 1HG2 ILE 611 2HG2 ILE 611 -1.103 -18.889 -17.079 790 2HG2 ILE 611 3HG2 ILE 611 -2.134 -19.191 -18.499 791 3HG2 ILE 611 1HG2 ILE 611 -0.413 -18.791 -18.717 792 1HD1 ILE 611 2HD1 ILE 611 -3.130 -18.452 -16.509 793 2HD1 ILE 611 3HD1 ILE 611 -4.733 -17.728 -16.787 794 3HD1 ILE 611 1HD1 ILE 611 -4.036 -18.839 -17.991 795 H GLU 612 H GLU 612 -0.020 -17.746 -15.156 796 HA GLU 612 HA GLU 612 -2.299 -17.555 -13.583 797 1HB GLU 612 1HB GLU 612 -0.683 -19.376 -13.327 798 2HB GLU 612 2HB GLU 612 0.582 -18.252 -12.869 799 1HG GLU 612 1HG GLU 612 -0.047 -18.654 -10.718 800 2HG GLU 612 2HG GLU 612 -1.424 -17.621 -11.048 801 HE2 GLU 612 HE GLU 612 -3.669 -20.273 -11.180 802 H ALA 613 H ALA 613 0.913 -15.870 -13.357 803 HA ALA 613 HA ALA 613 0.037 -14.225 -11.203 804 1HB ALA 613 1HB ALA 613 2.447 -15.033 -12.081 805 2HB ALA 613 3HB ALA 613 2.227 -13.529 -11.155 806 3HB ALA 613 2HB ALA 613 2.362 -13.470 -12.928 807 H ALA 614 H ALA 614 -0.302 -14.205 -14.679 808 HA ALA 614 HA ALA 614 -0.359 -11.515 -15.244 809 1HB ALA 614 1HB ALA 614 -2.225 -13.638 -16.369 810 2HB ALA 614 2HB ALA 614 -1.657 -12.155 -17.175 811 3HB ALA 614 3HB ALA 614 -0.514 -13.476 -16.833 812 H ALA 615 H ALA 615 -3.027 -13.657 -14.039 813 HA ALA 615 HA ALA 615 -4.997 -11.706 -13.995 814 1HB ALA 615 3HB ALA 615 -6.091 -13.602 -13.488 815 2HB ALA 615 1HB ALA 615 -4.567 -14.418 -13.062 816 3HB ALA 615 2HB ALA 615 -5.447 -13.478 -11.833 817 H SER 616 H SER 616 -2.728 -12.799 -11.377 818 HA SER 616 HA SER 616 -3.630 -11.131 -9.431 819 1HB SER 616 1HB SER 616 -1.467 -12.891 -9.800 820 2HB SER 616 2HB SER 616 -0.698 -11.361 -9.426 821 HG SER 616 HG SER 616 -1.121 -11.918 -7.395 822 H ALA 617 H ALA 617 -1.618 -10.444 -12.281 823 HA ALA 617 HA ALA 617 -0.665 -7.932 -11.361 824 1HB ALA 617 2HB ALA 617 -0.041 -9.678 -13.392 825 2HB ALA 617 1HB ALA 617 0.539 -7.999 -13.283 826 3HB ALA 617 3HB ALA 617 -0.886 -8.386 -14.276 827 H ILE 618 H ILE 618 -3.568 -9.126 -13.057 828 HA ILE 618 HA ILE 618 -4.434 -6.603 -13.963 829 HB ILE 618 HB ILE 618 -5.885 -9.197 -13.445 830 1HG1 ILE 618 1HG1 ILE 618 -4.178 -9.395 -15.149 831 2HG1 ILE 618 2HG1 ILE 618 -5.766 -9.449 -15.887 832 1HG2 ILE 618 1HG2 ILE 618 -7.265 -6.988 -13.424 833 2HG2 ILE 618 2HG2 ILE 618 -6.972 -7.000 -15.180 834 3HG2 ILE 618 3HG2 ILE 618 -7.814 -8.366 -14.408 835 1HD1 ILE 618 3HD1 ILE 618 -5.203 -6.722 -15.917 836 2HD1 ILE 618 1HD1 ILE 618 -3.610 -7.458 -16.217 837 3HD1 ILE 618 2HD1 ILE 618 -4.981 -7.835 -17.289 838 H GLN 619 H GLN 619 -5.136 -8.567 -11.007 839 HA GLN 619 HA GLN 619 -7.038 -6.960 -9.931 840 1HB GLN 619 1HB GLN 619 -5.188 -9.024 -8.996 841 2HB GLN 619 2HB GLN 619 -5.459 -7.826 -7.746 842 1HG GLN 619 1HG GLN 619 -7.701 -9.210 -9.294 843 2HG GLN 619 2HG GLN 619 -7.123 -9.740 -7.726 844 1HE2 GLN 619 1HE2 GLN 619 -9.554 -8.226 -9.110 845 2HE2 GLN 619 2HE2 GLN 619 -10.015 -7.060 -7.915 846 H GLY 620 H GLY 620 -3.512 -6.872 -9.010 847 1HA GLY 620 2HA GLY 620 -2.178 -5.153 -8.438 848 2HA GLY 620 1HA GLY 620 -3.549 -4.573 -7.512 849 H ASN 621 H ASN 621 -3.619 -4.960 -11.071 850 HA ASN 621 HA ASN 621 -2.962 -2.254 -11.547 851 1HB ASN 621 1HB ASN 621 -3.929 -4.602 -13.192 852 2HB ASN 621 2HB ASN 621 -4.099 -3.003 -13.888 853 1HD2 ASN 621 1HD2 ASN 621 -2.041 -1.581 -13.381 854 2HD2 ASN 621 2HD2 ASN 621 -0.531 -2.295 -13.837 855 H VAL 622 H VAL 622 -5.898 -4.231 -11.064 856 HA VAL 622 HA VAL 622 -7.763 -2.433 -12.134 857 HB VAL 622 HB VAL 622 -7.902 -4.653 -10.099 858 1HG1 VAL 622 2HG1 VAL 622 -10.041 -2.750 -11.003 859 2HG1 VAL 622 3HG1 VAL 622 -10.463 -4.452 -10.696 860 3HG1 VAL 622 1HG1 VAL 622 -9.752 -3.464 -9.398 861 1HG2 VAL 622 3HG2 VAL 622 -7.617 -4.727 -12.833 862 2HG2 VAL 622 1HG2 VAL 622 -8.301 -6.031 -11.832 863 3HG2 VAL 622 2HG2 VAL 622 -9.380 -4.866 -12.636 864 H THR 623 H THR 623 -6.720 -3.036 -8.703 865 HA THR 623 HA THR 623 -8.198 -0.879 -7.663 866 HB THR 623 HB THR 623 -6.796 -1.348 -5.645 867 HG1 THR 623 1HG THR 623 -5.465 -3.305 -7.327 868 1HG2 THR 623 2HG2 THR 623 -8.602 -3.041 -6.288 869 2HG2 THR 623 3HG2 THR 623 -7.342 -3.959 -7.147 870 3HG2 THR 623 1HG2 THR 623 -7.239 -3.742 -5.383 871 H SER 624 H SER 624 -4.955 -1.117 -9.120 872 HA SER 624 HA SER 624 -3.874 1.185 -8.182 873 1HB SER 624 1HB SER 624 -3.636 -0.303 -10.804 874 2HB SER 624 2HB SER 624 -2.800 1.225 -10.613 875 HG SER 624 HG SER 624 -1.510 -0.677 -10.008 876 H ILE 625 H ILE 625 -6.136 0.699 -10.963 877 HA ILE 625 HA ILE 625 -6.115 3.434 -11.711 878 HB ILE 625 HB ILE 625 -7.506 0.951 -12.493 879 1HG1 ILE 625 1HG1 ILE 625 -7.054 2.636 -14.688 880 2HG1 ILE 625 2HG1 ILE 625 -5.702 2.937 -13.615 881 1HG2 ILE 625 2HG2 ILE 625 -8.830 3.636 -12.608 882 2HG2 ILE 625 3HG2 ILE 625 -9.050 2.491 -13.953 883 3HG2 ILE 625 1HG2 ILE 625 -9.526 2.027 -12.302 884 1HD1 ILE 625 2HD1 ILE 625 -6.406 0.066 -13.841 885 2HD1 ILE 625 3HD1 ILE 625 -5.880 0.808 -15.371 886 3HD1 ILE 625 1HD1 ILE 625 -4.816 0.858 -13.945 887 H HIS 626 H HIS 626 -8.086 1.383 -9.532 888 HA HIS 626 HA HIS 626 -10.147 3.207 -9.143 889 1HB HIS 626 1HB HIS 626 -9.993 0.731 -8.507 890 2HB HIS 626 2HB HIS 626 -9.123 1.252 -7.078 891 HD1 HIS 626 1HD HIS 626 -11.293 0.099 -5.869 892 HD2 HIS 626 2HD HIS 626 -11.941 3.725 -7.876 893 HE1 HIS 626 1HE HIS 626 -13.511 1.012 -4.997 894 H SER 627 H SER 627 -7.022 2.701 -7.388 895 HA SER 627 HA SER 627 -7.580 4.811 -5.593 896 1HB SER 627 1HB SER 627 -5.292 2.961 -6.158 897 2HB SER 627 2HB SER 627 -4.890 4.465 -5.355 898 HG SER 627 HG SER 627 -5.440 2.640 -3.902 899 H LEU 628 H LEU 628 -5.862 4.415 -8.705 900 HA LEU 628 HA LEU 628 -4.425 6.796 -8.679 901 1HB LEU 628 1HB LEU 628 -5.334 4.823 -10.688 902 2HB LEU 628 2HB LEU 628 -4.935 6.414 -11.304 903 HG LEU 628 HG LEU 628 -2.975 5.094 -9.471 904 1HD1 LEU 628 2HD1 LEU 628 -3.949 3.811 -11.837 905 2HD1 LEU 628 3HD1 LEU 628 -2.273 4.342 -12.114 906 3HD1 LEU 628 1HD1 LEU 628 -2.657 3.296 -10.726 907 1HD2 LEU 628 2HD2 LEU 628 -2.759 7.440 -10.433 908 2HD2 LEU 628 3HD2 LEU 628 -1.368 6.350 -10.646 909 3HD2 LEU 628 1HD2 LEU 628 -2.475 6.657 -12.006 910 H LEU 629 H LEU 629 -7.762 6.042 -9.861 911 HA LEU 629 HA LEU 629 -8.259 8.676 -10.728 912 1HB LEU 629 1HB LEU 629 -9.680 6.141 -10.492 913 2HB LEU 629 2HB LEU 629 -10.712 7.518 -10.157 914 HG LEU 629 HG LEU 629 -9.173 8.089 -12.513 915 1HD1 LEU 629 1HD1 LEU 629 -10.589 5.411 -12.550 916 2HD1 LEU 629 2HD1 LEU 629 -10.064 6.307 -13.996 917 3HD1 LEU 629 3HD1 LEU 629 -8.858 5.722 -12.825 918 1HD2 LEU 629 1HD2 LEU 629 -11.490 8.893 -11.669 919 2HD2 LEU 629 2HD2 LEU 629 -11.226 8.675 -13.416 920 3HD2 LEU 629 3HD2 LEU 629 -12.108 7.438 -12.487 921 H ASP 630 H ASP 630 -8.555 6.969 -7.609 922 HA ASP 630 HA ASP 630 -10.200 8.822 -6.381 923 1HB ASP 630 1HB ASP 630 -8.629 6.505 -5.659 924 2HB ASP 630 2HB ASP 630 -8.303 7.761 -4.481 925 HD2 ASP 630 HD ASP 630 -11.684 7.875 -3.452 926 H GLU 631 H GLU 631 -6.692 8.666 -7.041 927 HA GLU 631 HA GLU 631 -6.059 10.766 -5.237 928 1HB GLU 631 1HB GLU 631 -4.561 9.147 -7.295 929 2HB GLU 631 2HB GLU 631 -3.840 10.637 -6.719 930 1HG GLU 631 1HG GLU 631 -4.661 8.219 -5.055 931 2HG GLU 631 2HG GLU 631 -3.040 8.842 -5.296 932 HE2 GLU 631 HE GLU 631 -2.545 10.771 -4.286 933 H GLY 632 H GLY 632 -6.707 10.404 -8.750 934 1HA GLY 632 2HA GLY 632 -6.834 11.927 -10.417 935 2HA GLY 632 1HA GLY 632 -5.957 13.078 -9.428 936 H LYS 633 H LYS 633 -9.024 11.368 -8.579 937 HA LYS 633 HA LYS 633 -10.829 13.274 -9.332 938 1HB LYS 633 1HB LYS 633 -11.117 10.902 -8.296 939 2HB LYS 633 2HB LYS 633 -11.130 11.740 -6.757 940 1HG LYS 633 1HG LYS 633 -13.433 11.525 -7.531 941 2HG LYS 633 2HG LYS 633 -12.986 13.218 -7.602 942 1HD LYS 633 1HD LYS 633 -12.214 12.226 -10.121 943 2HD LYS 633 2HD LYS 633 -13.717 11.387 -9.792 944 1HE LYS 633 1HE LYS 633 -14.198 14.062 -8.982 945 2HE LYS 633 2HE LYS 633 -13.285 14.207 -10.471 946 H GLN 634 H GLN 634 -8.637 13.214 -6.508 947 HA GLN 634 HA GLN 634 -9.890 15.371 -5.223 948 1HB GLN 634 1HB GLN 634 -7.158 14.065 -4.967 949 2HB GLN 634 2HB GLN 634 -7.597 15.457 -3.996 950 1HG GLN 634 1HG GLN 634 -9.820 13.714 -3.785 951 2HG GLN 634 2HG GLN 634 -8.424 12.658 -3.701 952 1HE2 GLN 634 1HE2 GLN 634 -10.244 15.169 -2.193 953 2HE2 GLN 634 2HE2 GLN 634 -9.400 15.241 -0.682 954 H SER 635 H SER 635 -7.508 15.051 -7.820 955 HA SER 635 HA SER 635 -6.637 17.755 -7.558 956 1HB SER 635 1HB SER 635 -5.716 15.390 -8.865 957 2HB SER 635 2HB SER 635 -6.006 16.564 -10.133 958 HG SER 635 HG SER 635 -4.243 16.771 -7.865 959 H LEU 636 H LEU 636 -9.257 16.013 -9.050 960 HA LEU 636 HA LEU 636 -9.691 17.625 -11.296 961 1HB LEU 636 1HB LEU 636 -10.976 15.462 -9.895 962 2HB LEU 636 2HB LEU 636 -12.166 16.666 -10.346 963 HG LEU 636 HG LEU 636 -11.849 14.824 -12.003 964 1HD1 LEU 636 2HD1 LEU 636 -11.318 17.664 -12.908 965 2HD1 LEU 636 3HD1 LEU 636 -11.753 16.327 -14.000 966 3HD1 LEU 636 1HD1 LEU 636 -12.891 16.850 -12.735 967 1HD2 LEU 636 2HD2 LEU 636 -9.401 14.583 -11.718 968 2HD2 LEU 636 3HD2 LEU 636 -9.894 14.758 -13.419 969 3HD2 LEU 636 1HD2 LEU 636 -9.175 16.137 -12.555 970 H THR 637 H THR 637 -11.060 17.755 -7.938 971 HA THR 637 HA THR 637 -12.503 20.148 -8.465 972 HB THR 637 HB THR 637 -13.393 18.834 -6.719 973 HG1 THR 637 1HG THR 637 -11.427 20.491 -5.322 974 1HG2 THR 637 3HG2 THR 637 -10.482 18.353 -6.020 975 2HG2 THR 637 1HG2 THR 637 -11.709 18.230 -4.736 976 3HG2 THR 637 2HG2 THR 637 -11.807 17.174 -6.165 977 H LYS 638 H LYS 638 -9.188 19.403 -7.495 978 HA LYS 638 HA LYS 638 -8.704 22.063 -6.541 979 1HB LYS 638 1HB LYS 638 -6.938 19.663 -7.066 980 2HB LYS 638 2HB LYS 638 -6.300 21.210 -6.547 981 1HG LYS 638 1HG LYS 638 -7.991 21.105 -4.595 982 2HG LYS 638 2HG LYS 638 -8.285 19.441 -5.057 983 1HD LYS 638 1HD LYS 638 -5.536 20.576 -4.356 984 2HD LYS 638 2HD LYS 638 -6.551 19.683 -3.241 985 1HE LYS 638 1HE LYS 638 -6.411 18.090 -5.607 986 2HE LYS 638 2HE LYS 638 -4.780 18.661 -5.320 987 H LEU 639 H LEU 639 -8.461 20.250 -9.592 988 HA LEU 639 HA LEU 639 -7.011 22.441 -10.825 989 1HB LEU 639 1HB LEU 639 -7.815 19.675 -11.679 990 2HB LEU 639 2HB LEU 639 -7.274 20.860 -12.851 991 HG LEU 639 HG LEU 639 -5.183 20.247 -12.446 992 1HD1 LEU 639 1HD1 LEU 639 -5.720 21.254 -9.641 993 2HD1 LEU 639 2HD1 LEU 639 -4.108 20.833 -10.268 994 3HD1 LEU 639 3HD1 LEU 639 -5.034 22.159 -11.012 995 1HD2 LEU 639 2HD2 LEU 639 -6.494 18.173 -11.377 996 2HD2 LEU 639 3HD2 LEU 639 -4.718 18.298 -11.383 997 3HD2 LEU 639 1HD2 LEU 639 -5.637 18.738 -9.923 998 H ALA 640 H ALA 640 -10.235 21.528 -10.110 999 HA ALA 640 HA ALA 640 -11.687 22.145 -12.316 1000 1HB ALA 640 3HB ALA 640 -12.611 21.356 -10.175 1001 2HB ALA 640 1HB ALA 640 -12.234 22.925 -9.423 1002 3HB ALA 640 2HB ALA 640 -13.452 22.827 -10.718 1003 H ALA 641 H ALA 641 -10.064 24.393 -10.016 1004 HA ALA 641 HA ALA 641 -11.157 26.755 -10.953 1005 1HB ALA 641 2HB ALA 641 -9.655 27.704 -9.522 1006 2HB ALA 641 3HB ALA 641 -9.396 26.020 -9.006 1007 3HB ALA 641 1HB ALA 641 -8.286 26.773 -10.176 1008 H ALA 642 H ALA 642 -8.700 24.593 -12.328 1009 HA ALA 642 HA ALA 642 -7.523 26.420 -14.089 1010 1HB ALA 642 3HB ALA 642 -6.949 23.932 -13.341 1011 2HB ALA 642 2HB ALA 642 -6.430 24.557 -14.924 1012 3HB ALA 642 1HB ALA 642 -7.873 23.522 -14.806 1013 H TRP 643 H TRP 643 -10.654 24.823 -14.036 1014 HA TRP 643 HA TRP 643 -11.083 25.270 -16.866 1015 1HB TRP 643 1HB TRP 643 -12.645 23.981 -14.648 1016 2HB TRP 643 2HB TRP 643 -13.432 24.426 -16.150 1017 HD1 TRP 643 HD TRP 643 -12.932 22.871 -18.281 1018 HE1 TRP 643 1HE TRP 643 -11.703 20.576 -18.709 1019 HE3 TRP 643 3HE TRP 643 -10.589 22.682 -13.771 1020 HZ2 TRP 643 2HZ TRP 643 -9.930 18.974 -17.150 1021 HZ3 TRP 643 3HZ TRP 643 -9.127 20.717 -13.304 1022 HH2 TRP 643 HH TRP 643 -8.780 18.904 -14.906 1023 H GLY 644 H GLY 644 -10.764 27.272 -14.310 1024 1HA GLY 644 2HA GLY 644 -12.619 29.220 -15.427 1025 2HA GLY 644 1HA GLY 644 -11.320 29.508 -14.287 1026 H GLY 645 H GLY 645 -11.761 27.844 -12.166 1027 1HA GLY 645 2HA GLY 645 -14.406 28.737 -11.206 1028 2HA GLY 645 1HA GLY 645 -12.986 28.462 -10.216 1029 H SER 646 H SER 646 -14.500 27.067 -8.924 1030 HA SER 646 HA SER 646 -14.449 24.394 -10.055 1031 1HB SER 646 1HB SER 646 -15.090 23.984 -7.443 1032 2HB SER 646 2HB SER 646 -13.440 24.084 -8.026 1033 HG SER 646 HG SER 646 -13.255 25.690 -6.620 1034 H GLY 647 H GLY 647 -16.537 27.043 -9.382 1035 1HA GLY 647 2HA GLY 647 -18.806 27.007 -8.705 1036 2HA GLY 647 1HA GLY 647 -18.902 25.306 -9.114 1037 H SER 648 H SER 648 -17.141 26.089 -11.639 1038 HA SER 648 HA SER 648 -19.212 27.460 -13.124 1039 1HB SER 648 1HB SER 648 -16.283 27.142 -13.352 1040 2HB SER 648 2HB SER 648 -17.106 26.946 -14.887 1041 HG SER 648 HG SER 648 -16.447 29.206 -14.199 1042 H GLU 649 H GLU 649 -20.356 26.484 -14.842 1043 HA GLU 649 HA GLU 649 -20.806 23.808 -14.710 1044 1HB GLU 649 1HB GLU 649 -22.037 24.065 -16.799 1045 2HB GLU 649 2HB GLU 649 -22.281 25.495 -15.816 1046 1HG GLU 649 1HG GLU 649 -19.994 26.157 -17.277 1047 2HG GLU 649 2HG GLU 649 -20.920 25.221 -18.433 1048 HE2 GLU 649 HE GLU 649 -21.044 28.245 -18.899 1049 H ALA 650 H ALA 650 -18.243 25.579 -16.386 1050 HA ALA 650 HA ALA 650 -17.520 23.782 -18.334 1051 1HB ALA 650 1HB ALA 650 -16.312 25.999 -16.825 1052 2HB ALA 650 3HB ALA 650 -16.184 25.591 -18.553 1053 3HB ALA 650 2HB ALA 650 -15.120 24.795 -17.369 1054 H TYR 651 H TYR 651 -15.805 24.058 -15.142 1055 HA TYR 651 HA TYR 651 -14.486 21.671 -15.282 1056 1HB TYR 651 1HB TYR 651 -13.948 23.167 -13.492 1057 2HB TYR 651 2HB TYR 651 -15.632 23.517 -13.159 1058 HD1 TYR 651 1HD TYR 651 -13.367 20.514 -13.079 1059 HD2 TYR 651 2HD TYR 651 -16.435 22.766 -11.124 1060 HE1 TYR 651 1HE TYR 651 -13.324 18.889 -11.124 1061 HE2 TYR 651 2HE TYR 651 -16.381 21.134 -9.176 1062 HH TYR 651 HH TYR 651 -15.371 19.440 -8.278 1063 H GLN 652 H GLN 652 -17.869 22.314 -14.269 1064 HA GLN 652 HA GLN 652 -18.368 19.910 -13.059 1065 1HB GLN 652 1HB GLN 652 -20.124 21.848 -14.599 1066 2HB GLN 652 2HB GLN 652 -20.799 20.389 -13.903 1067 1HG GLN 652 1HG GLN 652 -19.093 21.736 -11.948 1068 2HG GLN 652 2HG GLN 652 -20.289 22.853 -12.575 1069 1HE2 GLN 652 1HE2 GLN 652 -20.664 22.468 -10.102 1070 2HE2 GLN 652 2HE2 GLN 652 -21.920 21.343 -9.708 1071 H GLY 653 H GLY 653 -18.853 20.855 -16.535 1072 1HA GLY 653 2HA GLY 653 -18.967 19.619 -18.407 1073 2HA GLY 653 1HA GLY 653 -19.815 18.416 -17.457 1074 H VAL 654 H VAL 654 -16.564 19.392 -16.459 1075 HA VAL 654 HA VAL 654 -15.274 17.294 -17.937 1076 HB VAL 654 HB VAL 654 -14.394 19.307 -15.870 1077 1HG1 VAL 654 2HG1 VAL 654 -13.091 17.242 -15.550 1078 2HG1 VAL 654 3HG1 VAL 654 -12.664 17.244 -17.278 1079 3HG1 VAL 654 1HG1 VAL 654 -12.090 18.553 -16.218 1080 1HG2 VAL 654 2HG2 VAL 654 -14.829 19.536 -18.598 1081 2HG2 VAL 654 3HG2 VAL 654 -13.830 20.618 -17.599 1082 3HG2 VAL 654 1HG2 VAL 654 -13.073 19.272 -18.484 1083 H GLN 655 H GLN 655 -16.276 17.960 -14.532 1084 HA GLN 655 HA GLN 655 -15.123 15.830 -13.331 1085 1HB GLN 655 1HB GLN 655 -17.361 17.641 -12.794 1086 2HB GLN 655 2HB GLN 655 -17.671 16.051 -12.128 1087 1HG GLN 655 1HG GLN 655 -14.897 16.839 -11.629 1088 2HG GLN 655 2HG GLN 655 -15.996 18.069 -11.037 1089 1HE2 GLN 655 1HE2 GLN 655 -14.544 16.812 -9.226 1090 2HE2 GLN 655 2HE2 GLN 655 -15.465 15.686 -8.285 1091 H GLN 656 H GLN 656 -18.279 15.955 -15.096 1092 HA GLN 656 HA GLN 656 -18.950 13.309 -14.535 1093 1HB GLN 656 1HB GLN 656 -19.879 15.434 -16.437 1094 2HB GLN 656 2HB GLN 656 -20.333 13.785 -16.819 1095 1HG GLN 656 1HG GLN 656 -21.874 13.723 -15.147 1096 2HG GLN 656 2HG GLN 656 -20.722 14.314 -13.966 1097 1HE2 GLN 656 1HE2 GLN 656 -20.004 16.742 -15.032 1098 2HE2 GLN 656 2HE2 GLN 656 -21.346 17.837 -15.019 1099 H LYS 657 H LYS 657 -17.044 14.883 -17.129 1100 HA LYS 657 HA LYS 657 -16.925 12.632 -18.814 1101 1HB LYS 657 1HB LYS 657 -15.179 15.093 -18.551 1102 2HB LYS 657 2HB LYS 657 -14.960 13.883 -19.799 1103 1HG LYS 657 1HG LYS 657 -17.097 14.333 -20.782 1104 2HG LYS 657 2HG LYS 657 -17.680 15.164 -19.353 1105 1HD LYS 657 1HD LYS 657 -16.155 17.046 -19.745 1106 2HD LYS 657 2HD LYS 657 -15.361 16.191 -21.052 1107 1HE LYS 657 1HE LYS 657 -17.732 16.096 -22.167 1108 2HE LYS 657 2HE LYS 657 -18.184 17.322 -21.000 1109 H TRP 658 H TRP 658 -15.145 13.664 -15.914 1110 HA TRP 658 HA TRP 658 -12.998 11.840 -16.282 1111 1HB TRP 658 1HB TRP 658 -12.668 13.809 -14.969 1112 2HB TRP 658 2HB TRP 658 -14.002 13.406 -13.906 1113 HD1 TRP 658 HD TRP 658 -13.424 11.866 -11.821 1114 HE1 TRP 658 1HE TRP 658 -11.281 10.689 -10.826 1115 HE3 TRP 658 3HE TRP 658 -10.463 12.650 -15.881 1116 HZ2 TRP 658 2HZ TRP 658 -8.648 10.229 -11.826 1117 HZ3 TRP 658 3HZ TRP 658 -8.120 11.806 -15.789 1118 HH2 TRP 658 HH TRP 658 -7.202 10.632 -13.852 1119 H ASP 659 H ASP 659 -15.895 11.931 -14.075 1120 HA ASP 659 HA ASP 659 -15.511 9.385 -13.095 1121 1HB ASP 659 1HB ASP 659 -17.083 11.264 -12.268 1122 2HB ASP 659 2HB ASP 659 -18.210 10.743 -13.504 1123 HD2 ASP 659 HD ASP 659 -19.856 9.263 -11.677 1124 H ALA 660 H ALA 660 -17.023 10.667 -16.059 1125 HA ALA 660 HA ALA 660 -18.664 8.588 -16.788 1126 1HB ALA 660 2HB ALA 660 -18.751 10.567 -18.064 1127 2HB ALA 660 1HB ALA 660 -17.995 9.393 -19.168 1128 3HB ALA 660 3HB ALA 660 -16.989 10.591 -18.319 1129 H THR 661 H THR 661 -15.673 8.992 -18.709 1130 HA THR 661 HA THR 661 -15.415 6.314 -19.302 1131 HB THR 661 HB THR 661 -13.173 6.999 -20.094 1132 HG1 THR 661 1HG THR 661 -12.352 9.018 -19.244 1133 1HG2 THR 661 3HG2 THR 661 -15.461 8.205 -20.984 1134 2HG2 THR 661 1HG2 THR 661 -14.602 9.628 -20.347 1135 3HG2 THR 661 2HG2 THR 661 -13.849 8.626 -21.611 1136 H ALA 662 H ALA 662 -14.610 8.007 -16.336 1137 HA ALA 662 HA ALA 662 -12.622 6.367 -15.349 1138 1HB ALA 662 3HB ALA 662 -13.010 8.256 -14.071 1139 2HB ALA 662 2HB ALA 662 -13.871 7.041 -13.096 1140 3HB ALA 662 1HB ALA 662 -14.780 8.108 -14.194 1141 H THR 663 H THR 663 -15.937 6.169 -13.954 1142 HA THR 663 HA THR 663 -15.742 3.608 -13.049 1143 HB THR 663 HB THR 663 -17.592 4.922 -12.329 1144 HG1 THR 663 1HG THR 663 -18.985 3.235 -12.690 1145 1HG2 THR 663 3HG2 THR 663 -17.631 5.802 -15.122 1146 2HG2 THR 663 1HG2 THR 663 -19.250 5.258 -14.620 1147 3HG2 THR 663 2HG2 THR 663 -18.422 6.544 -13.710 1148 H GLU 664 H GLU 664 -16.118 4.682 -16.378 1149 HA GLU 664 HA GLU 664 -17.204 2.318 -17.364 1150 1HB GLU 664 1HB GLU 664 -17.259 4.368 -18.673 1151 2HB GLU 664 2HB GLU 664 -15.511 4.486 -18.672 1152 1HG GLU 664 1HG GLU 664 -15.988 3.563 -20.800 1153 2HG GLU 664 2HG GLU 664 -15.524 2.163 -19.853 1154 HE2 GLU 664 HE GLU 664 -18.371 0.587 -20.579 1155 H LEU 665 H LEU 665 -13.784 3.501 -17.103 1156 HA LEU 665 HA LEU 665 -12.765 1.024 -18.118 1157 1HB LEU 665 1HB LEU 665 -11.773 3.332 -18.431 1158 2HB LEU 665 2HB LEU 665 -11.259 3.254 -16.757 1159 HG LEU 665 HG LEU 665 -9.443 2.682 -18.281 1160 1HD1 LEU 665 3HD1 LEU 665 -10.001 1.451 -15.970 1161 2HD1 LEU 665 1HD1 LEU 665 -10.009 0.036 -17.050 1162 3HD1 LEU 665 2HD1 LEU 665 -8.565 1.072 -16.950 1163 1HD2 LEU 665 2HD2 LEU 665 -10.990 1.724 -20.054 1164 2HD2 LEU 665 3HD2 LEU 665 -9.459 0.859 -19.778 1165 3HD2 LEU 665 1HD2 LEU 665 -10.978 0.215 -19.109 1166 H ASN 666 H ASN 666 -13.617 2.426 -14.991 1167 HA ASN 666 HA ASN 666 -12.005 0.744 -13.453 1168 1HB ASN 666 1HB ASN 666 -13.558 2.926 -12.917 1169 2HB ASN 666 2HB ASN 666 -14.664 1.677 -12.381 1170 1HD2 ASN 666 1HD2 ASN 666 -12.822 3.783 -11.105 1171 2HD2 ASN 666 2HD2 ASN 666 -12.021 2.944 -9.819 1172 H ASN 667 H ASN 667 -15.516 0.703 -14.419 1173 HA ASN 667 HA ASN 667 -16.182 -1.615 -13.106 1174 1HB ASN 667 1HB ASN 667 -17.280 -0.451 -15.719 1175 2HB ASN 667 2HB ASN 667 -18.071 -1.728 -14.816 1176 1HD2 ASN 667 1HD2 ASN 667 -18.794 1.093 -15.498 1177 2HD2 ASN 667 2HD2 ASN 667 -19.239 1.849 -14.005 1178 H ALA 668 H ALA 668 -15.231 -1.026 -16.577 1179 HA ALA 668 HA ALA 668 -15.362 -3.587 -17.515 1180 1HB ALA 668 1HB ALA 668 -14.682 -1.206 -18.551 1181 2HB ALA 668 2HB ALA 668 -13.047 -1.879 -18.349 1182 3HB ALA 668 3HB ALA 668 -14.247 -2.739 -19.342 1183 H LEU 669 H LEU 669 -12.678 -1.971 -15.713 1184 HA LEU 669 HA LEU 669 -10.884 -4.099 -15.902 1185 1HB LEU 669 1HB LEU 669 -11.125 -1.566 -14.509 1186 2HB LEU 669 2HB LEU 669 -10.389 -2.785 -13.487 1187 HG LEU 669 HG LEU 669 -9.374 -2.403 -16.289 1188 1HD1 LEU 669 3HD1 LEU 669 -9.600 -0.176 -14.901 1189 2HD1 LEU 669 1HD1 LEU 669 -8.152 -0.802 -14.076 1190 3HD1 LEU 669 2HD1 LEU 669 -8.128 -0.534 -15.835 1191 1HD2 LEU 669 1HD2 LEU 669 -8.713 -4.195 -14.386 1192 2HD2 LEU 669 2HD2 LEU 669 -7.579 -3.595 -15.619 1193 3HD2 LEU 669 3HD2 LEU 669 -7.574 -2.887 -13.986 1194 H GLN 670 H GLN 670 -13.558 -3.368 -13.620 1195 HA GLN 670 HA GLN 670 -12.907 -5.351 -11.793 1196 1HB GLN 670 1HB GLN 670 -15.350 -3.732 -12.451 1197 2HB GLN 670 2HB GLN 670 -15.579 -5.148 -11.445 1198 1HG GLN 670 1HG GLN 670 -13.281 -3.914 -10.367 1199 2HG GLN 670 2HG GLN 670 -14.330 -2.571 -10.774 1200 1HE2 GLN 670 1HE2 GLN 670 -13.465 -3.938 -8.218 1201 2HE2 GLN 670 2HE2 GLN 670 -14.924 -4.225 -7.330 1202 H ASN 671 H ASN 671 -15.192 -5.333 -14.612 1203 HA ASN 671 HA ASN 671 -15.922 -8.012 -14.222 1204 1HB ASN 671 1HB ASN 671 -17.099 -6.072 -15.585 1205 2HB ASN 671 2HB ASN 671 -16.050 -6.565 -16.900 1206 1HD2 ASN 671 1HD2 ASN 671 -16.754 -8.066 -18.209 1207 2HD2 ASN 671 2HD2 ASN 671 -17.994 -9.235 -17.897 1208 H LEU 672 H LEU 672 -13.266 -6.297 -15.800 1209 HA LEU 672 HA LEU 672 -12.557 -8.434 -17.562 1210 1HB LEU 672 1HB LEU 672 -12.042 -6.259 -18.278 1211 2HB LEU 672 2HB LEU 672 -11.302 -5.826 -16.750 1212 HG LEU 672 HG LEU 672 -9.737 -6.188 -18.701 1213 1HD1 LEU 672 3HD1 LEU 672 -9.178 -6.289 -16.190 1214 2HD1 LEU 672 1HD1 LEU 672 -9.076 -8.050 -16.426 1215 3HD1 LEU 672 2HD1 LEU 672 -8.005 -6.965 -17.345 1216 1HD2 LEU 672 1HD2 LEU 672 -10.966 -8.231 -19.535 1217 2HD2 LEU 672 2HD2 LEU 672 -9.193 -8.371 -19.450 1218 3HD2 LEU 672 3HD2 LEU 672 -10.208 -9.133 -18.201 1219 H ALA 673 H ALA 673 -11.528 -7.216 -14.333 1220 HA ALA 673 HA ALA 673 -9.506 -9.261 -14.140 1221 1HB ALA 673 3HB ALA 673 -9.730 -6.757 -13.127 1222 2HB ALA 673 1HB ALA 673 -10.375 -7.694 -11.757 1223 3HB ALA 673 2HB ALA 673 -8.738 -8.028 -12.373 1224 H ARG 674 H ARG 674 -12.915 -8.927 -13.587 1225 HA ARG 674 HA ARG 674 -13.086 -10.692 -11.418 1226 1HB ARG 674 1HB ARG 674 -14.996 -9.457 -13.393 1227 2HB ARG 674 2HB ARG 674 -15.563 -10.874 -12.533 1228 1HG ARG 674 1HG ARG 674 -14.208 -8.814 -10.841 1229 2HG ARG 674 2HG ARG 674 -15.730 -8.314 -11.551 1230 1HD ARG 674 1HD ARG 674 -16.907 -10.213 -10.549 1231 2HD ARG 674 2HD ARG 674 -15.401 -10.935 -10.018 1232 HE ARG 674 HE ARG 674 -15.325 -9.432 -8.210 1233 2HH1 ARG 674 1HH ARG 674 -17.459 -6.847 -7.300 1234 1HH2 ARG 674 2HH2 ARG 674 -17.774 -8.351 -10.532 1235 2HH2 ARG 674 1HH2 ARG 674 -18.416 -7.136 -9.478 1236 H THR 675 H THR 675 -12.798 -11.041 -14.924 1237 HA THR 675 HA THR 675 -13.432 -13.904 -14.712 1238 HB THR 675 HB THR 675 -13.170 -12.094 -17.170 1239 HG1 THR 675 1HG THR 675 -14.927 -11.627 -15.552 1240 1HG2 THR 675 3HG2 THR 675 -13.120 -14.814 -17.190 1241 2HG2 THR 675 1HG2 THR 675 -14.876 -14.571 -17.035 1242 3HG2 THR 675 2HG2 THR 675 -14.001 -13.879 -18.422 1243 H ILE 676 H ILE 676 -10.831 -11.712 -14.676 1244 HA ILE 676 HA ILE 676 -9.043 -13.611 -15.976 1245 HB ILE 676 HB ILE 676 -8.857 -10.735 -15.156 1246 1HG1 ILE 676 1HG1 ILE 676 -8.471 -12.268 -17.737 1247 2HG1 ILE 676 2HG1 ILE 676 -9.744 -11.128 -17.348 1248 1HG2 ILE 676 1HG2 ILE 676 -6.680 -12.682 -15.111 1249 2HG2 ILE 676 2HG2 ILE 676 -6.375 -11.322 -16.218 1250 3HG2 ILE 676 3HG2 ILE 676 -6.743 -11.010 -14.505 1251 1HD1 ILE 676 2HD1 ILE 676 -7.732 -9.444 -16.936 1252 2HD1 ILE 676 3HD1 ILE 676 -6.835 -10.590 -17.960 1253 3HD1 ILE 676 1HD1 ILE 676 -8.289 -9.780 -18.592 1254 H SER 677 H SER 677 -9.360 -11.780 -12.854 1255 HA SER 677 HA SER 677 -7.328 -12.913 -11.518 1256 1HB SER 677 1HB SER 677 -8.642 -11.146 -10.524 1257 2HB SER 677 2HB SER 677 -10.100 -12.118 -10.550 1258 HG SER 677 HG SER 677 -8.062 -12.036 -8.664 1259 H GLU 678 H GLU 678 -10.446 -14.361 -12.424 1260 HA GLU 678 HA GLU 678 -10.353 -16.488 -10.621 1261 1HB GLU 678 1HB GLU 678 -11.904 -17.535 -12.505 1262 2HB GLU 678 2HB GLU 678 -12.472 -16.200 -11.523 1263 1HG GLU 678 1HG GLU 678 -12.408 -14.697 -13.271 1264 2HG GLU 678 2HG GLU 678 -10.946 -15.384 -13.951 1265 HE2 GLU 678 HE GLU 678 -14.380 -16.271 -15.518 1266 H ALA 679 H ALA 679 -8.613 -15.773 -13.567 1267 HA ALA 679 HA ALA 679 -8.118 -18.125 -14.751 1268 1HB ALA 679 3HB ALA 679 -6.003 -16.073 -13.987 1269 2HB ALA 679 1HB ALA 679 -5.948 -17.199 -15.364 1270 3HB ALA 679 2HB ALA 679 -7.154 -15.891 -15.332 1271 H GLY 680 H GLY 680 -7.134 -17.123 -11.488 1272 1HA GLY 680 2HA GLY 680 -6.436 -18.417 -9.764 1273 2HA GLY 680 1HA GLY 680 -5.069 -18.706 -10.821 1274 H GLN 681 H GLN 681 -8.277 -19.936 -9.787 1275 HA GLN 681 HA GLN 681 -7.479 -22.517 -10.891 1276 1HB GLN 681 1HB GLN 681 -8.207 -21.744 -8.144 1277 2HB GLN 681 2HB GLN 681 -9.184 -23.075 -8.733 1278 1HG GLN 681 1HG GLN 681 -7.405 -24.355 -8.052 1279 2HG GLN 681 2HG GLN 681 -6.731 -23.906 -9.606 1280 1HE2 GLN 681 1HE2 GLN 681 -4.630 -23.998 -8.953 1281 2HE2 GLN 681 2HE2 GLN 681 -3.891 -22.858 -7.879 1282 H ALA 682 H ALA 682 -9.713 -19.950 -10.916 1283 HA ALA 682 HA ALA 682 -11.939 -21.683 -11.683 1284 1HB ALA 682 2HB ALA 682 -11.710 -18.737 -10.968 1285 2HB ALA 682 3HB ALA 682 -13.203 -19.483 -11.584 1286 3HB ALA 682 1HB ALA 682 -12.511 -20.026 -10.037 1287 H MET 683 H MET 683 -9.364 -21.139 -13.261 1288 HA MET 683 HA MET 683 -9.895 -19.377 -15.306 1289 1HB MET 683 1HB MET 683 -7.786 -20.928 -14.587 1290 2HB MET 683 2HB MET 683 -8.420 -21.971 -15.843 1291 1HG MET 683 1HG MET 683 -7.900 -20.480 -17.549 1292 2HG MET 683 2HG MET 683 -8.189 -19.066 -16.554 1293 1HE MET 683 3HE MET 683 -6.200 -22.241 -15.761 1294 2HE MET 683 1HE MET 683 -5.548 -21.960 -17.393 1295 3HE MET 683 2HE MET 683 -4.498 -21.763 -15.969 1296 H ALA 684 H ALA 684 -11.185 -22.584 -14.644 1297 HA ALA 684 HA ALA 684 -12.255 -22.737 -17.367 1298 1HB ALA 684 3HB ALA 684 -10.940 -24.639 -16.072 1299 2HB ALA 684 1HB ALA 684 -12.525 -24.919 -15.312 1300 3HB ALA 684 2HB ALA 684 -12.352 -25.039 -17.079 1301 H SER 685 H SER 685 -13.211 -23.071 -13.878 1302 HA SER 685 HA SER 685 -15.739 -21.874 -14.626 1303 1HB SER 685 1HB SER 685 -15.404 -24.516 -13.153 1304 2HB SER 685 2HB SER 685 -16.880 -23.577 -13.056 1305 HG SER 685 HG SER 685 -16.785 -25.298 -14.761 1306 H THR 686 H THR 686 -15.137 -23.536 -11.532 1307 HA THR 686 HA THR 686 -13.912 -21.406 -10.174 1308 HB THR 686 HB THR 686 -16.192 -20.375 -10.744 1309 HG1 THR 686 1HG THR 686 -15.660 -21.023 -7.933 1310 1HG2 THR 686 1HG2 THR 686 -17.193 -22.850 -9.835 1311 2HG2 THR 686 2HG2 THR 686 -17.454 -21.750 -8.460 1312 3HG2 THR 686 3HG2 THR 686 -18.144 -21.361 -10.054 1313 H GLU 687 H GLU 687 -12.999 -22.204 -8.370 1314 HA GLU 687 HA GLU 687 -14.155 -23.793 -6.542 1315 1HB GLU 687 1HB GLU 687 -13.105 -26.079 -7.119 1316 2HB GLU 687 2HB GLU 687 -14.545 -25.619 -8.005 1317 1HG GLU 687 1HG GLU 687 -12.641 -24.532 -9.643 1318 2HG GLU 687 2HG GLU 687 -11.718 -25.859 -8.966 1319 HE2 GLU 687 HE GLU 687 -12.951 -28.211 -10.677 1320 H GLY 688 H GLY 688 -12.849 -23.136 -4.892 1321 1HA GLY 688 2HA GLY 688 -10.007 -23.720 -5.037 1322 2HA GLY 688 1HA GLY 688 -10.925 -23.189 -3.642 1323 H ASN 689 H ASN 689 -11.631 -21.364 -6.508 1324 HA ASN 689 HA ASN 689 -9.548 -19.452 -5.930 1325 1HB ASN 689 1HB ASN 689 -10.356 -20.253 -8.319 1326 2HB ASN 689 2HB ASN 689 -11.698 -19.154 -8.068 1327 1HD2 ASN 689 1HD2 ASN 689 -8.159 -19.360 -7.955 1328 2HD2 ASN 689 2HD2 ASN 689 -7.820 -17.746 -8.483 1329 H VAL 690 H VAL 690 -13.118 -19.368 -6.710 1330 HA VAL 690 HA VAL 690 -13.852 -18.044 -4.363 1331 HB VAL 690 HB VAL 690 -12.698 -16.131 -5.053 1332 1HG1 VAL 690 1HG1 VAL 690 -13.031 -17.159 -7.662 1333 2HG1 VAL 690 2HG1 VAL 690 -13.800 -15.554 -7.659 1334 3HG1 VAL 690 3HG1 VAL 690 -12.099 -15.726 -7.163 1335 1HG2 VAL 690 3HG2 VAL 690 -14.992 -15.666 -4.311 1336 2HG2 VAL 690 1HG2 VAL 690 -14.454 -14.477 -5.522 1337 3HG2 VAL 690 2HG2 VAL 690 -15.567 -15.785 -5.992 1338 H THR 691 H THR 691 -16.054 -18.255 -4.132 1339 HA THR 691 HA THR 691 -17.536 -18.935 -6.587 1340 HB THR 691 HB THR 691 -17.820 -20.078 -3.757 1341 HG1 THR 691 1HG THR 691 -16.721 -21.835 -4.754 1342 1HG2 THR 691 1HG2 THR 691 -19.787 -19.981 -5.712 1343 2HG2 THR 691 2HG2 THR 691 -18.934 -21.484 -6.137 1344 3HG2 THR 691 3HG2 THR 691 -19.634 -21.287 -4.513 1345 H GLY 692 H GLY 692 -17.574 -17.377 -3.353 1346 1HA GLY 692 2HA GLY 692 -18.751 -15.589 -2.645 1347 2HA GLY 692 1HA GLY 692 -20.145 -16.508 -3.179 1348 H MET 693 H MET 693 -17.439 -14.922 -5.018 1349 HA MET 693 HA MET 693 -19.042 -12.813 -5.897 1350 1HB MET 693 1HB MET 693 -17.107 -12.216 -7.201 1351 2HB MET 693 2HB MET 693 -16.444 -13.048 -5.809 1352 1HG MET 693 1HG MET 693 -15.321 -14.261 -7.415 1353 2HG MET 693 2HG MET 693 -16.803 -15.196 -7.448 1354 1HE MET 693 3HE MET 693 -15.788 -15.919 -9.762 1355 2HE MET 693 1HE MET 693 -15.753 -14.893 -11.216 1356 3HE MET 693 2HE MET 693 -14.535 -14.667 -9.937 1357 H PHE 694 H PHE 694 -18.653 -16.138 -6.963 1358 HA PHE 694 HA PHE 694 -19.721 -15.571 -9.591 1359 1HB PHE 694 1HB PHE 694 -18.290 -17.688 -8.111 1360 2HB PHE 694 2HB PHE 694 -19.665 -18.374 -8.955 1361 HD1 PHE 694 1HD PHE 694 -16.458 -18.450 -9.332 1362 HD2 PHE 694 2HD PHE 694 -19.714 -16.678 -11.397 1363 HE1 PHE 694 1HE PHE 694 -15.130 -18.491 -11.462 1364 HE2 PHE 694 2HE PHE 694 -18.387 -16.719 -13.527 1365 HZ PHE 694 HZ PHE 694 -16.110 -17.625 -13.534 1366 H ALA 695 H ALA 695 -21.856 -15.671 -10.129 1367 HA ALA 695 HA ALA 695 -23.695 -16.531 -8.046 1368 1HB ALA 695 3HB ALA 695 -25.210 -15.110 -9.036 1369 2HB ALA 695 2HB ALA 695 -24.607 -15.435 -10.679 1370 3HB ALA 695 1HB ALA 695 -23.707 -14.341 -9.601 No H/Q in entry = 1370 Start of MODEL 22 1 H ALA 1 H ALA 1 -9.160 33.509 0.549 2 HA ALA 1 HA ALA 1 -8.808 31.713 -0.996 3 1HB ALA 1 1HB ALA 1 -11.640 32.343 -1.516 4 2HB ALA 1 3HB ALA 1 -10.749 30.818 -1.739 5 3HB ALA 1 2HB ALA 1 -10.687 32.076 -2.996 6 H GLU 2 H GLU 2 -7.092 32.392 -2.172 7 HA GLU 2 HA GLU 2 -7.471 34.845 -3.697 8 1HB GLU 2 1HB GLU 2 -5.259 34.128 -1.770 9 2HB GLU 2 2HB GLU 2 -4.878 35.132 -3.155 10 1HG GLU 2 1HG GLU 2 -6.457 36.834 -2.489 11 2HG GLU 2 2HG GLU 2 -7.218 35.778 -1.317 12 HE2 GLU 2 HE GLU 2 -6.147 38.147 -0.200 13 H MET 3 H MET 3 -5.137 32.098 -3.161 14 HA MET 3 HA MET 3 -4.631 32.114 -6.006 15 1HB MET 3 1HB MET 3 -2.861 30.370 -5.279 16 2HB MET 3 2HB MET 3 -2.642 31.982 -4.625 17 1HG MET 3 1HG MET 3 -3.408 31.357 -2.464 18 2HG MET 3 2HG MET 3 -4.271 29.955 -3.064 19 1HE MET 3 2HE MET 3 -3.508 28.543 -1.383 20 2HE MET 3 3HE MET 3 -3.103 27.459 -2.736 21 3HE MET 3 1HE MET 3 -1.960 27.664 -1.387 22 H LYS 4 H LYS 4 -6.875 31.314 -6.485 23 HA LYS 4 HA LYS 4 -7.304 28.534 -5.730 24 1HB LYS 4 1HB LYS 4 -9.182 29.974 -5.359 25 2HB LYS 4 2HB LYS 4 -9.081 30.643 -6.975 26 1HG LYS 4 1HG LYS 4 -10.013 28.758 -7.977 27 2HG LYS 4 2HG LYS 4 -9.363 27.659 -6.777 28 1HD LYS 4 1HD LYS 4 -11.545 27.618 -6.046 29 2HD LYS 4 2HD LYS 4 -11.053 29.055 -5.172 30 1HE LYS 4 1HE LYS 4 -11.812 29.780 -7.894 31 2HE LYS 4 2HE LYS 4 -13.096 28.843 -7.156 32 H THR 5 H THR 5 -7.332 30.607 -8.717 33 HA THR 5 HA THR 5 -6.839 28.187 -10.283 34 HB THR 5 HB THR 5 -7.527 29.622 -12.168 35 HG1 THR 5 1HG THR 5 -7.443 31.842 -11.846 36 1HG2 THR 5 3HG2 THR 5 -9.182 29.745 -9.637 37 2HG2 THR 5 1HG2 THR 5 -9.668 30.762 -11.015 38 3HG2 THR 5 2HG2 THR 5 -9.579 28.994 -11.201 39 H ASP 6 H ASP 6 -5.039 30.444 -8.597 40 HA ASP 6 HA ASP 6 -3.185 31.469 -10.145 41 1HB ASP 6 1HB ASP 6 -3.244 30.328 -7.442 42 2HB ASP 6 2HB ASP 6 -1.648 30.163 -8.147 43 HD2 ASP 6 HD ASP 6 -1.264 32.617 -6.290 44 H ALA 7 H ALA 7 -1.301 30.758 -11.322 45 HA ALA 7 HA ALA 7 -1.415 28.147 -12.365 46 1HB ALA 7 3HB ALA 7 0.208 30.605 -12.665 47 2HB ALA 7 1HB ALA 7 1.080 29.094 -13.017 48 3HB ALA 7 2HB ALA 7 -0.414 29.486 -13.902 49 H ALA 8 H ALA 8 0.332 29.684 -9.665 50 HA ALA 8 HA ALA 8 2.299 27.736 -9.323 51 1HB ALA 8 1HB ALA 8 2.794 29.539 -8.028 52 2HB ALA 8 3HB ALA 8 1.828 28.688 -6.799 53 3HB ALA 8 2HB ALA 8 1.082 29.965 -7.790 54 H THR 9 H THR 9 -1.062 28.045 -8.023 55 HA THR 9 HA THR 9 -0.855 25.623 -6.520 56 HB THR 9 HB THR 9 -2.441 27.870 -6.446 57 HG1 THR 9 1HG THR 9 -2.949 25.080 -5.688 58 1HG2 THR 9 1HG2 THR 9 -3.762 27.024 -8.467 59 2HG2 THR 9 2HG2 THR 9 -4.191 25.591 -7.503 60 3HG2 THR 9 3HG2 THR 9 -4.735 27.205 -6.987 61 H LEU 10 H LEU 10 -2.311 26.554 -9.689 62 HA LEU 10 HA LEU 10 -3.481 24.100 -10.219 63 1HB LEU 10 1HB LEU 10 -2.535 26.418 -11.841 64 2HB LEU 10 2HB LEU 10 -2.957 24.937 -12.677 65 HG LEU 10 HG LEU 10 -4.764 26.599 -10.904 66 1HD1 LEU 10 3HD1 LEU 10 -4.201 27.355 -13.289 67 2HD1 LEU 10 1HD1 LEU 10 -5.162 25.955 -13.822 68 3HD1 LEU 10 2HD1 LEU 10 -5.918 27.231 -12.838 69 1HD2 LEU 10 2HD2 LEU 10 -5.176 23.872 -12.122 70 2HD2 LEU 10 3HD2 LEU 10 -5.449 24.409 -10.447 71 3HD2 LEU 10 1HD2 LEU 10 -6.539 24.952 -11.746 72 H ALA 11 H ALA 11 -0.128 25.298 -10.784 73 HA ALA 11 HA ALA 11 0.695 22.972 -12.163 74 1HB ALA 11 1HB ALA 11 1.995 25.368 -10.889 75 2HB ALA 11 2HB ALA 11 3.009 23.981 -11.351 76 3HB ALA 11 3HB ALA 11 2.035 24.820 -12.582 77 H GLN 12 H GLN 12 0.965 24.104 -8.731 78 HA GLN 12 HA GLN 12 2.450 22.007 -7.807 79 1HB GLN 12 1HB GLN 12 0.856 24.165 -6.700 80 2HB GLN 12 2HB GLN 12 0.595 22.714 -5.753 81 1HG GLN 12 1HG GLN 12 2.632 22.928 -4.784 82 2HG GLN 12 2HG GLN 12 3.417 22.888 -6.350 83 1HE2 GLN 12 1HE2 GLN 12 4.899 24.359 -5.252 84 2HE2 GLN 12 2HE2 GLN 12 4.577 26.061 -5.253 85 H GLU 13 H GLU 13 -0.999 22.195 -8.634 86 HA GLU 13 HA GLU 13 -1.469 19.634 -7.391 87 1HB GLU 13 1HB GLU 13 -3.253 21.699 -8.724 88 2HB GLU 13 2HB GLU 13 -3.852 20.094 -8.355 89 1HG GLU 13 1HG GLU 13 -4.252 20.774 -6.231 90 2HG GLU 13 2HG GLU 13 -2.524 20.941 -5.991 91 HE2 GLU 13 HE GLU 13 -2.010 23.307 -5.507 92 H ALA 14 H ALA 14 -1.446 21.208 -10.644 93 HA ALA 14 HA ALA 14 -2.243 18.971 -12.100 94 1HB ALA 14 1HB ALA 14 -2.160 21.335 -12.907 95 2HB ALA 14 3HB ALA 14 -1.349 20.198 -14.010 96 3HB ALA 14 2HB ALA 14 -0.383 21.234 -12.932 97 H GLY 15 H GLY 15 1.066 20.214 -11.268 98 1HA GLY 15 2HA GLY 15 3.020 19.121 -11.037 99 2HA GLY 15 1HA GLY 15 2.604 18.352 -12.556 100 H ASN 16 H ASN 16 0.621 17.974 -9.605 101 HA ASN 16 HA ASN 16 1.877 15.493 -8.968 102 1HB ASN 16 1HB ASN 16 1.103 16.527 -7.009 103 2HB ASN 16 2HB ASN 16 -0.294 17.227 -7.802 104 1HD2 ASN 16 1HD2 ASN 16 -2.099 16.480 -7.020 105 2HD2 ASN 16 2HD2 ASN 16 -2.455 14.851 -6.553 106 H PHE 17 H PHE 17 -0.931 16.760 -10.736 107 HA PHE 17 HA PHE 17 -2.432 14.358 -10.736 108 1HB PHE 17 1HB PHE 17 -3.387 16.629 -11.131 109 2HB PHE 17 2HB PHE 17 -2.310 16.880 -12.491 110 HD1 PHE 17 1HD PHE 17 -5.140 14.774 -11.331 111 HD2 PHE 17 2HD PHE 17 -2.965 16.267 -14.655 112 HE1 PHE 17 1HE PHE 17 -6.887 13.862 -12.884 113 HE2 PHE 17 2HE PHE 17 -4.712 15.354 -16.208 114 HZ PHE 17 HZ PHE 17 -6.653 14.162 -15.304 115 H GLU 18 H GLU 18 -0.341 16.007 -13.212 116 HA GLU 18 HA GLU 18 -0.605 14.386 -15.278 117 1HB GLU 18 1HB GLU 18 1.804 15.775 -14.115 118 2HB GLU 18 2HB GLU 18 2.044 14.720 -15.494 119 1HG GLU 18 1HG GLU 18 -0.291 16.382 -15.975 120 2HG GLU 18 2HG GLU 18 1.045 17.407 -15.488 121 HE2 GLU 18 HE GLU 18 0.889 18.062 -17.695 122 H ARG 19 H ARG 19 1.172 13.635 -12.254 123 HA ARG 19 HA ARG 19 2.355 11.309 -13.220 124 1HB ARG 19 1HB ARG 19 2.534 12.803 -10.904 125 2HB ARG 19 2HB ARG 19 1.648 11.411 -10.314 126 1HG ARG 19 1HG ARG 19 3.450 10.007 -10.530 127 2HG ARG 19 2HG ARG 19 3.926 10.690 -12.072 128 1HD ARG 19 1HD ARG 19 5.550 11.914 -11.062 129 2HD ARG 19 2HD ARG 19 4.358 12.708 -10.052 130 HE ARG 19 HE ARG 19 6.046 10.419 -9.304 131 2HH1 ARG 19 1HH ARG 19 4.802 10.266 -6.065 132 1HH2 ARG 19 2HH2 ARG 19 3.143 12.289 -8.507 133 2HH2 ARG 19 1HH2 ARG 19 3.111 11.768 -6.855 134 H ILE 20 H ILE 20 -0.775 12.046 -11.610 135 HA ILE 20 HA ILE 20 -1.510 9.375 -11.132 136 HB ILE 20 HB ILE 20 -3.245 11.820 -11.504 137 1HG1 ILE 20 1HG1 ILE 20 -2.029 10.705 -8.959 138 2HG1 ILE 20 2HG1 ILE 20 -1.436 12.114 -9.816 139 1HG2 ILE 20 1HG2 ILE 20 -3.797 9.019 -10.755 140 2HG2 ILE 20 2HG2 ILE 20 -4.508 10.248 -9.681 141 3HG2 ILE 20 3HG2 ILE 20 -4.871 10.272 -11.423 142 1HD1 ILE 20 2HD1 ILE 20 -4.366 12.113 -9.212 143 2HD1 ILE 20 3HD1 ILE 20 -3.274 12.256 -7.813 144 3HD1 ILE 20 1HD1 ILE 20 -3.188 13.446 -9.134 145 H SER 21 H SER 21 -2.422 11.701 -13.771 146 HA SER 21 HA SER 21 -3.968 9.969 -15.189 147 1HB SER 21 1HB SER 21 -2.319 12.387 -15.872 148 2HB SER 21 2HB SER 21 -2.937 11.437 -17.208 149 HG SER 21 HG SER 21 -4.572 12.458 -15.044 150 H GLY 22 H GLY 22 -0.392 10.501 -15.320 151 1HA GLY 22 2HA GLY 22 1.275 9.276 -16.198 152 2HA GLY 22 1HA GLY 22 0.172 8.815 -17.480 153 H ASP 23 H ASP 23 0.283 8.169 -13.897 154 HA ASP 23 HA ASP 23 1.037 5.541 -14.144 155 1HB ASP 23 1HB ASP 23 -0.354 7.199 -12.048 156 2HB ASP 23 2HB ASP 23 -0.378 5.460 -11.834 157 HD2 ASP 23 HD ASP 23 1.383 7.818 -10.519 158 H LEU 24 H LEU 24 -2.134 7.191 -14.321 159 HA LEU 24 HA LEU 24 -3.781 4.967 -13.973 160 1HB LEU 24 1HB LEU 24 -4.005 7.739 -14.819 161 2HB LEU 24 2HB LEU 24 -5.097 6.697 -15.710 162 HG LEU 24 HG LEU 24 -4.942 6.913 -12.690 163 1HD1 LEU 24 2HD1 LEU 24 -6.060 8.715 -14.462 164 2HD1 LEU 24 3HD1 LEU 24 -7.440 7.697 -13.986 165 3HD1 LEU 24 1HD1 LEU 24 -6.477 8.529 -12.742 166 1HD2 LEU 24 1HD2 LEU 24 -6.236 4.975 -14.475 167 2HD2 LEU 24 2HD2 LEU 24 -5.864 4.876 -12.737 168 3HD2 LEU 24 3HD2 LEU 24 -7.336 5.713 -13.286 169 H LYS 25 H LYS 25 -2.230 6.396 -16.902 170 HA LYS 25 HA LYS 25 -3.450 4.554 -18.670 171 1HB LYS 25 1HB LYS 25 -0.877 6.017 -19.233 172 2HB LYS 25 2HB LYS 25 -2.160 5.573 -20.341 173 1HG LYS 25 1HG LYS 25 -3.297 7.225 -18.252 174 2HG LYS 25 2HG LYS 25 -1.861 8.023 -18.863 175 1HD LYS 25 1HD LYS 25 -4.198 7.013 -20.553 176 2HD LYS 25 2HD LYS 25 -3.864 8.689 -20.166 177 1HE LYS 25 1HE LYS 25 -1.445 7.984 -21.236 178 2HE LYS 25 2HE LYS 25 -2.483 6.878 -22.114 179 H THR 26 H THR 26 -0.326 4.683 -16.883 180 HA THR 26 HA THR 26 0.927 2.533 -18.076 181 HB THR 26 HB THR 26 0.983 3.921 -15.392 182 HG1 THR 26 1HG THR 26 2.896 3.139 -17.480 183 1HG2 THR 26 1HG2 THR 26 1.970 1.156 -15.936 184 2HG2 THR 26 2HG2 THR 26 3.211 2.281 -15.332 185 3HG2 THR 26 3HG2 THR 26 1.737 1.986 -14.378 186 H GLN 27 H GLN 27 -1.226 2.474 -15.156 187 HA GLN 27 HA GLN 27 -1.122 -0.268 -14.888 188 1HB GLN 27 1HB GLN 27 -3.388 1.625 -14.123 189 2HB GLN 27 2HB GLN 27 -3.158 0.010 -13.484 190 1HG GLN 27 1HG GLN 27 -1.062 2.216 -13.243 191 2HG GLN 27 2HG GLN 27 -2.268 1.900 -12.012 192 1HE2 GLN 27 1HE2 GLN 27 0.488 0.623 -13.759 193 2HE2 GLN 27 2HE2 GLN 27 0.942 -0.611 -12.632 194 H ILE 28 H ILE 28 -3.360 1.863 -16.749 195 HA ILE 28 HA ILE 28 -5.170 -0.104 -17.503 196 HB ILE 28 HB ILE 28 -4.331 2.543 -18.629 197 1HG1 ILE 28 1HG1 ILE 28 -6.884 1.511 -17.360 198 2HG1 ILE 28 2HG1 ILE 28 -5.680 2.525 -16.591 199 1HG2 ILE 28 2HG2 ILE 28 -5.993 0.451 -19.965 200 2HG2 ILE 28 3HG2 ILE 28 -6.505 2.151 -20.087 201 3HG2 ILE 28 1HG2 ILE 28 -4.892 1.663 -20.661 202 1HD1 ILE 28 1HD1 ILE 28 -6.094 4.157 -18.617 203 2HD1 ILE 28 2HD1 ILE 28 -7.600 3.231 -18.824 204 3HD1 ILE 28 3HD1 ILE 28 -7.288 4.094 -17.299 205 H ASP 29 H ASP 29 -2.000 0.887 -18.873 206 HA ASP 29 HA ASP 29 -2.249 -0.653 -21.179 207 1HB ASP 29 1HB ASP 29 -0.259 1.000 -19.872 208 2HB ASP 29 2HB ASP 29 0.511 -0.492 -20.374 209 HD2 ASP 29 HD ASP 29 1.621 0.267 -21.896 210 H GLN 30 H GLN 30 -0.914 -1.207 -17.870 211 HA GLN 30 HA GLN 30 0.378 -3.569 -18.313 212 1HB GLN 30 1HB GLN 30 -1.162 -2.659 -15.842 213 2HB GLN 30 2HB GLN 30 -0.028 -3.994 -15.859 214 1HG GLN 30 1HG GLN 30 0.497 -1.060 -15.947 215 2HG GLN 30 2HG GLN 30 1.457 -2.343 -15.237 216 1HE2 GLN 30 1HE2 GLN 30 1.301 -0.109 -17.647 217 2HE2 GLN 30 2HE2 GLN 30 2.429 -0.763 -18.787 218 H VAL 31 H VAL 31 -3.093 -2.993 -17.441 219 HA VAL 31 HA VAL 31 -3.780 -5.709 -17.329 220 HB VAL 31 HB VAL 31 -5.307 -3.143 -17.716 221 1HG1 VAL 31 2HG1 VAL 31 -6.529 -4.926 -18.904 222 2HG1 VAL 31 3HG1 VAL 31 -6.499 -5.923 -17.430 223 3HG1 VAL 31 1HG1 VAL 31 -7.397 -4.386 -17.446 224 1HG2 VAL 31 3HG2 VAL 31 -4.197 -4.368 -15.476 225 2HG2 VAL 31 1HG2 VAL 31 -5.440 -3.095 -15.481 226 3HG2 VAL 31 2HG2 VAL 31 -5.920 -4.806 -15.395 227 H GLU 32 H GLU 32 -4.280 -3.226 -19.940 228 HA GLU 32 HA GLU 32 -5.396 -4.856 -21.778 229 1HB GLU 32 1HB GLU 32 -3.806 -2.345 -21.841 230 2HB GLU 32 2HB GLU 32 -3.822 -3.225 -23.357 231 1HG GLU 32 1HG GLU 32 -6.448 -3.403 -22.855 232 2HG GLU 32 2HG GLU 32 -6.137 -2.004 -21.846 233 HE2 GLU 32 HE GLU 32 -4.838 -1.880 -25.563 234 H SER 33 H SER 33 -1.957 -4.584 -20.836 235 HA SER 33 HA SER 33 -1.096 -6.197 -23.013 236 1HB SER 33 1HB SER 33 0.710 -4.936 -22.413 237 2HB SER 33 2HB SER 33 0.130 -4.705 -20.775 238 HG SER 33 HG SER 33 1.990 -5.956 -20.603 239 H THR 34 H THR 34 -1.285 -6.597 -19.398 240 HA THR 34 HA THR 34 -0.531 -9.265 -19.320 241 HB THR 34 HB THR 34 -1.957 -7.280 -17.582 242 HG1 THR 34 1HG THR 34 0.125 -9.343 -17.401 243 1HG2 THR 34 3HG2 THR 34 -3.309 -9.491 -17.407 244 2HG2 THR 34 1HG2 THR 34 -1.805 -10.229 -16.805 245 3HG2 THR 34 2HG2 THR 34 -2.569 -8.900 -15.900 246 H ALA 35 H ALA 35 -3.747 -7.784 -19.920 247 HA ALA 35 HA ALA 35 -5.285 -10.052 -19.707 248 1HB ALA 35 3HB ALA 35 -5.694 -7.950 -21.849 249 2HB ALA 35 2HB ALA 35 -5.909 -7.571 -20.123 250 3HB ALA 35 1HB ALA 35 -6.916 -8.821 -20.891 251 H GLY 36 H GLY 36 -2.756 -9.290 -21.975 252 1HA GLY 36 2HA GLY 36 -1.902 -10.426 -23.715 253 2HA GLY 36 1HA GLY 36 -3.553 -10.632 -24.265 254 H SER 37 H SER 37 -1.631 -11.903 -21.444 255 HA SER 37 HA SER 37 -1.507 -14.481 -22.439 256 1HB SER 37 1HB SER 37 -1.522 -13.867 -19.471 257 2HB SER 37 2HB SER 37 -0.583 -15.071 -20.330 258 HG SER 37 HG SER 37 0.976 -13.626 -20.483 259 H LEU 38 H LEU 38 -4.130 -12.676 -21.081 260 HA LEU 38 HA LEU 38 -5.514 -15.002 -20.069 261 1HB LEU 38 1HB LEU 38 -6.079 -12.055 -20.181 262 2HB LEU 38 2HB LEU 38 -7.351 -13.198 -19.799 263 HG LEU 38 HG LEU 38 -6.715 -12.836 -17.678 264 1HD1 LEU 38 1HD1 LEU 38 -6.070 -15.158 -18.011 265 2HD1 LEU 38 2HD1 LEU 38 -4.432 -14.655 -18.494 266 3HD1 LEU 38 3HD1 LEU 38 -4.996 -14.372 -16.829 267 1HD2 LEU 38 1HD2 LEU 38 -4.101 -11.880 -18.833 268 2HD2 LEU 38 2HD2 LEU 38 -5.358 -10.960 -17.971 269 3HD2 LEU 38 3HD2 LEU 38 -4.323 -12.101 -17.081 270 H GLN 39 H GLN 39 -6.448 -12.407 -22.437 271 HA GLN 39 HA GLN 39 -8.424 -13.862 -23.615 272 1HB GLN 39 1HB GLN 39 -8.026 -12.304 -25.610 273 2HB GLN 39 2HB GLN 39 -8.301 -11.523 -24.065 274 1HG GLN 39 1HG GLN 39 -5.519 -11.919 -24.102 275 2HG GLN 39 2HG GLN 39 -5.889 -11.510 -25.765 276 1HE2 GLN 39 1HE2 GLN 39 -7.279 -10.540 -22.631 277 2HE2 GLN 39 2HE2 GLN 39 -7.095 -8.829 -22.829 278 H GLY 40 H GLY 40 -4.959 -14.237 -23.860 279 1HA GLY 40 2HA GLY 40 -3.653 -15.325 -25.408 280 2HA GLY 40 1HA GLY 40 -5.064 -15.668 -26.390 281 H GLN 41 H GLN 41 -5.975 -16.394 -23.239 282 HA GLN 41 HA GLN 41 -5.701 -19.182 -23.785 283 1HB GLN 41 1HB GLN 41 -4.641 -18.351 -21.089 284 2HB GLN 41 2HB GLN 41 -4.321 -19.813 -22.001 285 1HG GLN 41 1HG GLN 41 -2.906 -18.597 -23.588 286 2HG GLN 41 2HG GLN 41 -3.361 -17.055 -22.890 287 1HE2 GLN 41 1HE2 GLN 41 -1.340 -16.429 -22.319 288 2HE2 GLN 41 2HE2 GLN 41 -0.397 -17.165 -21.066 289 H TRP 42 H TRP 42 -7.732 -19.936 -23.388 290 HA TRP 42 HA TRP 42 -8.966 -19.451 -20.866 291 1HB TRP 42 1HB TRP 42 -10.050 -18.070 -23.316 292 2HB TRP 42 2HB TRP 42 -11.065 -18.483 -21.948 293 HD1 TRP 42 HD TRP 42 -9.125 -15.639 -23.159 294 HE1 TRP 42 1HE TRP 42 -8.541 -13.852 -21.308 295 HE3 TRP 42 3HE TRP 42 -10.227 -18.620 -19.190 296 HZ2 TRP 42 2HZ TRP 42 -8.605 -13.884 -18.455 297 HZ3 TRP 42 3HZ TRP 42 -9.939 -17.665 -16.905 298 HH2 TRP 42 HH TRP 42 -9.158 -15.384 -16.504 299 H ARG 43 H ARG 43 -11.504 -20.346 -21.336 300 HA ARG 43 HA ARG 43 -11.583 -22.337 -23.313 301 1HB ARG 43 1HB ARG 43 -11.410 -24.332 -21.998 302 2HB ARG 43 2HB ARG 43 -10.051 -23.351 -21.486 303 1HG ARG 43 1HG ARG 43 -10.917 -23.944 -19.407 304 2HG ARG 43 2HG ARG 43 -11.772 -22.436 -19.667 305 1HD ARG 43 1HD ARG 43 -13.812 -23.482 -20.008 306 2HD ARG 43 2HD ARG 43 -13.095 -24.865 -20.811 307 HE ARG 43 HE ARG 43 -13.791 -24.743 -18.054 308 2HH1 ARG 43 1HH ARG 43 -11.761 -27.308 -16.886 309 1HH2 ARG 43 2HH2 ARG 43 -11.077 -25.812 -20.065 310 2HH2 ARG 43 1HH2 ARG 43 -10.555 -27.019 -18.937 311 H GLY 44 H GLY 44 -13.754 -23.073 -23.595 312 1HA GLY 44 2HA GLY 44 -15.721 -22.891 -21.552 313 2HA GLY 44 1HA GLY 44 -15.979 -23.206 -23.256 314 H ALA 45 H ALA 45 -16.413 -20.954 -20.730 315 HA ALA 45 HA ALA 45 -17.043 -18.869 -22.702 316 1HB ALA 45 2HB ALA 45 -18.792 -20.110 -21.096 317 2HB ALA 45 1HB ALA 45 -18.938 -18.379 -21.483 318 3HB ALA 45 3HB ALA 45 -18.210 -18.887 -19.940 319 H ALA 46 H ALA 46 -15.001 -19.820 -20.068 320 HA ALA 46 HA ALA 46 -14.541 -17.503 -18.706 321 1HB ALA 46 3HB ALA 46 -12.140 -19.088 -19.467 322 2HB ALA 46 2HB ALA 46 -13.483 -20.011 -18.750 323 3HB ALA 46 1HB ALA 46 -12.761 -18.650 -17.857 324 H GLY 47 H GLY 47 -13.547 -18.424 -22.011 325 1HA GLY 47 2HA GLY 47 -12.374 -17.314 -23.591 326 2HA GLY 47 1HA GLY 47 -11.689 -16.284 -22.350 327 H THR 48 H THR 48 -14.878 -16.906 -23.987 328 HA THR 48 HA THR 48 -15.159 -14.349 -25.002 329 HB THR 48 HB THR 48 -17.618 -15.078 -25.127 330 HG1 THR 48 1HG THR 48 -18.058 -17.060 -24.062 331 1HG2 THR 48 3HG2 THR 48 -15.575 -17.246 -25.846 332 2HG2 THR 48 1HG2 THR 48 -17.216 -17.094 -26.517 333 3HG2 THR 48 2HG2 THR 48 -15.987 -15.860 -26.883 334 H ALA 49 H ALA 49 -15.659 -15.543 -21.722 335 HA ALA 49 HA ALA 49 -17.333 -13.414 -20.897 336 1HB ALA 49 3HB ALA 49 -15.473 -15.135 -19.215 337 2HB ALA 49 1HB ALA 49 -16.952 -14.297 -18.686 338 3HB ALA 49 2HB ALA 49 -17.063 -15.681 -19.801 339 H ALA 50 H ALA 50 -13.783 -14.095 -20.515 340 HA ALA 50 HA ALA 50 -13.323 -11.499 -19.416 341 1HB ALA 50 1HB ALA 50 -11.394 -12.473 -18.783 342 2HB ALA 50 2HB ALA 50 -12.004 -13.978 -19.513 343 3HB ALA 50 3HB ALA 50 -10.975 -12.880 -20.464 344 H GLN 51 H GLN 51 -12.385 -13.151 -22.520 345 HA GLN 51 HA GLN 51 -11.142 -11.203 -23.780 346 1HB GLN 51 1HB GLN 51 -11.458 -13.247 -24.943 347 2HB GLN 51 2HB GLN 51 -13.203 -13.176 -24.797 348 1HG GLN 51 1HG GLN 51 -11.938 -10.891 -26.260 349 2HG GLN 51 2HG GLN 51 -11.834 -12.448 -27.057 350 1HE2 GLN 51 1HE2 GLN 51 -13.806 -9.805 -26.187 351 2HE2 GLN 51 2HE2 GLN 51 -15.311 -10.340 -26.857 352 H ALA 52 H ALA 52 -14.749 -11.474 -23.531 353 HA ALA 52 HA ALA 52 -15.283 -9.157 -25.018 354 1HB ALA 52 2HB ALA 52 -17.005 -10.785 -24.713 355 2HB ALA 52 1HB ALA 52 -17.522 -9.349 -23.797 356 3HB ALA 52 3HB ALA 52 -16.827 -10.747 -22.942 357 H ALA 53 H ALA 53 -14.975 -9.771 -21.458 358 HA ALA 53 HA ALA 53 -15.556 -7.199 -20.624 359 1HB ALA 53 1HB ALA 53 -13.514 -9.019 -19.314 360 2HB ALA 53 3HB ALA 53 -15.255 -9.388 -19.293 361 3HB ALA 53 2HB ALA 53 -14.654 -7.891 -18.542 362 H VAL 54 H VAL 54 -12.651 -8.586 -22.121 363 HA VAL 54 HA VAL 54 -10.944 -6.437 -21.368 364 HB VAL 54 HB VAL 54 -10.596 -8.365 -23.661 365 1HG1 VAL 54 3HG1 VAL 54 -9.023 -6.276 -22.858 366 2HG1 VAL 54 1HG1 VAL 54 -8.316 -7.625 -21.937 367 3HG1 VAL 54 2HG1 VAL 54 -8.434 -7.723 -23.711 368 1HG2 VAL 54 2HG2 VAL 54 -11.061 -9.085 -20.978 369 2HG2 VAL 54 3HG2 VAL 54 -10.424 -10.113 -22.285 370 3HG2 VAL 54 1HG2 VAL 54 -9.304 -9.230 -21.220 371 H VAL 55 H VAL 55 -12.641 -7.393 -24.434 372 HA VAL 55 HA VAL 55 -11.841 -5.295 -25.989 373 HB VAL 55 HB VAL 55 -14.346 -6.946 -25.849 374 1HG1 VAL 55 2HG1 VAL 55 -14.048 -4.402 -27.220 375 2HG1 VAL 55 3HG1 VAL 55 -14.325 -5.728 -28.374 376 3HG1 VAL 55 1HG1 VAL 55 -15.482 -5.443 -27.052 377 1HG2 VAL 55 3HG2 VAL 55 -11.830 -7.484 -26.799 378 2HG2 VAL 55 1HG2 VAL 55 -13.321 -8.300 -27.329 379 3HG2 VAL 55 2HG2 VAL 55 -12.666 -6.939 -28.272 380 H ARG 56 H ARG 56 -14.783 -5.454 -23.860 381 HA ARG 56 HA ARG 56 -15.632 -2.914 -24.368 382 1HB ARG 56 1HB ARG 56 -17.042 -4.486 -23.159 383 2HB ARG 56 2HB ARG 56 -15.864 -4.658 -21.873 384 1HG ARG 56 1HG ARG 56 -16.522 -2.722 -20.825 385 2HG ARG 56 2HG ARG 56 -16.723 -1.851 -22.333 386 1HD ARG 56 1HD ARG 56 -18.701 -4.047 -21.764 387 2HD ARG 56 2HD ARG 56 -18.827 -2.599 -20.786 388 HE ARG 56 HE ARG 56 -18.595 -1.616 -23.376 389 2HH1 ARG 56 1HH ARG 56 -21.840 -1.913 -24.577 390 1HH2 ARG 56 2HH2 ARG 56 -20.791 -3.901 -21.792 391 2HH2 ARG 56 1HH2 ARG 56 -22.122 -3.539 -22.840 392 H PHE 57 H PHE 57 -13.481 -4.133 -21.701 393 HA PHE 57 HA PHE 57 -13.096 -1.722 -20.420 394 1HB PHE 57 1HB PHE 57 -12.223 -3.603 -19.290 395 2HB PHE 57 2HB PHE 57 -11.726 -4.381 -20.779 396 HD1 PHE 57 1HD PHE 57 -9.486 -4.315 -21.465 397 HD2 PHE 57 2HD PHE 57 -10.804 -1.655 -18.433 398 HE1 PHE 57 1HE PHE 57 -7.109 -3.641 -21.023 399 HE2 PHE 57 2HE PHE 57 -8.427 -0.981 -17.990 400 HZ PHE 57 HZ PHE 57 -6.608 -1.982 -19.291 401 H GLN 58 H GLN 58 -11.285 -3.208 -23.178 402 HA GLN 58 HA GLN 58 -9.253 -1.387 -23.284 403 1HB GLN 58 1HB GLN 58 -10.639 -2.925 -25.519 404 2HB GLN 58 2HB GLN 58 -9.150 -2.031 -25.752 405 1HG GLN 58 1HG GLN 58 -7.908 -3.464 -24.315 406 2HG GLN 58 2HG GLN 58 -9.344 -4.063 -23.509 407 1HE2 GLN 58 1HE2 GLN 58 -8.948 -3.615 -26.981 408 2HE2 GLN 58 2HE2 GLN 58 -9.023 -5.282 -27.445 409 H GLU 59 H GLU 59 -12.367 -1.352 -25.170 410 HA GLU 59 HA GLU 59 -11.955 1.012 -26.444 411 1HB GLU 59 1HB GLU 59 -14.424 -0.470 -25.537 412 2HB GLU 59 2HB GLU 59 -14.610 1.122 -26.245 413 1HG GLU 59 1HG GLU 59 -12.759 -0.627 -27.767 414 2HG GLU 59 2HG GLU 59 -14.389 -1.265 -27.669 415 HE2 GLU 59 HE GLU 59 -15.796 -0.320 -29.168 416 H ALA 60 H ALA 60 -12.923 0.387 -23.075 417 HA ALA 60 HA ALA 60 -13.783 3.050 -22.561 418 1HB ALA 60 1HB ALA 60 -13.037 0.666 -20.833 419 2HB ALA 60 3HB ALA 60 -14.663 1.283 -21.210 420 3HB ALA 60 2HB ALA 60 -13.579 2.220 -20.154 421 H ALA 61 H ALA 61 -10.706 1.234 -22.407 422 HA ALA 61 HA ALA 61 -9.265 3.013 -20.838 423 1HB ALA 61 1HB ALA 61 -8.797 0.730 -22.583 424 2HB ALA 61 3HB ALA 61 -7.880 1.269 -21.156 425 3HB ALA 61 2HB ALA 61 -7.505 1.942 -22.760 426 H ASN 62 H ASN 62 -10.220 3.089 -24.279 427 HA ASN 62 HA ASN 62 -8.428 5.102 -25.004 428 1HB ASN 62 1HB ASN 62 -11.028 4.017 -26.148 429 2HB ASN 62 2HB ASN 62 -10.312 5.449 -26.861 430 1HD2 ASN 62 1HD2 ASN 62 -9.738 2.082 -25.986 431 2HD2 ASN 62 2HD2 ASN 62 -8.523 1.735 -27.170 432 H LYS 63 H LYS 63 -11.986 5.076 -24.202 433 HA LYS 63 HA LYS 63 -12.504 7.745 -24.447 434 1HB LYS 63 1HB LYS 63 -13.642 5.600 -22.658 435 2HB LYS 63 2HB LYS 63 -14.250 7.242 -22.599 436 1HG LYS 63 1HG LYS 63 -14.649 7.144 -25.094 437 2HG LYS 63 2HG LYS 63 -14.127 5.471 -25.086 438 1HD LYS 63 1HD LYS 63 -16.612 5.663 -24.989 439 2HD LYS 63 2HD LYS 63 -15.970 4.845 -23.579 440 1HE LYS 63 1HE LYS 63 -16.711 6.473 -22.161 441 2HE LYS 63 2HE LYS 63 -16.085 7.759 -23.173 442 H GLN 64 H GLN 64 -11.032 5.972 -21.677 443 HA GLN 64 HA GLN 64 -10.971 8.259 -20.044 444 1HB GLN 64 1HB GLN 64 -10.128 5.449 -19.902 445 2HB GLN 64 2HB GLN 64 -8.965 6.508 -19.130 446 1HG GLN 64 1HG GLN 64 -11.847 7.071 -18.528 447 2HG GLN 64 2HG GLN 64 -11.209 5.572 -17.882 448 1HE2 GLN 64 1HE2 GLN 64 -10.710 9.057 -18.073 449 2HE2 GLN 64 2HE2 GLN 64 -9.849 9.254 -16.583 450 H LYS 65 H LYS 65 -8.601 6.622 -22.221 451 HA LYS 65 HA LYS 65 -6.366 8.089 -21.580 452 1HB LYS 65 1HB LYS 65 -7.270 6.365 -23.754 453 2HB LYS 65 2HB LYS 65 -6.201 7.629 -24.328 454 1HG LYS 65 1HG LYS 65 -4.795 5.777 -23.679 455 2HG LYS 65 2HG LYS 65 -4.581 7.019 -22.461 456 1HD LYS 65 1HD LYS 65 -4.983 5.285 -21.006 457 2HD LYS 65 2HD LYS 65 -6.661 5.671 -21.330 458 1HE LYS 65 1HE LYS 65 -6.527 3.319 -21.684 459 2HE LYS 65 2HE LYS 65 -6.519 3.994 -23.301 460 H GLN 66 H GLN 66 -9.244 8.975 -23.473 461 HA GLN 66 HA GLN 66 -8.026 11.281 -24.569 462 1HB GLN 66 1HB GLN 66 -10.178 9.842 -25.290 463 2HB GLN 66 2HB GLN 66 -11.015 11.033 -24.315 464 1HG GLN 66 1HG GLN 66 -9.088 11.716 -26.586 465 2HG GLN 66 2HG GLN 66 -10.832 11.672 -26.751 466 1HE2 GLN 66 1HE2 GLN 66 -12.126 13.123 -25.525 467 2HE2 GLN 66 2HE2 GLN 66 -11.511 14.654 -24.996 468 H GLU 67 H GLU 67 -10.579 10.744 -22.030 469 HA GLU 67 HA GLU 67 -10.787 13.373 -21.286 470 1HB GLU 67 1HB GLU 67 -11.591 10.754 -20.237 471 2HB GLU 67 2HB GLU 67 -11.230 11.874 -18.939 472 1HG GLU 67 1HG GLU 67 -13.654 11.877 -19.840 473 2HG GLU 67 2HG GLU 67 -12.879 13.438 -19.653 474 HE2 GLU 67 HE GLU 67 -14.050 13.824 -22.942 475 H LEU 68 H LEU 68 -8.239 11.039 -20.693 476 HA LEU 68 HA LEU 68 -7.207 12.273 -18.353 477 1HB LEU 68 1HB LEU 68 -6.866 9.885 -19.628 478 2HB LEU 68 2HB LEU 68 -5.384 10.715 -20.060 479 HG LEU 68 HG LEU 68 -4.813 11.041 -17.724 480 1HD1 LEU 68 1HD1 LEU 68 -7.595 10.675 -17.289 481 2HD1 LEU 68 2HD1 LEU 68 -6.737 9.398 -16.394 482 3HD1 LEU 68 3HD1 LEU 68 -6.331 11.108 -16.112 483 1HD2 LEU 68 3HD2 LEU 68 -5.308 8.370 -18.864 484 2HD2 LEU 68 1HD2 LEU 68 -3.830 9.074 -18.165 485 3HD2 LEU 68 2HD2 LEU 68 -5.086 8.402 -17.098 486 H ASP 69 H ASP 69 -6.024 12.181 -21.793 487 HA ASP 69 HA ASP 69 -4.081 14.080 -21.404 488 1HB ASP 69 1HB ASP 69 -4.856 12.495 -23.478 489 2HB ASP 69 2HB ASP 69 -5.527 14.014 -24.039 490 HD2 ASP 69 HD ASP 69 -2.556 14.746 -25.463 491 H GLU 70 H GLU 70 -7.478 14.347 -22.690 492 HA GLU 70 HA GLU 70 -7.523 16.974 -23.294 493 1HB GLU 70 1HB GLU 70 -9.807 16.708 -23.462 494 2HB GLU 70 2HB GLU 70 -9.361 15.018 -23.335 495 1HG GLU 70 1HG GLU 70 -9.772 15.068 -20.884 496 2HG GLU 70 2HG GLU 70 -10.150 16.777 -20.964 497 HE2 GLU 70 HE GLU 70 -13.223 16.494 -21.550 498 H ILE 71 H ILE 71 -8.060 15.442 -20.061 499 HA ILE 71 HA ILE 71 -8.546 17.937 -18.784 500 HB ILE 71 HB ILE 71 -8.010 15.138 -17.814 501 1HG1 ILE 71 1HG1 ILE 71 -10.503 16.861 -17.722 502 2HG1 ILE 71 2HG1 ILE 71 -10.183 15.630 -18.927 503 1HG2 ILE 71 2HG2 ILE 71 -7.676 17.585 -16.342 504 2HG2 ILE 71 3HG2 ILE 71 -9.066 16.678 -15.700 505 3HG2 ILE 71 1HG2 ILE 71 -7.468 15.901 -15.805 506 1HD1 ILE 71 1HD1 ILE 71 -9.860 14.743 -16.094 507 2HD1 ILE 71 2HD1 ILE 71 -11.519 15.143 -16.598 508 3HD1 ILE 71 3HD1 ILE 71 -10.599 13.897 -17.475 509 H SER 72 H SER 72 -5.740 15.639 -18.904 510 HA SER 72 HA SER 72 -4.075 17.082 -17.305 511 1HB SER 72 1HB SER 72 -2.963 15.164 -17.778 512 2HB SER 72 2HB SER 72 -3.846 14.933 -19.274 513 HG SER 72 HG SER 72 -1.349 15.410 -19.225 514 H THR 73 H THR 73 -5.158 17.699 -20.605 515 HA THR 73 HA THR 73 -3.052 19.668 -21.048 516 HB THR 73 HB THR 73 -5.222 18.326 -22.706 517 HG1 THR 73 1HG THR 73 -3.157 17.932 -23.909 518 1HG2 THR 73 1HG2 THR 73 -4.768 20.984 -23.120 519 2HG2 THR 73 2HG2 THR 73 -3.353 20.315 -23.968 520 3HG2 THR 73 3HG2 THR 73 -4.994 19.838 -24.464 521 H ASN 74 H ASN 74 -6.440 19.420 -20.075 522 HA ASN 74 HA ASN 74 -7.299 21.910 -20.753 523 1HB ASN 74 1HB ASN 74 -8.019 19.829 -18.774 524 2HB ASN 74 2HB ASN 74 -8.422 21.438 -18.208 525 1HD2 ASN 74 1HD2 ASN 74 -9.180 18.878 -20.329 526 2HD2 ASN 74 2HD2 ASN 74 -10.537 19.578 -21.147 527 H ILE 75 H ILE 75 -5.061 20.809 -18.223 528 HA ILE 75 HA ILE 75 -5.223 23.148 -16.620 529 HB ILE 75 HB ILE 75 -2.981 21.136 -16.748 530 1HG1 ILE 75 1HG1 ILE 75 -5.160 19.974 -16.605 531 2HG1 ILE 75 2HG1 ILE 75 -4.174 19.764 -15.171 532 1HG2 ILE 75 3HG2 ILE 75 -3.081 23.441 -15.348 533 2HG2 ILE 75 1HG2 ILE 75 -3.882 22.343 -14.198 534 3HG2 ILE 75 2HG2 ILE 75 -2.244 21.973 -14.788 535 1HD1 ILE 75 1HD1 ILE 75 -6.048 22.103 -15.150 536 2HD1 ILE 75 2HD1 ILE 75 -6.783 20.484 -15.057 537 3HD1 ILE 75 3HD1 ILE 75 -5.598 20.995 -13.831 538 H ARG 76 H ARG 76 -3.140 22.009 -19.325 539 HA ARG 76 HA ARG 76 -1.283 24.025 -19.149 540 1HB ARG 76 1HB ARG 76 -2.278 22.702 -21.720 541 2HB ARG 76 2HB ARG 76 -0.705 23.433 -21.472 542 1HG ARG 76 1HG ARG 76 -1.325 21.380 -19.438 543 2HG ARG 76 2HG ARG 76 -1.350 20.734 -21.067 544 1HD ARG 76 1HD ARG 76 0.923 20.503 -20.436 545 2HD ARG 76 2HD ARG 76 0.930 21.967 -21.399 546 HE ARG 76 HE ARG 76 1.274 23.265 -19.437 547 2HH1 ARG 76 1HH ARG 76 2.023 22.195 -16.218 548 1HH2 ARG 76 2HH2 ARG 76 0.755 19.858 -18.615 549 2HH2 ARG 76 1HH2 ARG 76 1.300 20.041 -16.981 550 H GLN 77 H GLN 77 -4.610 23.999 -20.308 551 HA GLN 77 HA GLN 77 -4.295 26.348 -21.889 552 1HB GLN 77 1HB GLN 77 -6.620 24.598 -21.063 553 2HB GLN 77 2HB GLN 77 -6.937 26.171 -21.767 554 1HG GLN 77 1HG GLN 77 -4.887 24.800 -23.324 555 2HG GLN 77 2HG GLN 77 -6.281 23.754 -23.137 556 1HE2 GLN 77 1HE2 GLN 77 -5.177 25.235 -25.450 557 2HE2 GLN 77 2HE2 GLN 77 -6.474 26.187 -26.094 558 H ALA 78 H ALA 78 -5.027 25.520 -18.541 559 HA ALA 78 HA ALA 78 -6.413 27.847 -17.826 560 1HB ALA 78 3HB ALA 78 -4.565 26.243 -16.033 561 2HB ALA 78 1HB ALA 78 -6.059 27.104 -15.595 562 3HB ALA 78 2HB ALA 78 -6.142 25.618 -16.571 563 H GLY 79 H GLY 79 -3.084 27.242 -18.683 564 1HA GLY 79 2HA GLY 79 -2.418 29.993 -17.847 565 2HA GLY 79 1HA GLY 79 -1.730 29.134 -19.210 566 H VAL 80 H VAL 80 -1.800 26.605 -17.274 567 HA VAL 80 HA VAL 80 0.374 27.357 -15.498 568 HB VAL 80 HB VAL 80 -0.921 24.654 -15.798 569 1HG1 VAL 80 3HG1 VAL 80 0.979 25.919 -13.944 570 2HG1 VAL 80 1HG1 VAL 80 -0.371 25.088 -13.134 571 3HG1 VAL 80 2HG1 VAL 80 0.668 24.198 -14.274 572 1HG2 VAL 80 3HG2 VAL 80 -2.463 26.813 -15.368 573 2HG2 VAL 80 1HG2 VAL 80 -2.767 25.237 -14.597 574 3HG2 VAL 80 2HG2 VAL 80 -1.919 26.518 -13.699 575 H GLN 81 H GLN 81 2.113 27.733 -16.934 576 HA GLN 81 HA GLN 81 3.190 25.271 -17.992 577 1HB GLN 81 1HB GLN 81 3.897 26.894 -20.047 578 2HB GLN 81 2HB GLN 81 2.465 25.885 -20.077 579 1HG GLN 81 1HG GLN 81 1.027 27.674 -19.860 580 2HG GLN 81 2HG GLN 81 2.082 28.528 -18.752 581 1HE2 GLN 81 1HE2 GLN 81 2.737 30.378 -19.507 582 2HE2 GLN 81 2HE2 GLN 81 3.161 30.764 -21.142 583 H TYR 82 H TYR 82 3.548 27.597 -15.849 584 HA TYR 82 HA TYR 82 6.433 27.586 -16.076 585 1HB TYR 82 1HB TYR 82 6.509 30.066 -15.953 586 2HB TYR 82 2HB TYR 82 5.518 29.628 -17.330 587 HD1 TYR 82 1HD TYR 82 2.932 29.508 -16.912 588 HD2 TYR 82 2HD TYR 82 5.679 31.552 -14.346 589 HE1 TYR 82 1HE TYR 82 1.028 30.910 -15.979 590 HE2 TYR 82 2HE TYR 82 3.765 32.948 -13.422 591 HH TYR 82 HH TYR 82 0.429 32.322 -14.426 592 H SER 83 H SER 83 6.149 26.189 -14.187 593 HA SER 83 HA SER 83 5.813 27.822 -11.825 594 1HB SER 83 1HB SER 83 3.715 26.273 -12.587 595 2HB SER 83 2HB SER 83 4.625 25.072 -11.693 596 HG SER 83 HG SER 83 4.157 26.047 -9.830 597 H ARG 84 H ARG 84 6.331 24.359 -12.848 598 HA ARG 84 HA ARG 84 8.410 24.180 -10.877 599 1HB ARG 84 1HB ARG 84 6.530 22.375 -11.795 600 2HB ARG 84 2HB ARG 84 7.927 21.884 -12.732 601 1HG ARG 84 1HG ARG 84 9.173 22.068 -10.365 602 2HG ARG 84 2HG ARG 84 7.551 21.867 -9.734 603 1HD ARG 84 1HD ARG 84 7.417 19.838 -11.438 604 2HD ARG 84 2HD ARG 84 9.167 19.940 -11.430 605 HE ARG 84 HE ARG 84 8.325 19.984 -8.719 606 2HH1 ARG 84 1HH ARG 84 8.370 16.571 -8.076 607 1HH2 ARG 84 2HH2 ARG 84 8.280 17.737 -11.458 608 2HH2 ARG 84 1HH2 ARG 84 8.316 16.323 -10.459 609 H ALA 85 H ALA 85 7.943 24.533 -14.365 610 HA ALA 85 HA ALA 85 10.814 24.083 -14.788 611 1HB ALA 85 1HB ALA 85 8.598 24.214 -16.865 612 2HB ALA 85 3HB ALA 85 9.113 22.704 -16.076 613 3HB ALA 85 2HB ALA 85 10.262 23.620 -17.080 614 H ASP 86 H ASP 86 10.624 26.353 -13.508 615 HA ASP 86 HA ASP 86 9.824 28.512 -15.137 616 1HB ASP 86 1HB ASP 86 10.304 28.168 -12.454 617 2HB ASP 86 2HB ASP 86 11.791 28.965 -12.927 618 HD2 ASP 86 HD ASP 86 11.096 30.672 -11.636 619 H GLU 87 H GLU 87 12.775 26.628 -14.531 620 HA GLU 87 HA GLU 87 14.340 28.584 -16.000 621 1HB GLU 87 1HB GLU 87 16.309 27.398 -15.150 622 2HB GLU 87 2HB GLU 87 15.238 27.792 -13.820 623 1HG GLU 87 1HG GLU 87 14.603 25.569 -13.477 624 2HG GLU 87 2HG GLU 87 14.837 25.125 -15.156 625 HE2 GLU 87 HE GLU 87 16.170 23.493 -14.743 626 H GLU 88 H GLU 88 12.269 26.313 -16.878 627 HA GLU 88 HA GLU 88 13.467 24.319 -18.187 628 1HB GLU 88 1HB GLU 88 10.931 25.394 -18.131 629 2HB GLU 88 2HB GLU 88 11.377 25.699 -19.798 630 1HG GLU 88 1HG GLU 88 11.763 22.964 -18.511 631 2HG GLU 88 2HG GLU 88 10.249 23.422 -19.266 632 HE2 GLU 88 HE GLU 88 13.499 22.313 -20.983 633 H GLN 89 H GLN 89 12.912 27.654 -19.523 634 HA GLN 89 HA GLN 89 13.836 27.447 -21.971 635 1HB GLN 89 1HB GLN 89 13.442 29.537 -20.180 636 2HB GLN 89 2HB GLN 89 15.139 29.711 -20.577 637 1HG GLN 89 1HG GLN 89 14.713 30.296 -22.764 638 2HG GLN 89 2HG GLN 89 13.386 29.163 -22.922 639 1HE2 GLN 89 1HE2 GLN 89 11.772 30.355 -23.656 640 2HE2 GLN 89 2HE2 GLN 89 11.115 31.772 -22.908 641 H GLN 90 H GLN 90 16.029 27.952 -19.110 642 HA GLN 90 HA GLN 90 18.365 27.762 -20.559 643 1HB GLN 90 1HB GLN 90 17.898 28.506 -18.084 644 2HB GLN 90 2HB GLN 90 18.136 26.816 -17.687 645 1HG GLN 90 1HG GLN 90 20.364 26.969 -19.000 646 2HG GLN 90 2HG GLN 90 20.130 28.706 -19.006 647 1HE2 GLN 90 1HE2 GLN 90 22.326 27.644 -17.844 648 2HE2 GLN 90 2HE2 GLN 90 22.280 27.809 -16.120 649 H GLN 91 H GLN 91 16.780 25.225 -18.478 650 HA GLN 91 HA GLN 91 18.485 23.201 -19.080 651 1HB GLN 91 1HB GLN 91 16.070 23.503 -17.685 652 2HB GLN 91 2HB GLN 91 15.689 22.296 -18.897 653 1HG GLN 91 1HG GLN 91 17.577 20.894 -18.185 654 2HG GLN 91 2HG GLN 91 18.147 22.140 -17.092 655 1HE2 GLN 91 1HE2 GLN 91 17.995 20.969 -15.251 656 2HE2 GLN 91 2HE2 GLN 91 16.507 20.455 -14.527 657 H ALA 92 H ALA 92 16.126 24.763 -21.133 658 HA ALA 92 HA ALA 92 15.587 22.647 -22.891 659 1HB ALA 92 3HB ALA 92 15.696 25.416 -23.968 660 2HB ALA 92 2HB ALA 92 14.676 25.191 -22.527 661 3HB ALA 92 1HB ALA 92 14.370 24.229 -23.993 662 H LEU 93 H LEU 93 17.660 25.551 -23.578 663 HA LEU 93 HA LEU 93 19.083 24.070 -25.563 664 1HB LEU 93 1HB LEU 93 20.032 26.077 -26.158 665 2HB LEU 93 2HB LEU 93 18.450 26.543 -25.566 666 HG LEU 93 HG LEU 93 20.029 26.738 -23.298 667 1HD1 LEU 93 2HD1 LEU 93 21.933 26.459 -25.139 668 2HD1 LEU 93 3HD1 LEU 93 21.649 28.206 -25.323 669 3HD1 LEU 93 1HD1 LEU 93 22.111 27.542 -23.738 670 1HD2 LEU 93 1HD2 LEU 93 19.099 28.789 -25.311 671 2HD2 LEU 93 2HD2 LEU 93 18.355 28.332 -23.760 672 3HD2 LEU 93 3HD2 LEU 93 19.891 29.231 -23.780 673 H SER 94 H SER 94 19.491 22.377 -23.672 674 HA SER 94 HA SER 94 21.990 23.159 -22.391 675 1HB SER 94 1HB SER 94 21.530 21.438 -20.709 676 2HB SER 94 2HB SER 94 20.162 22.527 -20.828 677 HG SER 94 HG SER 94 20.406 19.833 -21.815 678 H SER 95 H SER 95 20.235 20.362 -23.916 679 HA SER 95 HA SER 95 22.338 18.658 -24.096 680 1HB SER 95 1HB SER 95 19.818 19.087 -25.672 681 2HB SER 95 2HB SER 95 21.016 18.016 -26.371 682 HG SER 95 HG SER 95 19.725 16.704 -25.098 683 H GLN 96 H GLN 96 21.256 21.156 -26.503 684 HA GLN 96 HA GLN 96 23.235 20.606 -28.352 685 1HB GLN 96 1HB GLN 96 21.223 22.702 -27.870 686 2HB GLN 96 2HB GLN 96 22.664 23.337 -28.638 687 1HG GLN 96 1HG GLN 96 22.123 22.371 -30.620 688 2HG GLN 96 2HG GLN 96 21.952 20.796 -29.871 689 1HE2 GLN 96 1HE2 GLN 96 20.345 21.619 -31.940 690 2HE2 GLN 96 2HE2 GLN 96 18.711 21.822 -31.403 691 H MET 97 H MET 97 23.095 23.008 -25.643 692 HA MET 97 HA MET 97 25.456 24.274 -26.153 693 1HB MET 97 1HB MET 97 23.805 24.988 -24.435 694 2HB MET 97 2HB MET 97 24.115 23.544 -23.491 695 1HG MET 97 1HG MET 97 25.624 24.839 -22.358 696 2HG MET 97 2HG MET 97 26.675 24.566 -23.733 697 1HE MET 97 3HE MET 97 26.480 26.628 -21.571 698 2HE MET 97 1HE MET 97 27.509 27.652 -22.600 699 3HE MET 97 2HE MET 97 25.947 28.268 -22.010 700 H GLY 98 H GLY 98 27.251 23.041 -26.750 701 1HA GLY 98 2HA GLY 98 28.153 21.025 -24.781 702 2HA GLY 98 1HA GLY 98 29.230 22.226 -25.464 703 H PHE 99 H PHE 99 29.983 19.637 -25.824 704 HA PHE 99 HA PHE 99 29.386 19.222 -28.663 705 1HB PHE 99 1HB PHE 99 31.716 18.408 -26.823 706 2HB PHE 99 2HB PHE 99 31.636 17.993 -28.523 707 HD1 PHE 99 1HD PHE 99 33.261 20.053 -26.405 708 HD2 PHE 99 2HD PHE 99 30.941 20.314 -29.949 709 HE1 PHE 99 1HE PHE 99 34.392 22.217 -26.986 710 HE2 PHE 99 2HE PHE 99 32.072 22.478 -30.530 711 HZ PHE 99 HZ PHE 99 33.784 23.404 -29.042 712 H MET 601 H MET 601 6.406 -18.998 -18.562 713 HA MET 601 HA MET 601 8.374 -20.053 -19.065 714 1HB MET 601 1HB MET 601 7.828 -19.386 -16.496 715 2HB MET 601 2HB MET 601 8.033 -21.107 -16.241 716 1HG MET 601 1HG MET 601 10.176 -20.016 -17.939 717 2HG MET 601 2HG MET 601 10.089 -19.177 -16.404 718 1HE MET 601 1HE MET 601 11.995 -19.676 -15.441 719 2HE MET 601 2HE MET 601 11.183 -20.438 -14.053 720 3HE MET 601 3HE MET 601 12.583 -21.233 -14.810 721 H THR 602 H THR 602 6.657 -22.390 -16.859 722 HA THR 602 HA THR 602 7.973 -24.656 -17.483 723 HB THR 602 HB THR 602 5.022 -24.101 -16.927 724 HG1 THR 602 1HG THR 602 6.633 -23.675 -15.263 725 1HG2 THR 602 3HG2 THR 602 6.503 -26.720 -17.325 726 2HG2 THR 602 1HG2 THR 602 5.264 -26.607 -16.052 727 3HG2 THR 602 2HG2 THR 602 4.823 -26.311 -17.751 728 H GLU 603 H GLU 603 5.281 -23.221 -19.420 729 HA GLU 603 HA GLU 603 6.308 -24.812 -21.626 730 1HB GLU 603 1HB GLU 603 3.362 -24.475 -20.907 731 2HB GLU 603 2HB GLU 603 3.947 -25.221 -22.381 732 1HG GLU 603 1HG GLU 603 5.388 -26.643 -20.527 733 2HG GLU 603 2HG GLU 603 3.957 -26.279 -19.583 734 HE2 GLU 603 HE GLU 603 4.781 -27.562 -22.770 735 H GLN 604 H GLN 604 7.061 -23.348 -23.094 736 HA GLN 604 HA GLN 604 6.561 -20.697 -23.060 737 1HB GLN 604 1HB GLN 604 7.932 -22.545 -24.737 738 2HB GLN 604 2HB GLN 604 6.937 -21.578 -25.808 739 1HG GLN 604 1HG GLN 604 8.119 -19.810 -23.849 740 2HG GLN 604 2HG GLN 604 9.390 -20.828 -24.497 741 1HE2 GLN 604 1HE2 GLN 604 8.711 -17.952 -24.831 742 2HE2 GLN 604 2HE2 GLN 604 8.631 -17.663 -26.537 743 H GLN 605 H GLN 605 4.835 -23.244 -24.970 744 HA GLN 605 HA GLN 605 3.264 -21.814 -26.538 745 1HB GLN 605 1HB GLN 605 2.344 -24.144 -24.797 746 2HB GLN 605 2HB GLN 605 1.523 -23.589 -26.241 747 1HG GLN 605 1HG GLN 605 4.098 -23.900 -27.194 748 2HG GLN 605 2HG GLN 605 4.041 -25.162 -25.980 749 1HE2 GLN 605 1HE2 GLN 605 3.242 -27.037 -26.538 750 2HE2 GLN 605 2HE2 GLN 605 2.197 -27.376 -27.877 751 H TRP 606 H TRP 606 2.590 -22.455 -23.028 752 HA TRP 606 HA TRP 606 1.110 -19.952 -22.950 753 1HB TRP 606 1HB TRP 606 -0.865 -20.830 -22.074 754 2HB TRP 606 2HB TRP 606 -0.506 -21.810 -23.482 755 HD1 TRP 606 HD TRP 606 0.437 -24.380 -22.942 756 HE1 TRP 606 1HE TRP 606 0.041 -26.045 -20.934 757 HE3 TRP 606 3HE TRP 606 -1.216 -20.862 -19.664 758 HZ2 TRP 606 2HZ TRP 606 -0.898 -25.711 -18.259 759 HZ3 TRP 606 3HZ TRP 606 -1.852 -21.615 -17.375 760 HH2 TRP 606 HH TRP 606 -1.715 -23.946 -16.654 761 H ASN 607 H ASN 607 2.776 -19.080 -21.653 762 HA ASN 607 HA ASN 607 4.101 -20.439 -19.688 763 1HB ASN 607 1HB ASN 607 3.384 -17.471 -19.914 764 2HB ASN 607 2HB ASN 607 4.512 -18.086 -18.723 765 1HD2 ASN 607 1HD2 ASN 607 5.839 -16.476 -19.951 766 2HD2 ASN 607 2HD2 ASN 607 6.771 -17.044 -21.296 767 H PHE 608 H PHE 608 2.856 -21.608 -18.157 768 HA PHE 608 HA PHE 608 0.398 -20.891 -17.179 769 1HB PHE 608 1HB PHE 608 1.486 -23.111 -16.903 770 2HB PHE 608 2HB PHE 608 2.793 -22.398 -15.979 771 HD1 PHE 608 1HD PHE 608 2.627 -23.547 -13.944 772 HD2 PHE 608 2HD PHE 608 -0.840 -21.735 -15.589 773 HE1 PHE 608 1HE PHE 608 1.377 -24.010 -11.818 774 HE2 PHE 608 2HE PHE 608 -2.091 -22.199 -13.462 775 HZ PHE 608 HZ PHE 608 -0.967 -23.331 -11.603 776 H ALA 609 H ALA 609 3.658 -20.306 -15.678 777 HA ALA 609 HA ALA 609 2.555 -18.837 -13.518 778 1HB ALA 609 2HB ALA 609 5.401 -18.864 -14.596 779 2HB ALA 609 1HB ALA 609 4.727 -20.103 -13.511 780 3HB ALA 609 3HB ALA 609 4.877 -18.419 -12.954 781 H GLY 610 H GLY 610 2.799 -18.160 -16.820 782 1HA GLY 610 2HA GLY 610 3.168 -16.199 -17.991 783 2HA GLY 610 1HA GLY 610 3.397 -15.321 -16.492 784 H ILE 611 H ILE 611 0.698 -17.517 -17.521 785 HA ILE 611 HA ILE 611 -1.069 -15.232 -17.722 786 HB ILE 611 HB ILE 611 -1.347 -16.741 -19.463 787 1HG1 ILE 611 1HG1 ILE 611 -3.445 -16.081 -17.972 788 2HG1 ILE 611 2HG1 ILE 611 -3.590 -17.095 -19.394 789 1HG2 ILE 611 1HG2 ILE 611 -0.824 -18.805 -17.398 790 2HG2 ILE 611 2HG2 ILE 611 -1.943 -19.253 -18.707 791 3HG2 ILE 611 3HG2 ILE 611 -0.294 -18.706 -19.094 792 1HD1 ILE 611 3HD1 ILE 611 -2.951 -18.527 -16.845 793 2HD1 ILE 611 1HD1 ILE 611 -4.575 -17.807 -16.962 794 3HD1 ILE 611 2HD1 ILE 611 -4.041 -18.997 -18.172 795 H GLU 612 H GLU 612 -0.051 -17.638 -15.409 796 HA GLU 612 HA GLU 612 -2.440 -17.704 -13.938 797 1HB GLU 612 1HB GLU 612 -0.875 -19.510 -13.670 798 2HB GLU 612 2HB GLU 612 0.443 -18.419 -13.291 799 1HG GLU 612 1HG GLU 612 -1.663 -17.880 -11.409 800 2HG GLU 612 2HG GLU 612 -1.479 -19.621 -11.488 801 HE2 GLU 612 HE GLU 612 0.491 -20.454 -10.810 802 H ALA 613 H ALA 613 0.555 -15.712 -13.822 803 HA ALA 613 HA ALA 613 -0.392 -14.303 -11.482 804 1HB ALA 613 2HB ALA 613 2.050 -14.966 -12.090 805 2HB ALA 613 1HB ALA 613 1.754 -13.333 -11.447 806 3HB ALA 613 3HB ALA 613 1.994 -13.572 -13.194 807 H ALA 614 H ALA 614 -0.534 -14.100 -14.983 808 HA ALA 614 HA ALA 614 -0.686 -11.432 -15.469 809 1HB ALA 614 2HB ALA 614 -2.235 -13.788 -16.594 810 2HB ALA 614 3HB ALA 614 -2.357 -12.148 -17.274 811 3HB ALA 614 1HB ALA 614 -0.792 -12.994 -17.268 812 H ALA 615 H ALA 615 -3.396 -13.602 -14.395 813 HA ALA 615 HA ALA 615 -5.339 -11.641 -14.264 814 1HB ALA 615 3HB ALA 615 -6.492 -13.501 -13.769 815 2HB ALA 615 1HB ALA 615 -4.971 -14.391 -13.520 816 3HB ALA 615 2HB ALA 615 -5.736 -13.537 -12.158 817 H SER 616 H SER 616 -3.058 -12.827 -11.701 818 HA SER 616 HA SER 616 -3.974 -11.236 -9.688 819 1HB SER 616 1HB SER 616 -1.848 -13.014 -10.088 820 2HB SER 616 2HB SER 616 -1.036 -11.508 -9.709 821 HG SER 616 HG SER 616 -1.416 -12.328 -7.707 822 H ALA 617 H ALA 617 -1.999 -10.446 -12.525 823 HA ALA 617 HA ALA 617 -1.011 -7.981 -11.501 824 1HB ALA 617 1HB ALA 617 -0.387 -9.654 -13.591 825 2HB ALA 617 3HB ALA 617 0.194 -7.980 -13.425 826 3HB ALA 617 2HB ALA 617 -1.230 -8.331 -14.432 827 H ILE 618 H ILE 618 -3.904 -9.089 -13.281 828 HA ILE 618 HA ILE 618 -4.756 -6.529 -14.079 829 HB ILE 618 HB ILE 618 -6.272 -9.104 -13.648 830 1HG1 ILE 618 1HG1 ILE 618 -4.437 -9.265 -15.284 831 2HG1 ILE 618 2HG1 ILE 618 -6.015 -9.452 -16.023 832 1HG2 ILE 618 2HG2 ILE 618 -7.683 -7.017 -13.612 833 2HG2 ILE 618 3HG2 ILE 618 -7.146 -6.713 -15.282 834 3HG2 ILE 618 1HG2 ILE 618 -8.071 -8.185 -14.899 835 1HD1 ILE 618 2HD1 ILE 618 -5.305 -6.635 -16.000 836 2HD1 ILE 618 3HD1 ILE 618 -3.987 -7.584 -16.727 837 3HD1 ILE 618 1HD1 ILE 618 -5.634 -7.692 -17.394 838 H GLN 619 H GLN 619 -5.378 -8.573 -11.173 839 HA GLN 619 HA GLN 619 -7.316 -7.008 -10.051 840 1HB GLN 619 1HB GLN 619 -5.493 -9.129 -9.200 841 2HB GLN 619 2HB GLN 619 -5.746 -7.979 -7.903 842 1HG GLN 619 1HG GLN 619 -7.957 -9.376 -9.484 843 2HG GLN 619 2HG GLN 619 -7.448 -9.801 -7.862 844 1HE2 GLN 619 1HE2 GLN 619 -9.821 -8.394 -9.451 845 2HE2 GLN 619 2HE2 GLN 619 -10.345 -7.162 -8.353 846 H GLY 620 H GLY 620 -3.768 -6.969 -9.214 847 1HA GLY 620 2HA GLY 620 -2.426 -5.297 -8.540 848 2HA GLY 620 1HA GLY 620 -3.790 -4.736 -7.594 849 H ASN 621 H ASN 621 -3.811 -4.994 -11.172 850 HA ASN 621 HA ASN 621 -3.146 -2.278 -11.542 851 1HB ASN 621 1HB ASN 621 -4.090 -4.568 -13.269 852 2HB ASN 621 2HB ASN 621 -4.297 -2.952 -13.913 853 1HD2 ASN 621 1HD2 ASN 621 -2.187 -1.562 -13.068 854 2HD2 ASN 621 2HD2 ASN 621 -0.692 -2.208 -13.658 855 H VAL 622 H VAL 622 -6.090 -4.231 -11.085 856 HA VAL 622 HA VAL 622 -7.930 -2.357 -12.112 857 HB VAL 622 HB VAL 622 -8.111 -4.713 -10.241 858 1HG1 VAL 622 1HG1 VAL 622 -10.255 -2.759 -11.055 859 2HG1 VAL 622 2HG1 VAL 622 -10.655 -4.467 -10.752 860 3HG1 VAL 622 3HG1 VAL 622 -9.926 -3.481 -9.461 861 1HG2 VAL 622 3HG2 VAL 622 -7.807 -4.608 -12.960 862 2HG2 VAL 622 1HG2 VAL 622 -8.560 -5.953 -12.070 863 3HG2 VAL 622 2HG2 VAL 622 -9.578 -4.689 -12.802 864 H THR 623 H THR 623 -6.930 -3.195 -8.717 865 HA THR 623 HA THR 623 -8.414 -1.167 -7.503 866 HB THR 623 HB THR 623 -6.936 -1.690 -5.569 867 HG1 THR 623 1HG THR 623 -5.101 -3.169 -6.168 868 1HG2 THR 623 2HG2 THR 623 -8.587 -3.523 -6.653 869 2HG2 THR 623 3HG2 THR 623 -7.048 -4.334 -7.031 870 3HG2 THR 623 1HG2 THR 623 -7.468 -3.966 -5.341 871 H SER 624 H SER 624 -5.153 -1.151 -8.983 872 HA SER 624 HA SER 624 -4.228 1.179 -7.968 873 1HB SER 624 1HB SER 624 -3.926 -0.040 -10.738 874 2HB SER 624 2HB SER 624 -3.040 1.394 -10.257 875 HG SER 624 HG SER 624 -2.069 -0.895 -9.924 876 H ILE 625 H ILE 625 -6.278 0.704 -10.932 877 HA ILE 625 HA ILE 625 -6.505 3.480 -11.431 878 HB ILE 625 HB ILE 625 -7.645 0.961 -12.503 879 1HG1 ILE 625 1HG1 ILE 625 -7.007 2.935 -14.465 880 2HG1 ILE 625 2HG1 ILE 625 -5.731 2.948 -13.264 881 1HG2 ILE 625 3HG2 ILE 625 -8.993 3.648 -12.770 882 2HG2 ILE 625 1HG2 ILE 625 -9.166 2.364 -13.991 883 3HG2 ILE 625 2HG2 ILE 625 -9.705 2.080 -12.318 884 1HD1 ILE 625 2HD1 ILE 625 -5.575 0.431 -13.463 885 2HD1 ILE 625 3HD1 ILE 625 -6.763 0.512 -14.785 886 3HD1 ILE 625 1HD1 ILE 625 -5.174 1.293 -14.967 887 H HIS 626 H HIS 626 -8.208 1.137 -9.393 888 HA HIS 626 HA HIS 626 -10.596 2.503 -9.092 889 1HB HIS 626 1HB HIS 626 -9.918 0.144 -8.343 890 2HB HIS 626 2HB HIS 626 -9.237 0.904 -6.918 891 HD1 HIS 626 1HD HIS 626 -11.153 -0.670 -5.735 892 HD2 HIS 626 2HD HIS 626 -12.490 2.671 -7.890 893 HE1 HIS 626 1HE HIS 626 -13.546 -0.232 -4.963 894 H SER 627 H SER 627 -7.516 2.701 -7.187 895 HA SER 627 HA SER 627 -8.589 4.816 -5.617 896 1HB SER 627 1HB SER 627 -6.060 3.232 -5.729 897 2HB SER 627 2HB SER 627 -5.897 4.859 -5.099 898 HG SER 627 HG SER 627 -6.736 4.165 -3.266 899 H LEU 628 H LEU 628 -6.138 4.431 -8.255 900 HA LEU 628 HA LEU 628 -5.082 6.899 -8.397 901 1HB LEU 628 1HB LEU 628 -5.712 4.765 -10.331 902 2HB LEU 628 2HB LEU 628 -5.449 6.348 -11.035 903 HG LEU 628 HG LEU 628 -3.459 5.258 -9.064 904 1HD1 LEU 628 2HD1 LEU 628 -4.101 4.080 -11.658 905 2HD1 LEU 628 3HD1 LEU 628 -2.403 4.598 -11.534 906 3HD1 LEU 628 1HD1 LEU 628 -3.078 3.467 -10.336 907 1HD2 LEU 628 2HD2 LEU 628 -3.345 7.189 -11.389 908 2HD2 LEU 628 3HD2 LEU 628 -3.100 7.527 -9.659 909 3HD2 LEU 628 1HD2 LEU 628 -1.900 6.566 -10.557 910 H LEU 629 H LEU 629 -8.271 5.882 -9.786 911 HA LEU 629 HA LEU 629 -8.907 8.370 -10.856 912 1HB LEU 629 1HB LEU 629 -10.130 5.808 -10.479 913 2HB LEU 629 2HB LEU 629 -11.276 7.054 -10.025 914 HG LEU 629 HG LEU 629 -11.422 6.307 -12.403 915 1HD1 LEU 629 3HD1 LEU 629 -11.068 9.139 -11.548 916 2HD1 LEU 629 1HD1 LEU 629 -11.196 8.809 -13.292 917 3HD1 LEU 629 2HD1 LEU 629 -12.499 8.298 -12.191 918 1HD2 LEU 629 2HD2 LEU 629 -8.588 6.935 -12.339 919 2HD2 LEU 629 3HD2 LEU 629 -9.532 6.018 -13.538 920 3HD2 LEU 629 1HD2 LEU 629 -9.422 7.790 -13.658 921 H ASP 630 H ASP 630 -9.304 6.986 -7.569 922 HA ASP 630 HA ASP 630 -10.940 9.016 -6.620 923 1HB ASP 630 1HB ASP 630 -10.543 6.809 -5.496 924 2HB ASP 630 2HB ASP 630 -8.900 7.297 -5.129 925 HD2 ASP 630 HD ASP 630 -9.759 9.822 -3.072 926 H GLU 631 H GLU 631 -7.352 8.428 -6.457 927 HA GLU 631 HA GLU 631 -6.757 10.717 -5.023 928 1HB GLU 631 1HB GLU 631 -4.595 9.995 -5.216 929 2HB GLU 631 2HB GLU 631 -5.347 8.543 -5.846 930 1HG GLU 631 1HG GLU 631 -4.955 9.189 -8.127 931 2HG GLU 631 2HG GLU 631 -4.621 10.853 -7.687 932 HE2 GLU 631 HE GLU 631 -1.803 8.320 -8.100 933 H GLY 632 H GLY 632 -7.298 10.128 -8.498 934 1HA GLY 632 2HA GLY 632 -7.201 11.496 -10.297 935 2HA GLY 632 1HA GLY 632 -6.219 12.625 -9.384 936 H LYS 633 H LYS 633 -9.485 11.357 -8.500 937 HA LYS 633 HA LYS 633 -10.960 13.503 -9.454 938 1HB LYS 633 1HB LYS 633 -11.704 11.189 -8.585 939 2HB LYS 633 2HB LYS 633 -11.678 11.913 -6.990 940 1HG LYS 633 1HG LYS 633 -13.927 12.178 -7.804 941 2HG LYS 633 2HG LYS 633 -13.189 13.765 -7.893 942 1HD LYS 633 1HD LYS 633 -12.525 12.807 -10.374 943 2HD LYS 633 2HD LYS 633 -14.017 11.927 -10.106 944 1HE LYS 633 1HE LYS 633 -14.926 14.326 -9.337 945 2HE LYS 633 2HE LYS 633 -13.586 14.913 -10.302 946 H GLN 634 H GLN 634 -8.969 13.106 -6.535 947 HA GLN 634 HA GLN 634 -10.058 15.321 -5.199 948 1HB GLN 634 1HB GLN 634 -7.493 13.725 -4.906 949 2HB GLN 634 2HB GLN 634 -7.797 15.131 -3.905 950 1HG GLN 634 1HG GLN 634 -9.908 12.965 -4.148 951 2HG GLN 634 2HG GLN 634 -8.551 12.742 -3.062 952 1HE2 GLN 634 1HE2 GLN 634 -10.741 12.700 -1.778 953 2HE2 GLN 634 2HE2 GLN 634 -11.145 14.173 -0.961 954 H SER 635 H SER 635 -7.946 14.979 -7.922 955 HA SER 635 HA SER 635 -6.715 17.545 -7.446 956 1HB SER 635 1HB SER 635 -5.869 15.192 -8.713 957 2HB SER 635 2HB SER 635 -6.202 16.269 -10.055 958 HG SER 635 HG SER 635 -3.991 16.247 -8.686 959 H LEU 636 H LEU 636 -9.254 15.957 -9.350 960 HA LEU 636 HA LEU 636 -9.548 17.726 -11.430 961 1HB LEU 636 1HB LEU 636 -11.104 15.669 -10.104 962 2HB LEU 636 2HB LEU 636 -12.129 16.971 -10.675 963 HG LEU 636 HG LEU 636 -11.798 15.029 -12.254 964 1HD1 LEU 636 1HD1 LEU 636 -11.162 17.854 -13.122 965 2HD1 LEU 636 2HD1 LEU 636 -11.458 16.523 -14.266 966 3HD1 LEU 636 3HD1 LEU 636 -12.734 17.020 -13.129 967 1HD2 LEU 636 3HD2 LEU 636 -9.301 14.878 -11.725 968 2HD2 LEU 636 1HD2 LEU 636 -9.793 14.702 -13.427 969 3HD2 LEU 636 2HD2 LEU 636 -9.100 16.238 -12.855 970 H THR 637 H THR 637 -10.534 18.009 -8.000 971 HA THR 637 HA THR 637 -12.098 20.351 -8.409 972 HB THR 637 HB THR 637 -12.704 19.333 -6.418 973 HG1 THR 637 1HG THR 637 -10.223 20.591 -5.515 974 1HG2 THR 637 2HG2 THR 637 -9.808 18.404 -6.354 975 2HG2 THR 637 3HG2 THR 637 -10.793 18.362 -4.872 976 3HG2 THR 637 1HG2 THR 637 -11.290 17.420 -6.299 977 H LYS 638 H LYS 638 -8.894 19.941 -6.748 978 HA LYS 638 HA LYS 638 -8.331 22.624 -6.598 979 1HB LYS 638 1HB LYS 638 -5.931 21.845 -6.463 980 2HB LYS 638 2HB LYS 638 -7.042 21.110 -5.325 981 1HG LYS 638 1HG LYS 638 -7.310 19.285 -7.276 982 2HG LYS 638 2HG LYS 638 -5.740 19.894 -7.763 983 1HD LYS 638 1HD LYS 638 -5.346 19.601 -5.050 984 2HD LYS 638 2HD LYS 638 -6.496 18.312 -5.346 985 1HE LYS 638 1HE LYS 638 -5.000 17.074 -6.587 986 2HE LYS 638 2HE LYS 638 -4.318 18.485 -7.371 987 H LEU 639 H LEU 639 -8.226 20.424 -9.364 988 HA LEU 639 HA LEU 639 -6.726 22.348 -10.932 989 1HB LEU 639 1HB LEU 639 -7.736 19.555 -11.389 990 2HB LEU 639 2HB LEU 639 -7.173 20.544 -12.722 991 HG LEU 639 HG LEU 639 -5.122 19.804 -12.317 992 1HD1 LEU 639 2HD1 LEU 639 -5.425 21.297 -9.701 993 2HD1 LEU 639 3HD1 LEU 639 -3.885 20.659 -10.325 994 3HD1 LEU 639 1HD1 LEU 639 -4.764 21.912 -11.235 995 1HD2 LEU 639 1HD2 LEU 639 -6.465 18.007 -10.925 996 2HD2 LEU 639 2HD2 LEU 639 -4.686 18.066 -10.894 997 3HD2 LEU 639 3HD2 LEU 639 -5.623 18.773 -9.556 998 H ALA 640 H ALA 640 -10.010 21.515 -10.116 999 HA ALA 640 HA ALA 640 -11.415 22.110 -12.367 1000 1HB ALA 640 3HB ALA 640 -12.259 21.353 -10.100 1001 2HB ALA 640 2HB ALA 640 -13.242 22.614 -10.882 1002 3HB ALA 640 1HB ALA 640 -12.128 23.045 -9.563 1003 H ALA 641 H ALA 641 -9.721 24.328 -10.119 1004 HA ALA 641 HA ALA 641 -10.831 26.707 -11.045 1005 1HB ALA 641 3HB ALA 641 -9.231 27.705 -9.706 1006 2HB ALA 641 1HB ALA 641 -9.213 26.060 -9.028 1007 3HB ALA 641 2HB ALA 641 -7.956 26.559 -10.185 1008 H ALA 642 H ALA 642 -8.364 24.528 -12.380 1009 HA ALA 642 HA ALA 642 -7.144 26.325 -14.129 1010 1HB ALA 642 3HB ALA 642 -6.709 23.773 -13.390 1011 2HB ALA 642 2HB ALA 642 -6.051 24.455 -14.897 1012 3HB ALA 642 1HB ALA 642 -7.533 23.471 -14.938 1013 H TRP 643 H TRP 643 -10.360 25.031 -14.036 1014 HA TRP 643 HA TRP 643 -10.742 25.415 -16.897 1015 1HB TRP 643 1HB TRP 643 -12.359 24.190 -14.685 1016 2HB TRP 643 2HB TRP 643 -13.134 24.685 -16.177 1017 HD1 TRP 643 HD TRP 643 -12.743 23.116 -18.314 1018 HE1 TRP 643 1HE TRP 643 -11.619 20.773 -18.775 1019 HE3 TRP 643 3HE TRP 643 -10.333 22.804 -13.848 1020 HZ2 TRP 643 2HZ TRP 643 -9.888 19.090 -17.254 1021 HZ3 TRP 643 3HZ TRP 643 -8.947 20.778 -13.415 1022 HH2 TRP 643 HH TRP 643 -8.704 18.960 -15.031 1023 H GLY 644 H GLY 644 -11.575 26.759 -13.668 1024 1HA GLY 644 2HA GLY 644 -12.976 28.991 -14.994 1025 2HA GLY 644 1HA GLY 644 -11.647 29.296 -13.894 1026 H GLY 645 H GLY 645 -11.864 27.961 -11.684 1027 1HA GLY 645 2HA GLY 645 -14.382 28.796 -10.541 1028 2HA GLY 645 1HA GLY 645 -12.990 28.134 -9.709 1029 H SER 646 H SER 646 -13.955 26.493 -8.503 1030 HA SER 646 HA SER 646 -14.571 24.145 -9.919 1031 1HB SER 646 1HB SER 646 -15.412 23.621 -7.363 1032 2HB SER 646 2HB SER 646 -13.749 23.487 -7.898 1033 HG SER 646 HG SER 646 -14.789 25.167 -6.034 1034 H GLY 647 H GLY 647 -16.664 22.882 -9.597 1035 1HA GLY 647 2HA GLY 647 -19.025 24.154 -8.720 1036 2HA GLY 647 1HA GLY 647 -18.904 22.697 -9.684 1037 H SER 648 H SER 648 -17.076 24.798 -11.444 1038 HA SER 648 HA SER 648 -19.119 26.409 -12.553 1039 1HB SER 648 1HB SER 648 -17.413 27.279 -13.978 1040 2HB SER 648 2HB SER 648 -16.618 26.947 -12.452 1041 HG SER 648 HG SER 648 -15.236 25.888 -13.724 1042 H GLU 649 H GLU 649 -20.087 26.215 -14.674 1043 HA GLU 649 HA GLU 649 -20.908 23.738 -15.368 1044 1HB GLU 649 1HB GLU 649 -22.046 25.709 -16.184 1045 2HB GLU 649 2HB GLU 649 -20.624 26.261 -17.046 1046 1HG GLU 649 1HG GLU 649 -20.760 24.373 -18.610 1047 2HG GLU 649 2HG GLU 649 -22.052 23.639 -17.682 1048 HE2 GLU 649 HE GLU 649 -22.518 25.552 -20.656 1049 H ALA 650 H ALA 650 -18.113 25.604 -16.711 1050 HA ALA 650 HA ALA 650 -17.400 23.816 -18.699 1051 1HB ALA 650 2HB ALA 650 -16.169 26.041 -17.177 1052 2HB ALA 650 3HB ALA 650 -15.011 24.883 -17.873 1053 3HB ALA 650 1HB ALA 650 -16.177 25.718 -18.927 1054 H TYR 651 H TYR 651 -15.971 24.115 -15.362 1055 HA TYR 651 HA TYR 651 -14.471 21.777 -15.535 1056 1HB TYR 651 1HB TYR 651 -14.000 23.349 -13.774 1057 2HB TYR 651 2HB TYR 651 -15.699 23.588 -13.415 1058 HD1 TYR 651 1HD TYR 651 -16.611 22.586 -11.518 1059 HD2 TYR 651 2HD TYR 651 -13.052 20.937 -13.227 1060 HE1 TYR 651 1HE TYR 651 -16.423 20.959 -9.573 1061 HE2 TYR 651 2HE TYR 651 -12.875 19.316 -11.276 1062 HH TYR 651 HH TYR 651 -14.783 19.672 -8.459 1063 H GLN 652 H GLN 652 -17.906 22.332 -14.806 1064 HA GLN 652 HA GLN 652 -18.395 19.976 -13.459 1065 1HB GLN 652 1HB GLN 652 -20.088 21.851 -15.122 1066 2HB GLN 652 2HB GLN 652 -20.788 20.358 -14.529 1067 1HG GLN 652 1HG GLN 652 -19.392 21.473 -12.310 1068 2HG GLN 652 2HG GLN 652 -20.211 22.823 -13.071 1069 1HE2 GLN 652 1HE2 GLN 652 -21.250 22.626 -10.865 1070 2HE2 GLN 652 2HE2 GLN 652 -22.705 21.694 -10.748 1071 H GLY 653 H GLY 653 -18.772 20.758 -16.991 1072 1HA GLY 653 2HA GLY 653 -18.753 19.442 -18.812 1073 2HA GLY 653 1HA GLY 653 -19.587 18.243 -17.844 1074 H VAL 654 H VAL 654 -16.436 19.381 -16.729 1075 HA VAL 654 HA VAL 654 -14.997 17.285 -18.075 1076 HB VAL 654 HB VAL 654 -14.289 19.431 -16.079 1077 1HG1 VAL 654 2HG1 VAL 654 -12.953 17.345 -15.666 1078 2HG1 VAL 654 3HG1 VAL 654 -12.345 17.467 -17.334 1079 3HG1 VAL 654 1HG1 VAL 654 -11.983 18.753 -16.158 1080 1HG2 VAL 654 2HG2 VAL 654 -14.607 19.506 -18.828 1081 2HG2 VAL 654 3HG2 VAL 654 -13.682 20.669 -17.849 1082 3HG2 VAL 654 1HG2 VAL 654 -12.850 19.304 -18.631 1083 H GLN 655 H GLN 655 -16.210 18.044 -14.765 1084 HA GLN 655 HA GLN 655 -15.003 15.957 -13.468 1085 1HB GLN 655 1HB GLN 655 -17.249 17.801 -12.988 1086 2HB GLN 655 2HB GLN 655 -17.493 16.250 -12.209 1087 1HG GLN 655 1HG GLN 655 -14.726 17.258 -11.908 1088 2HG GLN 655 2HG GLN 655 -15.920 18.343 -11.225 1089 1HE2 GLN 655 1HE2 GLN 655 -14.314 17.357 -9.461 1090 2HE2 GLN 655 2HE2 GLN 655 -15.000 16.083 -8.508 1091 H GLN 656 H GLN 656 -18.249 16.091 -15.086 1092 HA GLN 656 HA GLN 656 -18.910 13.465 -14.470 1093 1HB GLN 656 1HB GLN 656 -20.763 13.769 -15.941 1094 2HB GLN 656 2HB GLN 656 -20.447 15.355 -15.265 1095 1HG GLN 656 1HG GLN 656 -18.911 15.695 -17.383 1096 2HG GLN 656 2HG GLN 656 -19.785 14.328 -18.044 1097 1HE2 GLN 656 1HE2 GLN 656 -20.654 17.133 -16.020 1098 2HE2 GLN 656 2HE2 GLN 656 -21.964 17.709 -16.996 1099 H LYS 657 H LYS 657 -17.142 14.967 -17.210 1100 HA LYS 657 HA LYS 657 -17.098 12.658 -18.818 1101 1HB LYS 657 1HB LYS 657 -15.626 15.270 -18.745 1102 2HB LYS 657 2HB LYS 657 -15.009 13.981 -19.758 1103 1HG LYS 657 1HG LYS 657 -17.426 13.759 -20.683 1104 2HG LYS 657 2HG LYS 657 -17.761 15.280 -19.881 1105 1HD LYS 657 1HD LYS 657 -15.270 15.481 -21.392 1106 2HD LYS 657 2HD LYS 657 -16.554 14.901 -22.434 1107 1HE LYS 657 1HE LYS 657 -18.001 16.819 -21.702 1108 2HE LYS 657 2HE LYS 657 -16.700 17.403 -20.683 1109 H TRP 658 H TRP 658 -15.152 13.818 -16.073 1110 HA TRP 658 HA TRP 658 -13.006 12.016 -16.491 1111 1HB TRP 658 1HB TRP 658 -12.537 13.932 -15.233 1112 2HB TRP 658 2HB TRP 658 -13.935 13.721 -14.197 1113 HD1 TRP 658 HD TRP 658 -13.624 12.121 -12.058 1114 HE1 TRP 658 1HE TRP 658 -11.595 10.934 -10.860 1115 HE3 TRP 658 3HE TRP 658 -10.308 12.799 -15.852 1116 HZ2 TRP 658 2HZ TRP 658 -8.891 10.423 -11.616 1117 HZ3 TRP 658 3HZ TRP 658 -7.994 11.926 -15.542 1118 HH2 TRP 658 HH TRP 658 -7.267 10.772 -13.513 1119 H ASP 659 H ASP 659 -15.862 12.083 -14.235 1120 HA ASP 659 HA ASP 659 -15.364 9.573 -13.186 1121 1HB ASP 659 1HB ASP 659 -16.957 11.439 -12.357 1122 2HB ASP 659 2HB ASP 659 -18.112 10.845 -13.533 1123 HD2 ASP 659 HD ASP 659 -17.721 10.331 -10.180 1124 H ALA 660 H ALA 660 -17.128 10.766 -16.070 1125 HA ALA 660 HA ALA 660 -18.675 8.592 -16.696 1126 1HB ALA 660 1HB ALA 660 -18.891 10.624 -17.930 1127 2HB ALA 660 3HB ALA 660 -18.299 9.413 -19.092 1128 3HB ALA 660 2HB ALA 660 -17.174 10.607 -18.401 1129 H THR 661 H THR 661 -15.749 9.183 -18.697 1130 HA THR 661 HA THR 661 -15.393 6.551 -19.405 1131 HB THR 661 HB THR 661 -13.146 7.350 -20.122 1132 HG1 THR 661 1HG THR 661 -13.023 8.554 -17.935 1133 1HG2 THR 661 1HG2 THR 661 -15.417 8.377 -21.131 1134 2HG2 THR 661 2HG2 THR 661 -14.833 9.853 -20.325 1135 3HG2 THR 661 3HG2 THR 661 -13.836 9.066 -21.573 1136 H ALA 662 H ALA 662 -14.568 8.159 -16.380 1137 HA ALA 662 HA ALA 662 -12.575 6.443 -15.497 1138 1HB ALA 662 3HB ALA 662 -12.856 8.350 -14.202 1139 2HB ALA 662 2HB ALA 662 -13.682 7.140 -13.191 1140 3HB ALA 662 1HB ALA 662 -14.632 8.234 -14.225 1141 H THR 663 H THR 663 -15.846 6.362 -13.989 1142 HA THR 663 HA THR 663 -15.735 3.799 -13.098 1143 HB THR 663 HB THR 663 -17.524 5.207 -12.370 1144 HG1 THR 663 1HG THR 663 -18.151 2.957 -12.884 1145 1HG2 THR 663 3HG2 THR 663 -17.609 6.000 -15.186 1146 2HG2 THR 663 1HG2 THR 663 -19.227 5.502 -14.636 1147 3HG2 THR 663 2HG2 THR 663 -18.357 6.800 -13.783 1148 H GLU 664 H GLU 664 -16.114 4.875 -16.426 1149 HA GLU 664 HA GLU 664 -17.290 2.543 -17.388 1150 1HB GLU 664 1HB GLU 664 -17.287 4.618 -18.682 1151 2HB GLU 664 2HB GLU 664 -15.536 4.632 -18.748 1152 1HG GLU 664 1HG GLU 664 -16.917 3.694 -20.801 1153 2HG GLU 664 2HG GLU 664 -15.432 2.898 -20.318 1154 HE2 GLU 664 HE GLU 664 -16.707 0.676 -21.161 1155 H LEU 665 H LEU 665 -13.835 3.626 -17.182 1156 HA LEU 665 HA LEU 665 -12.911 1.105 -18.194 1157 1HB LEU 665 1HB LEU 665 -11.854 3.358 -18.593 1158 2HB LEU 665 2HB LEU 665 -11.326 3.336 -16.923 1159 HG LEU 665 HG LEU 665 -9.519 2.661 -18.378 1160 1HD1 LEU 665 2HD1 LEU 665 -10.213 1.399 -16.098 1161 2HD1 LEU 665 3HD1 LEU 665 -10.174 0.015 -17.216 1162 3HD1 LEU 665 1HD1 LEU 665 -8.732 1.041 -17.019 1163 1HD2 LEU 665 2HD2 LEU 665 -11.360 1.605 -20.033 1164 2HD2 LEU 665 3HD2 LEU 665 -9.631 1.185 -20.084 1165 3HD2 LEU 665 1HD2 LEU 665 -10.781 0.120 -19.241 1166 H ASN 666 H ASN 666 -13.733 2.533 -15.092 1167 HA ASN 666 HA ASN 666 -12.101 0.848 -13.555 1168 1HB ASN 666 1HB ASN 666 -13.631 3.079 -13.041 1169 2HB ASN 666 2HB ASN 666 -14.688 1.839 -12.396 1170 1HD2 ASN 666 1HD2 ASN 666 -13.219 3.930 -11.025 1171 2HD2 ASN 666 2HD2 ASN 666 -12.188 3.173 -9.858 1172 H ASN 667 H ASN 667 -15.689 0.952 -14.224 1173 HA ASN 667 HA ASN 667 -16.340 -1.360 -12.940 1174 1HB ASN 667 1HB ASN 667 -18.433 -1.158 -14.020 1175 2HB ASN 667 2HB ASN 667 -17.813 0.475 -14.163 1176 1HD2 ASN 667 1HD2 ASN 667 -17.947 1.358 -16.070 1177 2HD2 ASN 667 2HD2 ASN 667 -17.970 0.556 -17.605 1178 H ALA 668 H ALA 668 -15.196 -0.750 -16.315 1179 HA ALA 668 HA ALA 668 -15.586 -3.329 -17.306 1180 1HB ALA 668 1HB ALA 668 -15.048 -1.088 -18.500 1181 2HB ALA 668 3HB ALA 668 -14.323 -2.577 -19.151 1182 3HB ALA 668 2HB ALA 668 -13.346 -1.475 -18.151 1183 H LEU 669 H LEU 669 -12.809 -1.769 -15.604 1184 HA LEU 669 HA LEU 669 -11.063 -3.934 -15.873 1185 1HB LEU 669 1HB LEU 669 -11.182 -1.388 -14.502 1186 2HB LEU 669 2HB LEU 669 -10.451 -2.611 -13.482 1187 HG LEU 669 HG LEU 669 -9.516 -2.274 -16.322 1188 1HD1 LEU 669 3HD1 LEU 669 -9.598 -0.052 -14.919 1189 2HD1 LEU 669 1HD1 LEU 669 -8.161 -0.747 -14.131 1190 3HD1 LEU 669 2HD1 LEU 669 -8.166 -0.470 -15.889 1191 1HD2 LEU 669 2HD2 LEU 669 -8.870 -4.154 -14.571 1192 2HD2 LEU 669 3HD2 LEU 669 -7.672 -3.463 -15.691 1193 3HD2 LEU 669 1HD2 LEU 669 -7.741 -2.901 -14.003 1194 H GLN 670 H GLN 670 -13.707 -3.201 -13.586 1195 HA GLN 670 HA GLN 670 -13.001 -5.144 -11.720 1196 1HB GLN 670 1HB GLN 670 -15.463 -3.544 -12.361 1197 2HB GLN 670 2HB GLN 670 -15.665 -4.942 -11.324 1198 1HG GLN 670 1HG GLN 670 -13.376 -3.727 -10.271 1199 2HG GLN 670 2HG GLN 670 -14.351 -2.353 -10.752 1200 1HE2 GLN 670 1HE2 GLN 670 -13.606 -3.494 -8.111 1201 2HE2 GLN 670 2HE2 GLN 670 -15.086 -3.725 -7.242 1202 H ASN 671 H ASN 671 -15.328 -5.168 -14.505 1203 HA ASN 671 HA ASN 671 -16.032 -7.852 -14.064 1204 1HB ASN 671 1HB ASN 671 -17.230 -5.897 -15.432 1205 2HB ASN 671 2HB ASN 671 -16.258 -6.482 -16.768 1206 1HD2 ASN 671 1HD2 ASN 671 -17.436 -7.675 -18.047 1207 2HD2 ASN 671 2HD2 ASN 671 -18.560 -8.912 -17.594 1208 H LEU 672 H LEU 672 -13.448 -6.118 -15.741 1209 HA LEU 672 HA LEU 672 -12.770 -8.210 -17.545 1210 1HB LEU 672 1HB LEU 672 -12.234 -5.986 -18.139 1211 2HB LEU 672 2HB LEU 672 -11.410 -5.688 -16.621 1212 HG LEU 672 HG LEU 672 -9.940 -5.976 -18.651 1213 1HD1 LEU 672 2HD1 LEU 672 -9.302 -6.318 -16.172 1214 2HD1 LEU 672 3HD1 LEU 672 -9.272 -8.051 -16.575 1215 3HD1 LEU 672 1HD1 LEU 672 -8.198 -6.920 -17.432 1216 1HD2 LEU 672 3HD2 LEU 672 -11.376 -7.955 -19.484 1217 2HD2 LEU 672 1HD2 LEU 672 -9.609 -8.031 -19.688 1218 3HD2 LEU 672 2HD2 LEU 672 -10.393 -8.938 -18.372 1219 H ALA 673 H ALA 673 -11.730 -7.174 -14.261 1220 HA ALA 673 HA ALA 673 -9.699 -9.206 -14.165 1221 1HB ALA 673 1HB ALA 673 -10.139 -6.782 -12.910 1222 2HB ALA 673 2HB ALA 673 -10.572 -7.953 -11.641 1223 3HB ALA 673 3HB ALA 673 -8.959 -8.009 -12.392 1224 H ARG 674 H ARG 674 -13.122 -8.823 -13.364 1225 HA ARG 674 HA ARG 674 -13.242 -10.872 -11.488 1226 1HB ARG 674 1HB ARG 674 -15.274 -9.508 -13.290 1227 2HB ARG 674 2HB ARG 674 -15.764 -10.879 -12.314 1228 1HG ARG 674 1HG ARG 674 -14.188 -8.917 -10.769 1229 2HG ARG 674 2HG ARG 674 -15.630 -8.205 -11.465 1230 1HD ARG 674 1HD ARG 674 -17.017 -10.039 -10.467 1231 2HD ARG 674 2HD ARG 674 -15.575 -10.752 -9.773 1232 HE ARG 674 HE ARG 674 -15.843 -7.957 -9.020 1233 2HH1 ARG 674 1HH ARG 674 -17.024 -8.588 -5.815 1234 1HH2 ARG 674 2HH2 ARG 674 -16.993 -11.217 -8.243 1235 2HH2 ARG 674 1HH2 ARG 674 -17.396 -10.819 -6.606 1236 H THR 675 H THR 675 -13.092 -10.789 -15.014 1237 HA THR 675 HA THR 675 -13.832 -13.630 -15.147 1238 HB THR 675 HB THR 675 -13.412 -11.758 -17.506 1239 HG1 THR 675 1HG THR 675 -14.861 -10.665 -16.057 1240 1HG2 THR 675 2HG2 THR 675 -15.065 -14.233 -16.871 1241 2HG2 THR 675 3HG2 THR 675 -15.570 -13.122 -18.166 1242 3HG2 THR 675 1HG2 THR 675 -13.994 -13.944 -18.263 1243 H ILE 676 H ILE 676 -11.134 -11.569 -14.891 1244 HA ILE 676 HA ILE 676 -9.456 -13.428 -16.398 1245 HB ILE 676 HB ILE 676 -9.162 -10.602 -15.458 1246 1HG1 ILE 676 1HG1 ILE 676 -8.866 -12.052 -18.096 1247 2HG1 ILE 676 2HG1 ILE 676 -10.067 -10.855 -17.651 1248 1HG2 ILE 676 2HG2 ILE 676 -7.041 -12.606 -15.493 1249 2HG2 ILE 676 3HG2 ILE 676 -6.704 -11.227 -16.567 1250 3HG2 ILE 676 1HG2 ILE 676 -7.049 -10.949 -14.843 1251 1HD1 ILE 676 3HD1 ILE 676 -7.889 -9.348 -17.187 1252 2HD1 ILE 676 1HD1 ILE 676 -7.171 -10.473 -18.364 1253 3HD1 ILE 676 2HD1 ILE 676 -8.589 -9.497 -18.817 1254 H SER 677 H SER 677 -9.708 -11.804 -13.163 1255 HA SER 677 HA SER 677 -7.656 -12.995 -11.923 1256 1HB SER 677 1HB SER 677 -8.976 -11.348 -10.771 1257 2HB SER 677 2HB SER 677 -10.436 -12.307 -10.906 1258 HG SER 677 HG SER 677 -8.151 -13.330 -9.486 1259 H GLU 678 H GLU 678 -10.702 -14.457 -12.987 1260 HA GLU 678 HA GLU 678 -10.687 -16.672 -11.330 1261 1HB GLU 678 1HB GLU 678 -12.171 -17.688 -13.074 1262 2HB GLU 678 2HB GLU 678 -12.656 -16.065 -12.626 1263 1HG GLU 678 1HG GLU 678 -11.160 -15.296 -14.650 1264 2HG GLU 678 2HG GLU 678 -11.245 -16.971 -15.158 1265 HE2 GLU 678 HE GLU 678 -12.321 -15.756 -16.872 1266 H ALA 679 H ALA 679 -8.649 -15.772 -14.019 1267 HA ALA 679 HA ALA 679 -7.951 -18.080 -15.219 1268 1HB ALA 679 3HB ALA 679 -6.084 -15.887 -14.225 1269 2HB ALA 679 1HB ALA 679 -5.732 -17.044 -15.531 1270 3HB ALA 679 2HB ALA 679 -7.032 -15.845 -15.731 1271 H GLY 680 H GLY 680 -6.502 -16.825 -12.125 1272 1HA GLY 680 2HA GLY 680 -4.986 -17.985 -10.795 1273 2HA GLY 680 1HA GLY 680 -5.356 -19.476 -11.638 1274 H GLN 681 H GLN 681 -8.257 -17.773 -11.025 1275 HA GLN 681 HA GLN 681 -8.554 -18.857 -8.373 1276 1HB GLN 681 1HB GLN 681 -9.545 -16.578 -9.700 1277 2HB GLN 681 2HB GLN 681 -10.947 -17.618 -9.540 1278 1HG GLN 681 1HG GLN 681 -11.055 -16.604 -7.466 1279 2HG GLN 681 2HG GLN 681 -9.985 -17.924 -7.039 1280 1HE2 GLN 681 1HE2 GLN 681 -8.482 -17.241 -5.727 1281 2HE2 GLN 681 2HE2 GLN 681 -7.548 -15.788 -5.862 1282 H ALA 682 H ALA 682 -10.659 -18.826 -11.347 1283 HA ALA 682 HA ALA 682 -11.654 -21.447 -10.540 1284 1HB ALA 682 2HB ALA 682 -12.960 -20.483 -12.873 1285 2HB ALA 682 1HB ALA 682 -12.747 -19.083 -11.794 1286 3HB ALA 682 3HB ALA 682 -13.594 -20.536 -11.210 1287 H MET 683 H MET 683 -10.677 -19.791 -13.633 1288 HA MET 683 HA MET 683 -10.447 -21.888 -15.223 1289 1HB MET 683 1HB MET 683 -9.597 -19.248 -15.255 1290 2HB MET 683 2HB MET 683 -8.053 -20.076 -15.278 1291 1HG MET 683 1HG MET 683 -9.367 -21.549 -17.169 1292 2HG MET 683 2HG MET 683 -10.215 -20.027 -17.359 1293 1HE MET 683 1HE MET 683 -7.012 -22.007 -17.634 1294 2HE MET 683 2HE MET 683 -5.751 -20.826 -18.064 1295 3HE MET 683 3HE MET 683 -6.396 -20.876 -16.406 1296 H ALA 684 H ALA 684 -8.385 -21.191 -12.436 1297 HA ALA 684 HA ALA 684 -6.461 -23.217 -13.252 1298 1HB ALA 684 3HB ALA 684 -5.431 -22.443 -10.992 1299 2HB ALA 684 1HB ALA 684 -5.407 -21.308 -12.363 1300 3HB ALA 684 2HB ALA 684 -6.621 -21.122 -11.074 1301 H SER 685 H SER 685 -8.942 -22.513 -10.725 1302 HA SER 685 HA SER 685 -8.459 -24.878 -9.317 1303 1HB SER 685 1HB SER 685 -10.782 -22.925 -9.423 1304 2HB SER 685 2HB SER 685 -10.859 -24.361 -8.422 1305 HG SER 685 HG SER 685 -9.127 -23.636 -7.176 1306 H THR 686 H THR 686 -11.742 -24.211 -10.593 1307 HA THR 686 HA THR 686 -11.710 -26.194 -12.604 1308 HB THR 686 HB THR 686 -11.600 -27.393 -10.178 1309 HG1 THR 686 1HG THR 686 -13.534 -28.089 -12.266 1310 1HG2 THR 686 3HG2 THR 686 -13.875 -26.177 -9.606 1311 2HG2 THR 686 1HG2 THR 686 -14.588 -27.341 -10.749 1312 3HG2 THR 686 2HG2 THR 686 -13.747 -27.925 -9.293 1313 H GLU 687 H GLU 687 -13.653 -26.256 -13.794 1314 HA GLU 687 HA GLU 687 -15.118 -23.872 -13.543 1315 1HB GLU 687 1HB GLU 687 -14.587 -25.061 -15.707 1316 2HB GLU 687 2HB GLU 687 -15.727 -26.315 -15.264 1317 1HG GLU 687 1HG GLU 687 -17.256 -25.024 -16.372 1318 2HG GLU 687 2HG GLU 687 -17.291 -24.082 -14.895 1319 HE2 GLU 687 HE GLU 687 -16.846 -23.881 -18.062 1320 H GLY 688 H GLY 688 -17.173 -23.480 -12.699 1321 1HA GLY 688 2HA GLY 688 -18.721 -25.785 -11.740 1322 2HA GLY 688 1HA GLY 688 -19.308 -24.155 -12.004 1323 H ASN 689 H ASN 689 -16.426 -23.474 -10.638 1324 HA ASN 689 HA ASN 689 -17.206 -24.085 -7.929 1325 1HB ASN 689 1HB ASN 689 -14.792 -24.314 -8.877 1326 2HB ASN 689 2HB ASN 689 -14.724 -22.563 -8.860 1327 1HD2 ASN 689 1HD2 ASN 689 -13.080 -22.539 -7.356 1328 2HD2 ASN 689 2HD2 ASN 689 -13.316 -22.887 -5.676 1329 H VAL 690 H VAL 690 -15.879 -21.212 -9.758 1330 HA VAL 690 HA VAL 690 -17.401 -19.476 -7.962 1331 HB VAL 690 HB VAL 690 -15.899 -17.735 -8.663 1332 1HG1 VAL 690 3HG1 VAL 690 -14.531 -20.334 -7.918 1333 2HG1 VAL 690 1HG1 VAL 690 -13.691 -18.765 -7.950 1334 3HG1 VAL 690 2HG1 VAL 690 -15.060 -19.019 -6.841 1335 1HG2 VAL 690 2HG2 VAL 690 -15.301 -19.611 -10.859 1336 2HG2 VAL 690 3HG2 VAL 690 -15.206 -17.834 -10.804 1337 3HG2 VAL 690 1HG2 VAL 690 -13.870 -18.817 -10.157 1338 H THR 691 H THR 691 -19.451 -19.185 -8.721 1339 HA THR 691 HA THR 691 -19.712 -18.640 -11.605 1340 HB THR 691 HB THR 691 -21.874 -19.681 -11.468 1341 HG1 THR 691 1HG THR 691 -22.953 -19.545 -9.517 1342 1HG2 THR 691 2HG2 THR 691 -19.825 -21.279 -10.972 1343 2HG2 THR 691 3HG2 THR 691 -20.438 -21.260 -9.301 1344 3HG2 THR 691 1HG2 THR 691 -21.468 -21.867 -10.620 1345 H GLY 692 H GLY 692 -19.758 -17.272 -8.460 1346 1HA GLY 692 2HA GLY 692 -20.637 -15.355 -7.624 1347 2HA GLY 692 1HA GLY 692 -21.767 -15.281 -8.962 1348 H MET 693 H MET 693 -18.276 -15.673 -9.539 1349 HA MET 693 HA MET 693 -17.825 -12.889 -9.824 1350 1HB MET 693 1HB MET 693 -16.306 -15.459 -10.083 1351 2HB MET 693 2HB MET 693 -15.718 -14.171 -11.116 1352 1HG MET 693 1HG MET 693 -16.192 -12.954 -8.581 1353 2HG MET 693 2HG MET 693 -15.417 -14.485 -8.227 1354 1HE MET 693 3HE MET 693 -13.200 -14.924 -8.264 1355 2HE MET 693 1HE MET 693 -11.888 -13.803 -8.700 1356 3HE MET 693 2HE MET 693 -13.007 -13.393 -7.378 1357 H PHE 694 H PHE 694 -17.665 -15.656 -12.192 1358 HA PHE 694 HA PHE 694 -18.516 -13.731 -14.241 1359 1HB PHE 694 1HB PHE 694 -17.021 -14.924 -15.747 1360 2HB PHE 694 2HB PHE 694 -16.102 -14.713 -14.270 1361 HD1 PHE 694 1HD PHE 694 -17.941 -17.136 -16.330 1362 HD2 PHE 694 2HD PHE 694 -15.486 -16.596 -12.911 1363 HE1 PHE 694 1HE PHE 694 -17.564 -19.615 -16.209 1364 HE2 PHE 694 2HE PHE 694 -15.109 -19.075 -12.790 1365 HZ PHE 694 HZ PHE 694 -16.153 -20.555 -14.441 1366 H ALA 695 H ALA 695 -20.257 -14.285 -15.526 1367 HA ALA 695 HA ALA 695 -21.817 -16.515 -14.664 1368 1HB ALA 695 3HB ALA 695 -23.503 -15.566 -15.991 1369 2HB ALA 695 1HB ALA 695 -22.542 -14.148 -15.508 1370 3HB ALA 695 2HB ALA 695 -22.340 -14.849 -17.131 No H/Q in entry = 1370 Start of MODEL 23 1 H ALA 1 H ALA 1 -9.150 31.477 -3.112 2 HA ALA 1 HA ALA 1 -9.703 33.362 -4.220 3 1HB ALA 1 2HB ALA 1 -9.461 35.317 -2.723 4 2HB ALA 1 1HB ALA 1 -8.242 34.434 -1.771 5 3HB ALA 1 3HB ALA 1 -9.925 33.857 -1.816 6 H GLU 2 H GLU 2 -6.441 34.204 -2.842 7 HA GLU 2 HA GLU 2 -5.806 35.854 -4.970 8 1HB GLU 2 1HB GLU 2 -4.423 34.691 -2.621 9 2HB GLU 2 2HB GLU 2 -3.350 35.044 -3.961 10 1HG GLU 2 1HG GLU 2 -5.371 37.156 -3.270 11 2HG GLU 2 2HG GLU 2 -4.075 36.908 -2.117 12 HE2 GLU 2 HE GLU 2 -3.156 38.132 -5.838 13 H MET 3 H MET 3 -4.492 32.546 -4.186 14 HA MET 3 HA MET 3 -3.917 32.301 -7.035 15 1HB MET 3 1HB MET 3 -2.175 30.667 -6.335 16 2HB MET 3 2HB MET 3 -1.946 32.177 -5.476 17 1HG MET 3 1HG MET 3 -3.691 30.805 -3.786 18 2HG MET 3 2HG MET 3 -2.700 29.508 -4.421 19 1HE MET 3 2HE MET 3 -2.726 30.150 -1.415 20 2HE MET 3 3HE MET 3 -1.574 31.364 -0.810 21 3HE MET 3 1HE MET 3 -3.052 31.883 -1.656 22 H LYS 4 H LYS 4 -6.321 31.743 -7.191 23 HA LYS 4 HA LYS 4 -6.973 29.125 -6.124 24 1HB LYS 4 1HB LYS 4 -9.229 29.613 -6.905 25 2HB LYS 4 2HB LYS 4 -8.615 30.920 -5.913 26 1HG LYS 4 1HG LYS 4 -7.789 31.732 -8.425 27 2HG LYS 4 2HG LYS 4 -9.280 30.898 -8.817 28 1HD LYS 4 1HD LYS 4 -9.693 32.540 -6.450 29 2HD LYS 4 2HD LYS 4 -8.983 33.521 -7.717 30 1HE LYS 4 1HE LYS 4 -10.757 32.720 -9.310 31 2HE LYS 4 2HE LYS 4 -11.477 31.779 -8.020 32 H THR 5 H THR 5 -6.320 30.806 -9.229 33 HA THR 5 HA THR 5 -6.273 28.147 -10.502 34 HB THR 5 HB THR 5 -7.079 29.269 -12.538 35 HG1 THR 5 1HG THR 5 -7.273 31.592 -12.449 36 1HG2 THR 5 1HG2 THR 5 -8.581 29.467 -10.007 37 2HG2 THR 5 2HG2 THR 5 -9.018 30.768 -11.141 38 3HG2 THR 5 3HG2 THR 5 -9.177 29.066 -11.636 39 H ASP 6 H ASP 6 -4.427 30.729 -9.349 40 HA ASP 6 HA ASP 6 -2.655 31.410 -11.162 41 1HB ASP 6 1HB ASP 6 -2.599 30.910 -8.279 42 2HB ASP 6 2HB ASP 6 -1.031 30.566 -8.981 43 HD2 ASP 6 HD ASP 6 -0.185 32.333 -7.932 44 H ALA 7 H ALA 7 -0.962 30.435 -12.374 45 HA ALA 7 HA ALA 7 -1.029 27.726 -12.867 46 1HB ALA 7 2HB ALA 7 -0.057 29.109 -14.504 47 2HB ALA 7 3HB ALA 7 1.005 29.918 -13.326 48 3HB ALA 7 1HB ALA 7 1.340 28.242 -13.821 49 H ALA 8 H ALA 8 0.358 29.492 -10.193 50 HA ALA 8 HA ALA 8 2.356 27.574 -9.541 51 1HB ALA 8 2HB ALA 8 2.872 29.590 -8.586 52 2HB ALA 8 1HB ALA 8 1.931 28.919 -7.233 53 3HB ALA 8 3HB ALA 8 1.165 30.049 -8.375 54 H THR 9 H THR 9 -1.027 28.265 -8.465 55 HA THR 9 HA THR 9 -1.036 26.142 -6.566 56 HB THR 9 HB THR 9 -2.454 28.286 -6.574 57 HG1 THR 9 1HG THR 9 -3.567 26.906 -5.253 58 1HG2 THR 9 3HG2 THR 9 -3.647 26.782 -8.913 59 2HG2 THR 9 1HG2 THR 9 -4.751 27.634 -7.807 60 3HG2 THR 9 2HG2 THR 9 -3.486 28.538 -8.673 61 H LEU 10 H LEU 10 -1.703 26.413 -10.037 62 HA LEU 10 HA LEU 10 -3.088 23.923 -10.155 63 1HB LEU 10 1HB LEU 10 -2.013 25.896 -12.136 64 2HB LEU 10 2HB LEU 10 -2.502 24.302 -12.675 65 HG LEU 10 HG LEU 10 -4.224 26.418 -11.368 66 1HD1 LEU 10 2HD1 LEU 10 -3.673 26.557 -13.834 67 2HD1 LEU 10 3HD1 LEU 10 -4.593 25.047 -14.037 68 3HD1 LEU 10 1HD1 LEU 10 -5.403 26.506 -13.419 69 1HD2 LEU 10 3HD2 LEU 10 -4.700 23.479 -11.689 70 2HD2 LEU 10 1HD2 LEU 10 -5.149 24.576 -10.361 71 3HD2 LEU 10 2HD2 LEU 10 -6.061 24.609 -11.890 72 H ALA 11 H ALA 11 0.210 25.039 -11.206 73 HA ALA 11 HA ALA 11 1.156 22.573 -11.973 74 1HB ALA 11 2HB ALA 11 2.498 25.031 -10.801 75 2HB ALA 11 3HB ALA 11 3.417 23.629 -11.396 76 3HB ALA 11 1HB ALA 11 2.379 24.550 -12.510 77 H GLN 12 H GLN 12 0.525 23.887 -8.757 78 HA GLN 12 HA GLN 12 2.231 22.144 -7.381 79 1HB GLN 12 1HB GLN 12 0.637 24.335 -6.737 80 2HB GLN 12 2HB GLN 12 -0.192 23.020 -5.928 81 1HG GLN 12 1HG GLN 12 1.469 22.770 -4.380 82 2HG GLN 12 2HG GLN 12 2.734 22.854 -5.590 83 1HE2 GLN 12 1HE2 GLN 12 0.993 24.484 -3.163 84 2HE2 GLN 12 2HE2 GLN 12 1.722 26.051 -3.288 85 H GLU 13 H GLU 13 -1.168 21.967 -8.510 86 HA GLU 13 HA GLU 13 -1.394 19.365 -7.255 87 1HB GLU 13 1HB GLU 13 -3.511 21.018 -8.701 88 2HB GLU 13 2HB GLU 13 -3.801 19.541 -7.804 89 1HG GLU 13 1HG GLU 13 -2.977 22.261 -6.737 90 2HG GLU 13 2HG GLU 13 -4.357 21.284 -6.275 91 HE2 GLU 13 HE GLU 13 -2.378 22.182 -4.394 92 H ALA 14 H ALA 14 -1.731 21.009 -10.467 93 HA ALA 14 HA ALA 14 -2.346 18.815 -11.994 94 1HB ALA 14 2HB ALA 14 -1.735 21.502 -12.387 95 2HB ALA 14 3HB ALA 14 -0.440 20.654 -13.266 96 3HB ALA 14 1HB ALA 14 -2.145 20.327 -13.660 97 H GLY 15 H GLY 15 0.942 20.118 -11.157 98 1HA GLY 15 2HA GLY 15 2.916 19.056 -10.940 99 2HA GLY 15 1HA GLY 15 2.520 18.333 -12.486 100 H ASN 16 H ASN 16 0.532 17.797 -9.566 101 HA ASN 16 HA ASN 16 1.847 15.322 -9.020 102 1HB ASN 16 1HB ASN 16 1.056 16.316 -7.032 103 2HB ASN 16 2HB ASN 16 -0.395 16.936 -7.795 104 1HD2 ASN 16 1HD2 ASN 16 -2.100 16.082 -6.894 105 2HD2 ASN 16 2HD2 ASN 16 -2.355 14.417 -6.492 106 H PHE 17 H PHE 17 -1.130 16.599 -10.555 107 HA PHE 17 HA PHE 17 -2.568 14.212 -10.682 108 1HB PHE 17 1HB PHE 17 -3.519 16.468 -11.097 109 2HB PHE 17 2HB PHE 17 -2.391 16.748 -12.408 110 HD1 PHE 17 1HD PHE 17 -3.031 16.294 -14.597 111 HD2 PHE 17 2HD PHE 17 -5.188 14.500 -11.413 112 HE1 PHE 17 1HE PHE 17 -4.716 15.411 -16.235 113 HE2 PHE 17 2HE PHE 17 -6.873 13.617 -13.051 114 HZ PHE 17 HZ PHE 17 -6.617 14.084 -15.442 115 H GLU 18 H GLU 18 -0.453 15.837 -13.155 116 HA GLU 18 HA GLU 18 -0.700 14.222 -15.216 117 1HB GLU 18 1HB GLU 18 1.727 15.546 -14.011 118 2HB GLU 18 2HB GLU 18 1.951 14.505 -15.403 119 1HG GLU 18 1HG GLU 18 -0.330 16.186 -15.936 120 2HG GLU 18 2HG GLU 18 0.954 17.215 -15.335 121 HE2 GLU 18 HE GLU 18 2.042 17.951 -16.960 122 H ARG 19 H ARG 19 0.757 13.359 -12.099 123 HA ARG 19 HA ARG 19 2.025 11.043 -13.050 124 1HB ARG 19 1HB ARG 19 2.205 12.483 -10.749 125 2HB ARG 19 2HB ARG 19 1.123 11.227 -10.181 126 1HG ARG 19 1HG ARG 19 2.768 9.641 -10.182 127 2HG ARG 19 2HG ARG 19 3.365 10.131 -11.756 128 1HD ARG 19 1HD ARG 19 5.075 11.298 -10.816 129 2HD ARG 19 2HD ARG 19 3.967 12.219 -9.818 130 HE ARG 19 HE ARG 19 4.469 9.467 -8.883 131 2HH1 ARG 19 1HH ARG 19 6.200 10.521 -6.063 132 1HH2 ARG 19 2HH2 ARG 19 5.421 12.872 -8.646 133 2HH2 ARG 19 1HH2 ARG 19 6.182 12.680 -7.102 134 H ILE 20 H ILE 20 -1.114 11.755 -11.391 135 HA ILE 20 HA ILE 20 -1.915 9.076 -11.154 136 HB ILE 20 HB ILE 20 -3.596 11.581 -11.299 137 1HG1 ILE 20 1HG1 ILE 20 -2.723 10.292 -8.734 138 2HG1 ILE 20 2HG1 ILE 20 -1.613 11.359 -9.571 139 1HG2 ILE 20 3HG2 ILE 20 -4.827 9.434 -11.583 140 2HG2 ILE 20 1HG2 ILE 20 -4.217 8.921 -9.991 141 3HG2 ILE 20 2HG2 ILE 20 -5.281 10.342 -10.121 142 1HD1 ILE 20 3HD1 ILE 20 -3.878 12.879 -9.704 143 2HD1 ILE 20 1HD1 ILE 20 -4.183 11.994 -8.190 144 3HD1 ILE 20 2HD1 ILE 20 -2.711 12.979 -8.364 145 H SER 21 H SER 21 -2.446 11.599 -13.682 146 HA SER 21 HA SER 21 -4.175 10.077 -15.210 147 1HB SER 21 1HB SER 21 -2.568 12.537 -15.527 148 2HB SER 21 2HB SER 21 -2.801 11.681 -17.037 149 HG SER 21 HG SER 21 -4.986 12.270 -15.238 150 H GLY 22 H GLY 22 -0.590 10.624 -15.531 151 1HA GLY 22 2HA GLY 22 1.030 9.367 -16.448 152 2HA GLY 22 1HA GLY 22 -0.127 8.969 -17.703 153 H ASP 23 H ASP 23 0.089 8.189 -14.153 154 HA ASP 23 HA ASP 23 0.834 5.583 -14.477 155 1HB ASP 23 1HB ASP 23 0.495 7.140 -12.343 156 2HB ASP 23 2HB ASP 23 -1.091 6.398 -12.284 157 HD2 ASP 23 HD ASP 23 -0.500 4.082 -10.610 158 H LEU 24 H LEU 24 -2.431 7.139 -14.309 159 HA LEU 24 HA LEU 24 -4.012 4.904 -14.175 160 1HB LEU 24 1HB LEU 24 -4.282 7.700 -14.882 161 2HB LEU 24 2HB LEU 24 -5.332 6.700 -15.865 162 HG LEU 24 HG LEU 24 -5.273 6.850 -12.841 163 1HD1 LEU 24 2HD1 LEU 24 -6.474 8.557 -14.587 164 2HD1 LEU 24 3HD1 LEU 24 -7.770 7.367 -14.320 165 3HD1 LEU 24 1HD1 LEU 24 -7.047 8.222 -12.936 166 1HD2 LEU 24 3HD2 LEU 24 -5.988 4.629 -14.419 167 2HD2 LEU 24 1HD2 LEU 24 -6.292 4.887 -12.684 168 3HD2 LEU 24 2HD2 LEU 24 -7.514 5.372 -13.884 169 H LYS 25 H LYS 25 -2.524 6.473 -17.069 170 HA LYS 25 HA LYS 25 -3.704 4.633 -18.874 171 1HB LYS 25 1HB LYS 25 -3.173 6.495 -20.033 172 2HB LYS 25 2HB LYS 25 -1.841 6.917 -18.976 173 1HG LYS 25 1HG LYS 25 -0.297 5.595 -20.146 174 2HG LYS 25 2HG LYS 25 -1.520 4.479 -20.720 175 1HD LYS 25 1HD LYS 25 -0.802 5.796 -22.623 176 2HD LYS 25 2HD LYS 25 -2.424 6.317 -22.216 177 1HE LYS 25 1HE LYS 25 -1.513 8.421 -22.271 178 2HE LYS 25 2HE LYS 25 -0.974 8.039 -20.648 179 H THR 26 H THR 26 -0.765 4.715 -16.878 180 HA THR 26 HA THR 26 0.633 2.691 -18.253 181 HB THR 26 HB THR 26 0.695 3.853 -15.430 182 HG1 THR 26 1HG THR 26 1.757 5.258 -16.788 183 1HG2 THR 26 1HG2 THR 26 1.923 1.384 -16.366 184 2HG2 THR 26 2HG2 THR 26 3.182 2.622 -16.141 185 3HG2 THR 26 3HG2 THR 26 2.113 2.183 -14.787 186 H GLN 27 H GLN 27 -1.390 2.532 -15.243 187 HA GLN 27 HA GLN 27 -1.191 -0.178 -14.953 188 1HB GLN 27 1HB GLN 27 -3.427 1.749 -14.205 189 2HB GLN 27 2HB GLN 27 -3.414 0.073 -13.694 190 1HG GLN 27 1HG GLN 27 -2.247 2.124 -12.281 191 2HG GLN 27 2HG GLN 27 -1.801 0.438 -12.114 192 1HE2 GLN 27 1HE2 GLN 27 -0.017 -0.391 -13.279 193 2HE2 GLN 27 2HE2 GLN 27 1.278 0.629 -13.810 194 H ILE 28 H ILE 28 -3.671 1.765 -16.748 195 HA ILE 28 HA ILE 28 -5.307 -0.307 -17.510 196 HB ILE 28 HB ILE 28 -4.726 2.433 -18.398 197 1HG1 ILE 28 1HG1 ILE 28 -7.405 1.062 -18.292 198 2HG1 ILE 28 2HG1 ILE 28 -6.568 1.486 -16.812 199 1HG2 ILE 28 1HG2 ILE 28 -5.597 0.329 -20.334 200 2HG2 ILE 28 2HG2 ILE 28 -6.362 1.934 -20.413 201 3HG2 ILE 28 3HG2 ILE 28 -4.597 1.780 -20.585 202 1HD1 ILE 28 2HD1 ILE 28 -6.290 3.832 -18.213 203 2HD1 ILE 28 3HD1 ILE 28 -7.852 3.251 -18.837 204 3HD1 ILE 28 1HD1 ILE 28 -7.629 3.499 -17.088 205 H ASP 29 H ASP 29 -2.311 0.954 -19.098 206 HA ASP 29 HA ASP 29 -2.430 -0.653 -21.309 207 1HB ASP 29 1HB ASP 29 -0.562 1.112 -20.059 208 2HB ASP 29 2HB ASP 29 0.313 -0.378 -20.352 209 HD2 ASP 29 HD ASP 29 1.076 -0.620 -22.258 210 H GLN 30 H GLN 30 -1.111 -1.199 -17.992 211 HA GLN 30 HA GLN 30 0.227 -3.542 -18.468 212 1HB GLN 30 1HB GLN 30 -1.270 -2.658 -15.961 213 2HB GLN 30 2HB GLN 30 -0.102 -3.964 -16.009 214 1HG GLN 30 1HG GLN 30 0.347 -1.000 -16.223 215 2HG GLN 30 2HG GLN 30 1.282 -2.204 -15.359 216 1HE2 GLN 30 1HE2 GLN 30 1.470 -0.094 -17.756 217 2HE2 GLN 30 2HE2 GLN 30 2.575 -0.859 -18.848 218 H VAL 31 H VAL 31 -3.224 -3.009 -17.487 219 HA VAL 31 HA VAL 31 -3.872 -5.737 -17.381 220 HB VAL 31 HB VAL 31 -5.432 -3.179 -17.660 221 1HG1 VAL 31 3HG1 VAL 31 -6.496 -6.015 -17.660 222 2HG1 VAL 31 1HG1 VAL 31 -7.479 -4.610 -17.181 223 3HG1 VAL 31 2HG1 VAL 31 -6.818 -4.713 -18.831 224 1HG2 VAL 31 2HG2 VAL 31 -4.255 -4.462 -15.491 225 2HG2 VAL 31 3HG2 VAL 31 -5.510 -3.202 -15.422 226 3HG2 VAL 31 1HG2 VAL 31 -5.971 -4.920 -15.377 227 H GLU 32 H GLU 32 -4.507 -3.229 -19.939 228 HA GLU 32 HA GLU 32 -5.673 -4.835 -21.756 229 1HB GLU 32 1HB GLU 32 -4.028 -2.348 -21.879 230 2HB GLU 32 2HB GLU 32 -4.203 -3.206 -23.397 231 1HG GLU 32 1HG GLU 32 -6.779 -3.305 -22.693 232 2HG GLU 32 2HG GLU 32 -6.346 -1.948 -21.672 233 HE2 GLU 32 HE GLU 32 -7.726 -0.543 -23.927 234 H SER 33 H SER 33 -2.184 -4.532 -20.987 235 HA SER 33 HA SER 33 -1.412 -6.139 -23.190 236 1HB SER 33 1HB SER 33 0.388 -4.841 -22.617 237 2HB SER 33 2HB SER 33 -0.095 -4.724 -20.936 238 HG SER 33 HG SER 33 0.984 -7.156 -22.064 239 H THR 34 H THR 34 -1.471 -6.591 -19.576 240 HA THR 34 HA THR 34 -0.712 -9.254 -19.551 241 HB THR 34 HB THR 34 -2.110 -7.299 -17.758 242 HG1 THR 34 1HG THR 34 -0.322 -8.211 -16.444 243 1HG2 THR 34 3HG2 THR 34 -3.471 -9.487 -17.564 244 2HG2 THR 34 1HG2 THR 34 -1.956 -10.271 -17.056 245 3HG2 THR 34 2HG2 THR 34 -2.653 -8.960 -16.074 246 H ALA 35 H ALA 35 -3.977 -7.800 -19.984 247 HA ALA 35 HA ALA 35 -5.467 -10.097 -19.802 248 1HB ALA 35 3HB ALA 35 -6.020 -7.973 -21.880 249 2HB ALA 35 1HB ALA 35 -7.163 -8.844 -20.830 250 3HB ALA 35 2HB ALA 35 -6.107 -7.586 -20.145 251 H GLY 36 H GLY 36 -3.202 -9.038 -22.304 252 1HA GLY 36 2HA GLY 36 -2.409 -10.078 -24.131 253 2HA GLY 36 1HA GLY 36 -4.075 -10.477 -24.500 254 H SER 37 H SER 37 -2.295 -11.548 -21.563 255 HA SER 37 HA SER 37 -1.819 -14.118 -22.712 256 1HB SER 37 1HB SER 37 -1.052 -12.647 -20.249 257 2HB SER 37 2HB SER 37 -1.282 -14.367 -20.004 258 HG SER 37 HG SER 37 0.111 -14.231 -22.254 259 H LEU 38 H LEU 38 -4.468 -12.529 -21.286 260 HA LEU 38 HA LEU 38 -5.499 -14.931 -20.007 261 1HB LEU 38 1HB LEU 38 -6.190 -12.025 -19.983 262 2HB LEU 38 2HB LEU 38 -7.439 -13.193 -19.601 263 HG LEU 38 HG LEU 38 -6.719 -12.963 -17.495 264 1HD1 LEU 38 3HD1 LEU 38 -5.972 -15.244 -18.091 265 2HD1 LEU 38 1HD1 LEU 38 -4.349 -14.600 -18.436 266 3HD1 LEU 38 2HD1 LEU 38 -5.007 -14.516 -16.785 267 1HD2 LEU 38 3HD2 LEU 38 -5.376 -10.997 -18.059 268 2HD2 LEU 38 1HD2 LEU 38 -4.579 -11.996 -16.820 269 3HD2 LEU 38 2HD2 LEU 38 -4.012 -12.049 -18.507 270 H GLN 39 H GLN 39 -6.665 -12.460 -22.411 271 HA GLN 39 HA GLN 39 -8.805 -13.863 -23.288 272 1HB GLN 39 1HB GLN 39 -8.322 -12.594 -25.529 273 2HB GLN 39 2HB GLN 39 -8.653 -11.663 -24.082 274 1HG GLN 39 1HG GLN 39 -5.839 -12.179 -24.068 275 2HG GLN 39 2HG GLN 39 -6.239 -11.709 -25.708 276 1HE2 GLN 39 1HE2 GLN 39 -7.705 -10.790 -22.605 277 2HE2 GLN 39 2HE2 GLN 39 -7.427 -9.084 -22.722 278 H GLY 40 H GLY 40 -5.362 -14.360 -24.007 279 1HA GLY 40 2HA GLY 40 -4.330 -15.739 -25.510 280 2HA GLY 40 1HA GLY 40 -5.877 -16.160 -26.216 281 H GLN 41 H GLN 41 -6.224 -16.386 -22.856 282 HA GLN 41 HA GLN 41 -5.769 -19.253 -23.033 283 1HB GLN 41 1HB GLN 41 -4.618 -17.312 -21.067 284 2HB GLN 41 2HB GLN 41 -5.200 -18.826 -20.403 285 1HG GLN 41 1HG GLN 41 -3.343 -19.889 -21.146 286 2HG GLN 41 2HG GLN 41 -3.741 -19.463 -22.798 287 1HE2 GLN 41 1HE2 GLN 41 -3.367 -17.016 -23.258 288 2HE2 GLN 41 2HE2 GLN 41 -1.816 -16.395 -22.800 289 H TRP 42 H TRP 42 -7.924 -19.877 -23.146 290 HA TRP 42 HA TRP 42 -9.453 -19.607 -20.752 291 1HB TRP 42 1HB TRP 42 -10.399 -18.168 -23.236 292 2HB TRP 42 2HB TRP 42 -11.416 -18.549 -21.860 293 HD1 TRP 42 HD TRP 42 -9.506 -15.725 -23.122 294 HE1 TRP 42 1HE TRP 42 -8.887 -13.918 -21.302 295 HE3 TRP 42 3HE TRP 42 -10.506 -18.671 -19.100 296 HZ2 TRP 42 2HZ TRP 42 -8.885 -13.923 -18.448 297 HZ3 TRP 42 3HZ TRP 42 -10.169 -17.693 -16.832 298 HH2 TRP 42 HH TRP 42 -9.388 -15.405 -16.470 299 H ARG 43 H ARG 43 -11.464 -20.977 -20.941 300 HA ARG 43 HA ARG 43 -11.275 -22.778 -23.212 301 1HB ARG 43 1HB ARG 43 -11.459 -23.500 -20.254 302 2HB ARG 43 2HB ARG 43 -11.922 -24.638 -21.503 303 1HG ARG 43 1HG ARG 43 -9.212 -23.266 -21.592 304 2HG ARG 43 2HG ARG 43 -9.457 -24.689 -20.599 305 1HD ARG 43 1HD ARG 43 -10.249 -24.676 -23.539 306 2HD ARG 43 2HD ARG 43 -8.604 -25.029 -23.049 307 HE ARG 43 HE ARG 43 -10.562 -26.604 -21.562 308 2HH1 ARG 43 1HH ARG 43 -9.946 -29.552 -23.292 309 1HH2 ARG 43 2HH2 ARG 43 -8.718 -26.449 -24.584 310 2HH2 ARG 43 1HH2 ARG 43 -8.796 -28.156 -24.864 311 H GLY 44 H GLY 44 -13.079 -20.957 -23.617 312 1HA GLY 44 2HA GLY 44 -15.605 -22.245 -23.343 313 2HA GLY 44 1HA GLY 44 -15.276 -20.674 -24.047 314 H ALA 45 H ALA 45 -17.132 -19.719 -23.014 315 HA ALA 45 HA ALA 45 -18.213 -18.640 -21.414 316 1HB ALA 45 2HB ALA 45 -18.708 -20.647 -20.293 317 2HB ALA 45 3HB ALA 45 -17.013 -20.911 -19.817 318 3HB ALA 45 1HB ALA 45 -17.974 -19.642 -19.021 319 H ALA 46 H ALA 46 -15.336 -19.574 -19.427 320 HA ALA 46 HA ALA 46 -14.943 -17.092 -18.340 321 1HB ALA 46 3HB ALA 46 -12.461 -18.587 -18.856 322 2HB ALA 46 2HB ALA 46 -13.770 -19.603 -18.207 323 3HB ALA 46 1HB ALA 46 -13.236 -18.160 -17.311 324 H GLY 47 H GLY 47 -13.986 -18.373 -21.526 325 1HA GLY 47 2HA GLY 47 -12.966 -17.418 -23.289 326 2HA GLY 47 1HA GLY 47 -12.101 -16.374 -22.179 327 H THR 48 H THR 48 -15.428 -16.832 -23.571 328 HA THR 48 HA THR 48 -15.589 -14.304 -24.683 329 HB THR 48 HB THR 48 -18.061 -14.858 -24.730 330 HG1 THR 48 1HG THR 48 -18.378 -15.951 -22.774 331 1HG2 THR 48 3HG2 THR 48 -15.914 -16.501 -25.785 332 2HG2 THR 48 1HG2 THR 48 -17.242 -17.564 -25.260 333 3HG2 THR 48 2HG2 THR 48 -17.551 -16.274 -26.447 334 H ALA 49 H ALA 49 -16.051 -15.347 -21.334 335 HA ALA 49 HA ALA 49 -17.503 -13.067 -20.519 336 1HB ALA 49 3HB ALA 49 -15.853 -15.191 -19.120 337 2HB ALA 49 1HB ALA 49 -16.619 -13.856 -18.226 338 3HB ALA 49 2HB ALA 49 -17.623 -14.999 -19.150 339 H ALA 50 H ALA 50 -13.991 -13.968 -20.430 340 HA ALA 50 HA ALA 50 -13.280 -11.395 -19.392 341 1HB ALA 50 3HB ALA 50 -11.384 -12.490 -18.874 342 2HB ALA 50 1HB ALA 50 -12.136 -13.961 -19.538 343 3HB ALA 50 2HB ALA 50 -11.110 -12.941 -20.574 344 H GLN 51 H GLN 51 -12.623 -13.163 -22.506 345 HA GLN 51 HA GLN 51 -11.401 -11.240 -23.867 346 1HB GLN 51 1HB GLN 51 -11.712 -12.661 -25.603 347 2HB GLN 51 2HB GLN 51 -12.637 -13.653 -24.493 348 1HG GLN 51 1HG GLN 51 -14.065 -13.302 -26.391 349 2HG GLN 51 2HG GLN 51 -14.701 -12.272 -25.124 350 1HE2 GLN 51 1HE2 GLN 51 -15.544 -10.613 -26.171 351 2HE2 GLN 51 2HE2 GLN 51 -14.721 -9.569 -27.280 352 H ALA 52 H ALA 52 -14.926 -11.441 -23.187 353 HA ALA 52 HA ALA 52 -15.563 -9.200 -24.829 354 1HB ALA 52 1HB ALA 52 -17.148 -11.036 -24.307 355 2HB ALA 52 3HB ALA 52 -17.785 -9.450 -23.810 356 3HB ALA 52 2HB ALA 52 -17.117 -10.562 -22.591 357 H ALA 53 H ALA 53 -15.040 -9.786 -21.298 358 HA ALA 53 HA ALA 53 -15.655 -7.194 -20.474 359 1HB ALA 53 3HB ALA 53 -13.608 -9.015 -19.174 360 2HB ALA 53 2HB ALA 53 -15.352 -9.367 -19.119 361 3HB ALA 53 1HB ALA 53 -14.723 -7.865 -18.398 362 H VAL 54 H VAL 54 -12.815 -8.605 -22.049 363 HA VAL 54 HA VAL 54 -11.058 -6.481 -21.331 364 HB VAL 54 HB VAL 54 -10.790 -8.403 -23.639 365 1HG1 VAL 54 1HG1 VAL 54 -9.176 -6.352 -22.947 366 2HG1 VAL 54 2HG1 VAL 54 -8.494 -7.631 -21.914 367 3HG1 VAL 54 3HG1 VAL 54 -8.583 -7.863 -23.677 368 1HG2 VAL 54 1HG2 VAL 54 -11.143 -9.091 -20.896 369 2HG2 VAL 54 2HG2 VAL 54 -10.713 -10.151 -22.259 370 3HG2 VAL 54 3HG2 VAL 54 -9.432 -9.364 -21.306 371 H VAL 55 H VAL 55 -13.120 -7.318 -24.172 372 HA VAL 55 HA VAL 55 -12.253 -5.258 -25.823 373 HB VAL 55 HB VAL 55 -14.820 -6.816 -25.580 374 1HG1 VAL 55 2HG1 VAL 55 -14.455 -4.327 -26.969 375 2HG1 VAL 55 3HG1 VAL 55 -14.663 -5.636 -28.158 376 3HG1 VAL 55 1HG1 VAL 55 -15.893 -5.374 -26.898 377 1HG2 VAL 55 2HG2 VAL 55 -12.260 -7.094 -27.028 378 2HG2 VAL 55 3HG2 VAL 55 -13.436 -8.330 -26.519 379 3HG2 VAL 55 1HG2 VAL 55 -13.713 -7.398 -28.010 380 H ARG 56 H ARG 56 -15.099 -5.393 -23.564 381 HA ARG 56 HA ARG 56 -15.949 -2.849 -24.013 382 1HB ARG 56 1HB ARG 56 -16.234 -4.875 -21.847 383 2HB ARG 56 2HB ARG 56 -16.512 -3.229 -21.314 384 1HG ARG 56 1HG ARG 56 -18.654 -3.958 -22.036 385 2HG ARG 56 2HG ARG 56 -18.073 -2.986 -23.373 386 1HD ARG 56 1HD ARG 56 -17.133 -5.250 -24.331 387 2HD ARG 56 2HD ARG 56 -18.206 -6.017 -23.177 388 HE ARG 56 HE ARG 56 -19.768 -4.091 -24.525 389 2HH1 ARG 56 1HH ARG 56 -20.838 -5.975 -27.239 390 1HH2 ARG 56 2HH2 ARG 56 -17.966 -7.020 -25.376 391 2HH2 ARG 56 1HH2 ARG 56 -18.990 -7.409 -26.718 392 H PHE 57 H PHE 57 -13.661 -4.075 -21.465 393 HA PHE 57 HA PHE 57 -13.179 -1.612 -20.276 394 1HB PHE 57 1HB PHE 57 -12.384 -3.489 -19.075 395 2HB PHE 57 2HB PHE 57 -11.919 -4.341 -20.533 396 HD1 PHE 57 1HD PHE 57 -10.894 -1.591 -18.267 397 HD2 PHE 57 2HD PHE 57 -9.684 -4.344 -21.261 398 HE1 PHE 57 1HE PHE 57 -8.494 -0.979 -17.859 399 HE2 PHE 57 2HE PHE 57 -7.284 -3.732 -20.854 400 HZ PHE 57 HZ PHE 57 -6.718 -2.057 -19.158 401 H GLN 58 H GLN 58 -11.550 -3.300 -23.023 402 HA GLN 58 HA GLN 58 -9.423 -1.580 -23.251 403 1HB GLN 58 1HB GLN 58 -10.909 -3.311 -25.252 404 2HB GLN 58 2HB GLN 58 -9.538 -2.341 -25.752 405 1HG GLN 58 1HG GLN 58 -8.775 -3.682 -23.327 406 2HG GLN 58 2HG GLN 58 -9.539 -4.879 -24.355 407 1HE2 GLN 58 1HE2 GLN 58 -8.931 -3.908 -26.867 408 2HE2 GLN 58 2HE2 GLN 58 -7.227 -4.018 -27.161 409 H GLU 59 H GLU 59 -12.578 -1.533 -25.066 410 HA GLU 59 HA GLU 59 -12.071 0.774 -26.452 411 1HB GLU 59 1HB GLU 59 -14.588 -0.641 -25.564 412 2HB GLU 59 2HB GLU 59 -14.725 0.925 -26.339 413 1HG GLU 59 1HG GLU 59 -12.881 -0.985 -27.703 414 2HG GLU 59 2HG GLU 59 -14.565 -1.472 -27.692 415 HE2 GLU 59 HE GLU 59 -15.033 0.299 -30.423 416 H ALA 60 H ALA 60 -12.945 0.273 -23.070 417 HA ALA 60 HA ALA 60 -13.820 2.981 -22.676 418 1HB ALA 60 2HB ALA 60 -13.178 0.685 -20.782 419 2HB ALA 60 3HB ALA 60 -13.861 2.250 -20.278 420 3HB ALA 60 1HB ALA 60 -14.788 1.180 -21.356 421 H ALA 61 H ALA 61 -10.813 1.112 -22.571 422 HA ALA 61 HA ALA 61 -9.315 2.705 -20.881 423 1HB ALA 61 1HB ALA 61 -8.940 0.529 -22.679 424 2HB ALA 61 2HB ALA 61 -7.733 1.766 -23.105 425 3HB ALA 61 3HB ALA 61 -7.811 1.135 -21.443 426 H ASN 62 H ASN 62 -9.855 2.961 -24.459 427 HA ASN 62 HA ASN 62 -8.214 5.112 -24.860 428 1HB ASN 62 1HB ASN 62 -10.868 4.826 -26.322 429 2HB ASN 62 2HB ASN 62 -9.326 5.348 -26.972 430 1HD2 ASN 62 1HD2 ASN 62 -11.162 2.620 -25.732 431 2HD2 ASN 62 2HD2 ASN 62 -10.264 1.356 -26.502 432 H LYS 63 H LYS 63 -11.760 4.925 -24.081 433 HA LYS 63 HA LYS 63 -12.398 7.578 -24.208 434 1HB LYS 63 1HB LYS 63 -13.416 5.360 -22.421 435 2HB LYS 63 2HB LYS 63 -14.132 6.959 -22.439 436 1HG LYS 63 1HG LYS 63 -14.429 6.727 -24.957 437 2HG LYS 63 2HG LYS 63 -13.863 5.074 -24.827 438 1HD LYS 63 1HD LYS 63 -16.255 4.933 -24.767 439 2HD LYS 63 2HD LYS 63 -15.733 4.674 -23.114 440 1HE LYS 63 1HE LYS 63 -17.091 6.381 -22.488 441 2HE LYS 63 2HE LYS 63 -16.010 7.481 -23.320 442 H GLN 64 H GLN 64 -10.785 5.755 -21.556 443 HA GLN 64 HA GLN 64 -10.806 7.970 -19.819 444 1HB GLN 64 1HB GLN 64 -9.862 5.194 -19.803 445 2HB GLN 64 2HB GLN 64 -8.711 6.258 -19.020 446 1HG GLN 64 1HG GLN 64 -11.697 6.236 -18.379 447 2HG GLN 64 2HG GLN 64 -10.507 5.315 -17.481 448 1HE2 GLN 64 1HE2 GLN 64 -9.557 6.223 -15.817 449 2HE2 GLN 64 2HE2 GLN 64 -9.507 7.912 -15.438 450 H LYS 65 H LYS 65 -8.318 6.457 -21.977 451 HA LYS 65 HA LYS 65 -6.213 8.115 -21.316 452 1HB LYS 65 1HB LYS 65 -6.945 6.364 -23.605 453 2HB LYS 65 2HB LYS 65 -5.703 7.561 -23.913 454 1HG LYS 65 1HG LYS 65 -4.514 5.652 -23.114 455 2HG LYS 65 2HG LYS 65 -4.558 6.747 -21.747 456 1HD LYS 65 1HD LYS 65 -5.273 4.821 -20.675 457 2HD LYS 65 2HD LYS 65 -6.832 5.428 -21.194 458 1HE LYS 65 1HE LYS 65 -5.160 3.231 -22.470 459 2HE LYS 65 2HE LYS 65 -6.796 3.120 -21.851 460 H GLN 66 H GLN 66 -9.098 8.691 -23.299 461 HA GLN 66 HA GLN 66 -8.050 10.973 -24.569 462 1HB GLN 66 1HB GLN 66 -10.260 9.372 -24.934 463 2HB GLN 66 2HB GLN 66 -11.001 10.785 -24.212 464 1HG GLN 66 1HG GLN 66 -8.997 11.157 -26.451 465 2HG GLN 66 2HG GLN 66 -10.629 10.656 -26.844 466 1HE2 GLN 66 1HE2 GLN 66 -10.596 12.727 -27.984 467 2HE2 GLN 66 2HE2 GLN 66 -11.053 14.172 -27.144 468 H GLU 67 H GLU 67 -10.402 10.500 -21.834 469 HA GLU 67 HA GLU 67 -10.629 13.213 -21.295 470 1HB GLU 67 1HB GLU 67 -11.220 10.676 -19.761 471 2HB GLU 67 2HB GLU 67 -11.351 12.220 -18.942 472 1HG GLU 67 1HG GLU 67 -13.485 11.293 -20.100 473 2HG GLU 67 2HG GLU 67 -13.093 12.981 -20.361 474 HE2 GLU 67 HE GLU 67 -12.668 9.929 -22.656 475 H LEU 68 H LEU 68 -8.088 10.917 -20.668 476 HA LEU 68 HA LEU 68 -7.045 12.168 -18.344 477 1HB LEU 68 1HB LEU 68 -6.659 9.797 -19.714 478 2HB LEU 68 2HB LEU 68 -5.163 10.666 -19.995 479 HG LEU 68 HG LEU 68 -4.713 10.840 -17.647 480 1HD1 LEU 68 3HD1 LEU 68 -7.554 10.532 -17.380 481 2HD1 LEU 68 1HD1 LEU 68 -6.728 9.308 -16.386 482 3HD1 LEU 68 2HD1 LEU 68 -6.352 11.034 -16.167 483 1HD2 LEU 68 1HD2 LEU 68 -5.493 8.128 -18.667 484 2HD2 LEU 68 2HD2 LEU 68 -3.878 8.813 -18.364 485 3HD2 LEU 68 3HD2 LEU 68 -4.906 8.319 -16.998 486 H ASP 69 H ASP 69 -5.931 12.101 -21.807 487 HA ASP 69 HA ASP 69 -3.996 14.022 -21.435 488 1HB ASP 69 1HB ASP 69 -4.721 12.414 -23.488 489 2HB ASP 69 2HB ASP 69 -5.484 13.887 -24.051 490 HD2 ASP 69 HD ASP 69 -3.243 15.215 -25.420 491 H GLU 70 H GLU 70 -7.407 14.231 -22.691 492 HA GLU 70 HA GLU 70 -7.500 16.853 -23.308 493 1HB GLU 70 1HB GLU 70 -9.755 16.509 -23.511 494 2HB GLU 70 2HB GLU 70 -9.312 14.834 -23.250 495 1HG GLU 70 1HG GLU 70 -9.839 14.974 -20.877 496 2HG GLU 70 2HG GLU 70 -10.009 16.716 -20.954 497 HE2 GLU 70 HE GLU 70 -11.510 17.193 -22.900 498 H ILE 71 H ILE 71 -8.089 15.344 -20.063 499 HA ILE 71 HA ILE 71 -8.553 17.840 -18.803 500 HB ILE 71 HB ILE 71 -8.008 15.049 -17.818 501 1HG1 ILE 71 1HG1 ILE 71 -10.508 16.756 -17.672 502 2HG1 ILE 71 2HG1 ILE 71 -10.190 15.589 -18.940 503 1HG2 ILE 71 2HG2 ILE 71 -7.670 17.503 -16.358 504 2HG2 ILE 71 3HG2 ILE 71 -9.060 16.601 -15.708 505 3HG2 ILE 71 1HG2 ILE 71 -7.463 15.821 -15.812 506 1HD1 ILE 71 1HD1 ILE 71 -9.868 14.612 -16.121 507 2HD1 ILE 71 2HD1 ILE 71 -11.525 14.943 -16.679 508 3HD1 ILE 71 3HD1 ILE 71 -10.512 13.768 -17.550 509 H SER 72 H SER 72 -5.739 15.547 -18.870 510 HA SER 72 HA SER 72 -4.091 17.058 -17.302 511 1HB SER 72 1HB SER 72 -2.423 15.571 -17.932 512 2HB SER 72 2HB SER 72 -3.840 14.658 -18.409 513 HG SER 72 HG SER 72 -3.527 15.774 -20.591 514 H THR 73 H THR 73 -5.181 17.557 -20.606 515 HA THR 73 HA THR 73 -3.046 19.476 -21.141 516 HB THR 73 HB THR 73 -5.269 18.158 -22.766 517 HG1 THR 73 1HG THR 73 -3.440 17.083 -23.514 518 1HG2 THR 73 1HG2 THR 73 -4.314 20.759 -23.262 519 2HG2 THR 73 2HG2 THR 73 -3.245 19.726 -24.240 520 3HG2 THR 73 3HG2 THR 73 -5.008 19.662 -24.479 521 H ASN 74 H ASN 74 -6.460 19.293 -20.214 522 HA ASN 74 HA ASN 74 -7.361 21.698 -20.992 523 1HB ASN 74 1HB ASN 74 -8.002 19.750 -18.924 524 2HB ASN 74 2HB ASN 74 -8.212 21.358 -18.260 525 1HD2 ASN 74 1HD2 ASN 74 -9.645 18.910 -19.945 526 2HD2 ASN 74 2HD2 ASN 74 -10.950 19.752 -20.711 527 H ILE 75 H ILE 75 -5.654 20.900 -17.867 528 HA ILE 75 HA ILE 75 -5.508 23.552 -16.977 529 HB ILE 75 HB ILE 75 -3.692 21.252 -16.260 530 1HG1 ILE 75 1HG1 ILE 75 -5.770 21.510 -14.362 531 2HG1 ILE 75 2HG1 ILE 75 -6.551 21.507 -15.931 532 1HG2 ILE 75 2HG2 ILE 75 -3.673 23.922 -15.450 533 2HG2 ILE 75 3HG2 ILE 75 -4.479 23.050 -14.125 534 3HG2 ILE 75 1HG2 ILE 75 -2.858 22.551 -14.662 535 1HD1 ILE 75 3HD1 ILE 75 -5.068 19.466 -16.508 536 2HD1 ILE 75 1HD1 ILE 75 -4.688 19.402 -14.770 537 3HD1 ILE 75 2HD1 ILE 75 -6.369 19.203 -15.322 538 H ARG 76 H ARG 76 -3.244 21.464 -18.860 539 HA ARG 76 HA ARG 76 -1.092 23.087 -18.858 540 1HB ARG 76 1HB ARG 76 -2.224 21.352 -21.106 541 2HB ARG 76 2HB ARG 76 -0.632 22.080 -21.187 542 1HG ARG 76 1HG ARG 76 -1.201 20.597 -18.660 543 2HG ARG 76 2HG ARG 76 -1.154 19.601 -20.101 544 1HD ARG 76 1HD ARG 76 1.112 19.580 -19.675 545 2HD ARG 76 2HD ARG 76 1.079 21.095 -20.554 546 HE ARG 76 HE ARG 76 0.555 21.951 -18.014 547 2HH1 ARG 76 1HH ARG 76 3.597 21.755 -16.348 548 1HH2 ARG 76 2HH2 ARG 76 3.039 19.756 -19.265 549 2HH2 ARG 76 1HH2 ARG 76 4.188 20.153 -18.030 550 H GLN 77 H GLN 77 -4.161 23.415 -20.640 551 HA GLN 77 HA GLN 77 -3.113 25.473 -22.323 552 1HB GLN 77 1HB GLN 77 -5.970 24.486 -21.910 553 2HB GLN 77 2HB GLN 77 -5.469 25.611 -23.157 554 1HG GLN 77 1HG GLN 77 -3.709 23.322 -23.267 555 2HG GLN 77 2HG GLN 77 -5.358 22.731 -23.205 556 1HE2 GLN 77 1HE2 GLN 77 -4.215 22.131 -25.414 557 2HE2 GLN 77 2HE2 GLN 77 -4.654 23.137 -26.754 558 H ALA 78 H ALA 78 -4.403 25.206 -19.127 559 HA ALA 78 HA ALA 78 -5.772 27.639 -18.926 560 1HB ALA 78 2HB ALA 78 -4.236 26.515 -16.607 561 2HB ALA 78 3HB ALA 78 -5.915 27.103 -16.686 562 3HB ALA 78 1HB ALA 78 -5.500 25.502 -17.344 563 H GLY 79 H GLY 79 -2.349 26.797 -19.083 564 1HA GLY 79 2HA GLY 79 -1.701 29.653 -18.693 565 2HA GLY 79 1HA GLY 79 -0.849 28.546 -19.751 566 H VAL 80 H VAL 80 -1.268 26.376 -17.504 567 HA VAL 80 HA VAL 80 0.367 27.367 -15.372 568 HB VAL 80 HB VAL 80 -0.291 24.485 -15.913 569 1HG1 VAL 80 1HG1 VAL 80 0.520 26.150 -13.587 570 2HG1 VAL 80 2HG1 VAL 80 -0.685 24.879 -13.270 571 3HG1 VAL 80 3HG1 VAL 80 0.893 24.454 -13.974 572 1HG2 VAL 80 3HG2 VAL 80 -2.177 26.701 -15.172 573 2HG2 VAL 80 1HG2 VAL 80 -2.434 25.288 -16.223 574 3HG2 VAL 80 2HG2 VAL 80 -2.403 25.088 -14.454 575 H GLN 81 H GLN 81 2.345 28.042 -16.286 576 HA GLN 81 HA GLN 81 3.987 25.796 -17.115 577 1HB GLN 81 1HB GLN 81 5.064 27.725 -18.690 578 2HB GLN 81 2HB GLN 81 3.827 26.617 -19.248 579 1HG GLN 81 1HG GLN 81 2.072 28.313 -18.526 580 2HG GLN 81 2HG GLN 81 3.369 29.429 -18.149 581 1HE2 GLN 81 1HE2 GLN 81 3.528 30.914 -19.635 582 2HE2 GLN 81 2HE2 GLN 81 3.448 30.700 -21.352 583 H TYR 82 H TYR 82 3.430 27.917 -14.774 584 HA TYR 82 HA TYR 82 6.148 27.976 -13.924 585 1HB TYR 82 1HB TYR 82 6.420 30.395 -14.040 586 2HB TYR 82 2HB TYR 82 5.779 29.950 -15.609 587 HD1 TYR 82 1HD TYR 82 2.961 29.732 -15.364 588 HD2 TYR 82 2HD TYR 82 5.576 32.418 -13.302 589 HE1 TYR 82 1HE TYR 82 1.038 31.362 -15.034 590 HE2 TYR 82 2HE TYR 82 3.644 34.039 -12.979 591 HH TYR 82 HH TYR 82 0.505 33.420 -14.464 592 H SER 83 H SER 83 6.338 28.490 -11.679 593 HA SER 83 HA SER 83 3.793 29.051 -10.387 594 1HB SER 83 1HB SER 83 4.455 27.403 -8.579 595 2HB SER 83 2HB SER 83 4.057 26.672 -10.121 596 HG SER 83 HG SER 83 6.291 26.318 -8.737 597 H ARG 84 H ARG 84 7.327 28.494 -9.674 598 HA ARG 84 HA ARG 84 7.206 30.581 -7.724 599 1HB ARG 84 1HB ARG 84 8.958 28.321 -8.351 600 2HB ARG 84 2HB ARG 84 9.914 29.772 -8.132 601 1HG ARG 84 1HG ARG 84 9.724 29.455 -5.893 602 2HG ARG 84 2HG ARG 84 8.036 29.903 -6.040 603 1HD ARG 84 1HD ARG 84 8.234 27.165 -6.883 604 2HD ARG 84 2HD ARG 84 9.171 27.305 -5.409 605 HE ARG 84 HE ARG 84 6.269 27.599 -5.667 606 2HH1 ARG 84 1HH ARG 84 5.773 28.329 -2.308 607 1HH2 ARG 84 2HH2 ARG 84 9.082 28.403 -3.669 608 2HH2 ARG 84 1HH2 ARG 84 8.149 28.631 -2.228 609 H ALA 85 H ALA 85 9.857 29.937 -10.105 610 HA ALA 85 HA ALA 85 9.600 32.734 -10.978 611 1HB ALA 85 3HB ALA 85 11.678 33.076 -10.200 612 2HB ALA 85 2HB ALA 85 12.281 31.817 -11.305 613 3HB ALA 85 1HB ALA 85 11.774 31.384 -9.655 614 H ASP 86 H ASP 86 11.533 29.823 -11.966 615 HA ASP 86 HA ASP 86 10.120 29.939 -14.501 616 1HB ASP 86 1HB ASP 86 13.035 29.254 -14.579 617 2HB ASP 86 2HB ASP 86 12.058 30.080 -15.776 618 HD2 ASP 86 HD ASP 86 14.512 32.176 -13.838 619 H GLU 87 H GLU 87 9.546 28.147 -12.399 620 HA GLU 87 HA GLU 87 10.905 25.954 -11.953 621 1HB GLU 87 1HB GLU 87 8.641 26.307 -11.097 622 2HB GLU 87 2HB GLU 87 7.954 26.114 -12.698 623 1HG GLU 87 1HG GLU 87 9.647 23.878 -11.564 624 2HG GLU 87 2HG GLU 87 8.007 24.072 -10.978 625 HE2 GLU 87 HE GLU 87 7.979 21.835 -13.788 626 H GLU 88 H GLU 88 8.708 26.230 -14.847 627 HA GLU 88 HA GLU 88 9.334 23.880 -16.007 628 1HB GLU 88 1HB GLU 88 7.624 25.628 -16.744 629 2HB GLU 88 2HB GLU 88 8.930 26.481 -17.543 630 1HG GLU 88 1HG GLU 88 9.061 23.681 -18.288 631 2HG GLU 88 2HG GLU 88 7.420 24.246 -18.526 632 HE2 GLU 88 HE GLU 88 7.499 24.443 -20.666 633 H GLN 89 H GLN 89 11.126 27.008 -16.242 634 HA GLN 89 HA GLN 89 13.086 25.753 -17.925 635 1HB GLN 89 1HB GLN 89 12.324 28.114 -18.304 636 2HB GLN 89 2HB GLN 89 13.008 28.570 -16.756 637 1HG GLN 89 1HG GLN 89 14.984 27.106 -18.338 638 2HG GLN 89 2HG GLN 89 14.348 28.452 -19.263 639 1HE2 GLN 89 1HE2 GLN 89 16.748 27.579 -17.296 640 2HE2 GLN 89 2HE2 GLN 89 17.150 29.074 -16.520 641 H GLN 90 H GLN 90 12.621 24.808 -15.105 642 HA GLN 90 HA GLN 90 14.260 25.645 -13.227 643 1HB GLN 90 1HB GLN 90 14.717 23.035 -12.856 644 2HB GLN 90 2HB GLN 90 13.130 23.732 -12.595 645 1HG GLN 90 1HG GLN 90 12.216 22.614 -14.367 646 2HG GLN 90 2HG GLN 90 13.568 22.985 -15.418 647 1HE2 GLN 90 1HE2 GLN 90 14.709 21.344 -16.078 648 2HE2 GLN 90 2HE2 GLN 90 14.933 19.824 -15.278 649 H GLN 91 H GLN 91 15.470 22.923 -15.299 650 HA GLN 91 HA GLN 91 18.105 24.120 -15.034 651 1HB GLN 91 1HB GLN 91 17.080 21.390 -14.953 652 2HB GLN 91 2HB GLN 91 18.332 21.528 -16.171 653 1HG GLN 91 1HG GLN 91 19.412 20.980 -14.065 654 2HG GLN 91 2HG GLN 91 19.824 22.638 -14.456 655 1HE2 GLN 91 1HE2 GLN 91 19.889 21.424 -11.892 656 2HE2 GLN 91 2HE2 GLN 91 18.777 22.250 -10.851 657 H ALA 92 H ALA 92 16.809 21.834 -17.519 658 HA ALA 92 HA ALA 92 17.343 23.894 -19.541 659 1HB ALA 92 3HB ALA 92 18.626 22.433 -20.832 660 2HB ALA 92 1HB ALA 92 19.142 22.005 -19.183 661 3HB ALA 92 2HB ALA 92 17.962 20.984 -20.040 662 H LEU 93 H LEU 93 14.844 23.145 -18.187 663 HA LEU 93 HA LEU 93 13.481 21.627 -20.279 664 1HB LEU 93 1HB LEU 93 13.111 22.052 -17.394 665 2HB LEU 93 2HB LEU 93 11.630 22.127 -18.328 666 HG LEU 93 HG LEU 93 11.875 19.900 -19.113 667 1HD1 LEU 93 3HD1 LEU 93 14.716 20.117 -18.132 668 2HD1 LEU 93 1HD1 LEU 93 13.937 18.539 -18.401 669 3HD1 LEU 93 2HD1 LEU 93 14.112 19.687 -19.750 670 1HD2 LEU 93 1HD2 LEU 93 12.498 20.213 -16.181 671 2HD2 LEU 93 2HD2 LEU 93 10.949 19.830 -16.970 672 3HD2 LEU 93 3HD2 LEU 93 12.247 18.613 -16.920 673 H SER 94 H SER 94 14.271 23.901 -21.397 674 HA SER 94 HA SER 94 11.868 25.547 -21.260 675 1HB SER 94 1HB SER 94 14.101 26.548 -20.320 676 2HB SER 94 2HB SER 94 14.589 26.668 -21.999 677 HG SER 94 HG SER 94 12.991 28.157 -22.418 678 H SER 95 H SER 95 14.853 25.172 -23.322 679 HA SER 95 HA SER 95 13.104 25.272 -25.628 680 1HB SER 95 1HB SER 95 14.937 26.825 -25.757 681 2HB SER 95 2HB SER 95 16.101 25.615 -25.254 682 HG SER 95 HG SER 95 16.007 24.617 -27.253 683 H GLN 96 H GLN 96 15.158 23.134 -23.720 684 HA GLN 96 HA GLN 96 15.698 21.246 -25.684 685 1HB GLN 96 1HB GLN 96 16.411 21.619 -23.050 686 2HB GLN 96 2HB GLN 96 15.329 20.249 -22.903 687 1HG GLN 96 1HG GLN 96 16.793 18.824 -23.933 688 2HG GLN 96 2HG GLN 96 17.186 19.982 -25.188 689 1HE2 GLN 96 1HE2 GLN 96 19.180 18.512 -24.296 690 2HE2 GLN 96 2HE2 GLN 96 20.272 19.393 -23.280 691 H MET 97 H MET 97 13.127 21.332 -23.111 692 HA MET 97 HA MET 97 11.890 19.006 -23.779 693 1HB MET 97 1HB MET 97 11.467 20.730 -21.846 694 2HB MET 97 2HB MET 97 10.406 21.557 -22.969 695 1HG MET 97 1HG MET 97 10.100 18.592 -22.307 696 2HG MET 97 2HG MET 97 9.284 19.849 -21.398 697 1HE MET 97 3HE MET 97 7.762 21.504 -22.243 698 2HE MET 97 1HE MET 97 8.440 22.055 -23.793 699 3HE MET 97 2HE MET 97 6.786 21.401 -23.727 700 H GLY 98 H GLY 98 10.630 18.285 -25.459 701 1HA GLY 98 2HA GLY 98 10.105 20.146 -27.638 702 2HA GLY 98 1HA GLY 98 8.697 19.448 -26.862 703 H PHE 99 H PHE 99 10.922 19.045 -29.365 704 HA PHE 99 HA PHE 99 10.062 16.287 -29.695 705 1HB PHE 99 1HB PHE 99 9.711 17.812 -31.583 706 2HB PHE 99 2HB PHE 99 11.315 18.495 -31.413 707 HD1 PHE 99 1HD PHE 99 13.293 17.218 -32.168 708 HD2 PHE 99 2HD PHE 99 9.350 15.788 -32.818 709 HE1 PHE 99 1HE PHE 99 14.159 15.614 -33.893 710 HE2 PHE 99 2HE PHE 99 10.217 14.184 -34.543 711 HZ PHE 99 HZ PHE 99 12.611 14.116 -35.060 712 H MET 601 H MET 601 6.864 -25.000 -18.778 713 HA MET 601 HA MET 601 8.832 -23.403 -20.176 714 1HB MET 601 1HB MET 601 8.837 -25.815 -18.345 715 2HB MET 601 2HB MET 601 10.179 -25.658 -19.461 716 1HG MET 601 1HG MET 601 10.103 -23.100 -18.493 717 2HG MET 601 2HG MET 601 9.459 -23.950 -17.103 718 1HE MET 601 1HE MET 601 11.900 -22.401 -16.690 719 2HE MET 601 2HE MET 601 13.490 -23.167 -16.919 720 3HE MET 601 3HE MET 601 12.598 -22.531 -18.322 721 H THR 602 H THR 602 7.538 -26.806 -20.217 722 HA THR 602 HA THR 602 8.740 -27.770 -22.431 723 HB THR 602 HB THR 602 5.822 -28.069 -21.543 724 HG1 THR 602 1HG THR 602 8.301 -29.580 -21.110 725 1HG2 THR 602 2HG2 THR 602 7.618 -29.680 -23.405 726 2HG2 THR 602 3HG2 THR 602 6.326 -30.471 -22.470 727 3HG2 THR 602 1HG2 THR 602 5.921 -29.202 -23.650 728 H GLU 603 H GLU 603 6.128 -25.338 -22.332 729 HA GLU 603 HA GLU 603 6.773 -24.738 -25.063 730 1HB GLU 603 1HB GLU 603 4.036 -25.723 -24.193 731 2HB GLU 603 2HB GLU 603 4.216 -24.676 -25.587 732 1HG GLU 603 1HG GLU 603 6.133 -26.481 -26.216 733 2HG GLU 603 2HG GLU 603 5.140 -27.516 -25.209 734 HE2 GLU 603 HE GLU 603 2.516 -27.752 -26.972 735 H GLN 604 H GLN 604 7.112 -22.562 -25.055 736 HA GLN 604 HA GLN 604 6.136 -21.009 -22.912 737 1HB GLN 604 1HB GLN 604 7.380 -19.198 -23.911 738 2HB GLN 604 2HB GLN 604 8.336 -20.654 -24.103 739 1HG GLN 604 1HG GLN 604 6.605 -20.485 -26.390 740 2HG GLN 604 2HG GLN 604 7.296 -18.891 -26.156 741 1HE2 GLN 604 1HE2 GLN 604 7.880 -20.400 -28.360 742 2HE2 GLN 604 2HE2 GLN 604 9.536 -20.906 -28.343 743 H GLN 605 H GLN 605 4.662 -22.179 -25.715 744 HA GLN 605 HA GLN 605 3.381 -20.230 -26.943 745 1HB GLN 605 1HB GLN 605 2.582 -22.983 -26.090 746 2HB GLN 605 2HB GLN 605 1.280 -21.950 -26.645 747 1HG GLN 605 1HG GLN 605 3.838 -22.589 -28.188 748 2HG GLN 605 2HG GLN 605 2.244 -23.230 -28.533 749 1HE2 GLN 605 1HE2 GLN 605 4.463 -20.941 -29.342 750 2HE2 GLN 605 2HE2 GLN 605 3.464 -19.765 -30.129 751 H TRP 606 H TRP 606 2.468 -21.545 -23.694 752 HA TRP 606 HA TRP 606 1.197 -18.994 -23.120 753 1HB TRP 606 1HB TRP 606 -0.878 -19.876 -22.470 754 2HB TRP 606 2HB TRP 606 -0.560 -20.498 -24.077 755 HD1 TRP 606 HD TRP 606 0.203 -23.196 -24.175 756 HE1 TRP 606 1HE TRP 606 -0.420 -25.270 -22.668 757 HE3 TRP 606 3HE TRP 606 -1.393 -20.481 -20.183 758 HZ2 TRP 606 2HZ TRP 606 -1.487 -25.537 -20.034 759 HZ3 TRP 606 3HZ TRP 606 -2.209 -21.725 -18.184 760 HH2 TRP 606 HH TRP 606 -2.272 -24.166 -18.068 761 H ASN 607 H ASN 607 3.070 -18.717 -21.746 762 HA ASN 607 HA ASN 607 4.044 -20.581 -20.027 763 1HB ASN 607 1HB ASN 607 4.600 -18.400 -18.591 764 2HB ASN 607 2HB ASN 607 5.356 -18.634 -20.155 765 1HD2 ASN 607 1HD2 ASN 607 5.628 -16.348 -20.183 766 2HD2 ASN 607 2HD2 ASN 607 4.346 -15.295 -20.682 767 H PHE 608 H PHE 608 3.165 -21.550 -18.186 768 HA PHE 608 HA PHE 608 0.577 -20.969 -17.342 769 1HB PHE 608 1HB PHE 608 3.010 -22.515 -16.377 770 2HB PHE 608 2HB PHE 608 1.688 -22.322 -15.244 771 HD1 PHE 608 1HD PHE 608 2.352 -23.447 -18.736 772 HD2 PHE 608 2HD PHE 608 -0.053 -23.853 -15.263 773 HE1 PHE 608 1HE PHE 608 1.170 -25.398 -19.782 774 HE2 PHE 608 2HE PHE 608 -1.235 -25.804 -16.309 775 HZ PHE 608 HZ PHE 608 -0.610 -26.553 -18.557 776 H ALA 609 H ALA 609 3.801 -20.149 -15.896 777 HA ALA 609 HA ALA 609 2.622 -18.766 -13.707 778 1HB ALA 609 3HB ALA 609 5.449 -18.725 -14.841 779 2HB ALA 609 2HB ALA 609 4.839 -19.857 -13.611 780 3HB ALA 609 1HB ALA 609 4.956 -18.120 -13.241 781 H GLY 610 H GLY 610 2.730 -18.094 -17.001 782 1HA GLY 610 2HA GLY 610 2.867 -16.155 -18.220 783 2HA GLY 610 1HA GLY 610 3.261 -15.247 -16.773 784 H ILE 611 H ILE 611 0.485 -17.363 -17.820 785 HA ILE 611 HA ILE 611 -1.296 -15.114 -17.673 786 HB ILE 611 HB ILE 611 -1.741 -16.538 -19.439 787 1HG1 ILE 611 1HG1 ILE 611 -3.663 -16.140 -17.505 788 2HG1 ILE 611 2HG1 ILE 611 -3.948 -16.689 -19.145 789 1HG2 ILE 611 3HG2 ILE 611 -1.205 -18.775 -17.503 790 2HG2 ILE 611 1HG2 ILE 611 -2.143 -19.061 -18.989 791 3HG2 ILE 611 2HG2 ILE 611 -0.475 -18.449 -19.094 792 1HD1 ILE 611 1HD1 ILE 611 -3.232 -18.672 -16.960 793 2HD1 ILE 611 2HD1 ILE 611 -4.909 -18.122 -17.192 794 3HD1 ILE 611 3HD1 ILE 611 -4.062 -18.974 -18.505 795 H GLU 612 H GLU 612 -0.083 -17.598 -15.547 796 HA GLU 612 HA GLU 612 -2.309 -17.830 -13.897 797 1HB GLU 612 1HB GLU 612 -0.595 -19.489 -13.727 798 2HB GLU 612 2HB GLU 612 0.663 -18.293 -13.488 799 1HG GLU 612 1HG GLU 612 -0.475 -17.643 -11.297 800 2HG GLU 612 2HG GLU 612 -1.569 -18.993 -11.526 801 HE2 GLU 612 HE GLU 612 1.744 -18.189 -11.141 802 H ALA 613 H ALA 613 0.659 -15.750 -13.677 803 HA ALA 613 HA ALA 613 -0.461 -14.346 -11.417 804 1HB ALA 613 2HB ALA 613 1.672 -13.294 -11.291 805 2HB ALA 613 1HB ALA 613 2.047 -13.676 -12.989 806 3HB ALA 613 3HB ALA 613 2.002 -14.976 -11.774 807 H ALA 614 H ALA 614 -0.585 -14.215 -14.875 808 HA ALA 614 HA ALA 614 -0.611 -11.566 -15.475 809 1HB ALA 614 1HB ALA 614 -2.276 -13.898 -16.469 810 2HB ALA 614 2HB ALA 614 -2.371 -12.282 -17.208 811 3HB ALA 614 3HB ALA 614 -0.830 -13.174 -17.212 812 H ALA 615 H ALA 615 -3.373 -13.550 -14.205 813 HA ALA 615 HA ALA 615 -5.220 -11.477 -14.139 814 1HB ALA 615 2HB ALA 615 -6.548 -13.113 -13.321 815 2HB ALA 615 3HB ALA 615 -5.149 -14.188 -13.556 816 3HB ALA 615 1HB ALA 615 -5.445 -13.448 -11.965 817 H SER 616 H SER 616 -2.890 -12.667 -11.631 818 HA SER 616 HA SER 616 -3.674 -11.059 -9.595 819 1HB SER 616 1HB SER 616 -1.599 -12.832 -10.064 820 2HB SER 616 2HB SER 616 -0.729 -11.322 -9.877 821 HG SER 616 HG SER 616 -2.152 -11.060 -7.858 822 H ALA 617 H ALA 617 -1.903 -10.255 -12.559 823 HA ALA 617 HA ALA 617 -0.934 -7.744 -11.600 824 1HB ALA 617 3HB ALA 617 -0.332 -9.447 -13.686 825 2HB ALA 617 2HB ALA 617 0.235 -7.766 -13.541 826 3HB ALA 617 1HB ALA 617 -1.208 -8.138 -14.514 827 H ILE 618 H ILE 618 -3.837 -8.986 -13.269 828 HA ILE 618 HA ILE 618 -4.792 -6.468 -14.096 829 HB ILE 618 HB ILE 618 -6.236 -9.069 -13.573 830 1HG1 ILE 618 1HG1 ILE 618 -4.406 -9.264 -15.211 831 2HG1 ILE 618 2HG1 ILE 618 -5.984 -9.499 -15.938 832 1HG2 ILE 618 3HG2 ILE 618 -7.425 -6.636 -13.854 833 2HG2 ILE 618 1HG2 ILE 618 -7.319 -7.168 -15.550 834 3HG2 ILE 618 2HG2 ILE 618 -8.149 -8.185 -14.348 835 1HD1 ILE 618 2HD1 ILE 618 -5.440 -6.692 -16.077 836 2HD1 ILE 618 3HD1 ILE 618 -3.968 -7.539 -16.608 837 3HD1 ILE 618 1HD1 ILE 618 -5.520 -7.856 -17.420 838 H GLN 619 H GLN 619 -5.386 -8.522 -11.178 839 HA GLN 619 HA GLN 619 -7.305 -6.968 -10.034 840 1HB GLN 619 1HB GLN 619 -5.461 -9.070 -9.202 841 2HB GLN 619 2HB GLN 619 -5.678 -7.910 -7.906 842 1HG GLN 619 1HG GLN 619 -7.985 -9.206 -9.433 843 2HG GLN 619 2HG GLN 619 -7.370 -9.802 -7.904 844 1HE2 GLN 619 1HE2 GLN 619 -9.863 -8.300 -9.083 845 2HE2 GLN 619 2HE2 GLN 619 -10.254 -7.137 -7.860 846 H GLY 620 H GLY 620 -3.787 -6.914 -9.085 847 1HA GLY 620 2HA GLY 620 -2.450 -5.213 -8.466 848 2HA GLY 620 1HA GLY 620 -3.826 -4.655 -7.536 849 H ASN 621 H ASN 621 -3.854 -4.944 -11.107 850 HA ASN 621 HA ASN 621 -3.196 -2.226 -11.499 851 1HB ASN 621 1HB ASN 621 -4.108 -4.540 -13.210 852 2HB ASN 621 2HB ASN 621 -4.333 -2.932 -13.869 853 1HD2 ASN 621 1HD2 ASN 621 -2.312 -1.458 -13.286 854 2HD2 ASN 621 2HD2 ASN 621 -0.783 -2.109 -13.776 855 H VAL 622 H VAL 622 -6.126 -4.200 -11.042 856 HA VAL 622 HA VAL 622 -7.981 -2.364 -12.099 857 HB VAL 622 HB VAL 622 -8.146 -4.673 -10.168 858 1HG1 VAL 622 2HG1 VAL 622 -10.314 -2.783 -11.075 859 2HG1 VAL 622 3HG1 VAL 622 -10.683 -4.480 -10.683 860 3HG1 VAL 622 1HG1 VAL 622 -9.976 -3.414 -9.445 861 1HG2 VAL 622 2HG2 VAL 622 -7.848 -4.609 -12.907 862 2HG2 VAL 622 3HG2 VAL 622 -8.518 -5.966 -11.970 863 3HG2 VAL 622 1HG2 VAL 622 -9.610 -4.775 -12.716 864 H THR 623 H THR 623 -6.965 -3.110 -8.688 865 HA THR 623 HA THR 623 -8.459 -0.997 -7.574 866 HB THR 623 HB THR 623 -7.000 -1.536 -5.572 867 HG1 THR 623 1HG THR 623 -5.022 -2.129 -6.472 868 1HG2 THR 623 1HG2 THR 623 -8.947 -3.129 -6.500 869 2HG2 THR 623 2HG2 THR 623 -7.579 -4.195 -6.902 870 3HG2 THR 623 3HG2 THR 623 -7.857 -3.702 -5.215 871 H SER 624 H SER 624 -5.206 -1.186 -9.010 872 HA SER 624 HA SER 624 -4.146 1.087 -7.948 873 1HB SER 624 1HB SER 624 -3.824 -0.242 -10.659 874 2HB SER 624 2HB SER 624 -2.910 1.195 -10.248 875 HG SER 624 HG SER 624 -2.168 -1.236 -9.704 876 H ILE 625 H ILE 625 -6.379 0.657 -10.749 877 HA ILE 625 HA ILE 625 -6.313 3.410 -11.464 878 HB ILE 625 HB ILE 625 -7.682 0.945 -12.334 879 1HG1 ILE 625 1HG1 ILE 625 -7.179 2.646 -14.491 880 2HG1 ILE 625 2HG1 ILE 625 -5.867 2.977 -13.376 881 1HG2 ILE 625 1HG2 ILE 625 -8.979 3.652 -12.504 882 2HG2 ILE 625 2HG2 ILE 625 -9.219 2.442 -13.787 883 3HG2 ILE 625 3HG2 ILE 625 -9.697 2.071 -12.113 884 1HD1 ILE 625 3HD1 ILE 625 -6.706 0.201 -14.337 885 2HD1 ILE 625 1HD1 ILE 625 -5.284 1.113 -14.900 886 3HD1 ILE 625 2HD1 ILE 625 -5.367 0.544 -13.215 887 H HIS 626 H HIS 626 -8.398 1.300 -9.436 888 HA HIS 626 HA HIS 626 -10.462 3.087 -9.050 889 1HB HIS 626 1HB HIS 626 -10.285 0.625 -8.409 890 2HB HIS 626 2HB HIS 626 -9.425 1.147 -6.975 891 HD1 HIS 626 1HD HIS 626 -11.609 -0.064 -5.816 892 HD2 HIS 626 2HD HIS 626 -12.246 3.615 -7.728 893 HE1 HIS 626 1HE HIS 626 -13.833 0.825 -4.935 894 H SER 627 H SER 627 -7.375 2.649 -7.208 895 HA SER 627 HA SER 627 -8.019 4.757 -5.443 896 1HB SER 627 1HB SER 627 -5.717 2.916 -5.918 897 2HB SER 627 2HB SER 627 -5.307 4.450 -5.177 898 HG SER 627 HG SER 627 -6.787 4.026 -3.469 899 H LEU 628 H LEU 628 -5.970 4.348 -8.387 900 HA LEU 628 HA LEU 628 -4.656 6.749 -8.372 901 1HB LEU 628 1HB LEU 628 -5.503 4.779 -10.409 902 2HB LEU 628 2HB LEU 628 -5.095 6.373 -11.012 903 HG LEU 628 HG LEU 628 -3.222 4.878 -9.181 904 1HD1 LEU 628 2HD1 LEU 628 -3.931 4.202 -11.937 905 2HD1 LEU 628 3HD1 LEU 628 -2.192 4.514 -11.715 906 3HD1 LEU 628 1HD1 LEU 628 -3.009 3.281 -10.724 907 1HD2 LEU 628 2HD2 LEU 628 -2.851 7.294 -9.554 908 2HD2 LEU 628 3HD2 LEU 628 -1.523 6.283 -10.172 909 3HD2 LEU 628 1HD2 LEU 628 -2.709 6.981 -11.301 910 H LEU 629 H LEU 629 -7.894 6.006 -9.840 911 HA LEU 629 HA LEU 629 -8.399 8.609 -10.675 912 1HB LEU 629 1HB LEU 629 -9.808 6.086 -10.438 913 2HB LEU 629 2HB LEU 629 -10.860 7.437 -10.063 914 HG LEU 629 HG LEU 629 -9.358 8.062 -12.436 915 1HD1 LEU 629 2HD1 LEU 629 -9.085 5.645 -12.702 916 2HD1 LEU 629 3HD1 LEU 629 -10.846 5.424 -12.561 917 3HD1 LEU 629 1HD1 LEU 629 -10.169 6.319 -13.942 918 1HD2 LEU 629 2HD2 LEU 629 -11.685 8.814 -11.510 919 2HD2 LEU 629 3HD2 LEU 629 -11.408 8.705 -13.265 920 3HD2 LEU 629 1HD2 LEU 629 -12.284 7.406 -12.420 921 H ASP 630 H ASP 630 -8.679 7.019 -7.505 922 HA ASP 630 HA ASP 630 -10.360 8.885 -6.343 923 1HB ASP 630 1HB ASP 630 -8.917 6.571 -5.562 924 2HB ASP 630 2HB ASP 630 -8.328 7.837 -4.502 925 HD2 ASP 630 HD ASP 630 -11.022 6.771 -2.563 926 H GLU 631 H GLU 631 -6.802 8.683 -6.838 927 HA GLU 631 HA GLU 631 -6.253 10.911 -5.181 928 1HB GLU 631 1HB GLU 631 -4.730 9.018 -6.886 929 2HB GLU 631 2HB GLU 631 -4.032 10.623 -6.807 930 1HG GLU 631 1HG GLU 631 -4.666 8.768 -4.473 931 2HG GLU 631 2HG GLU 631 -3.087 9.327 -4.986 932 HE2 GLU 631 HE GLU 631 -4.178 12.532 -4.770 933 H GLY 632 H GLY 632 -6.798 10.331 -8.678 934 1HA GLY 632 2HA GLY 632 -6.890 11.743 -10.440 935 2HA GLY 632 1HA GLY 632 -6.009 12.943 -9.516 936 H LYS 633 H LYS 633 -9.128 11.332 -8.647 937 HA LYS 633 HA LYS 633 -10.870 13.243 -9.535 938 1HB LYS 633 1HB LYS 633 -11.294 10.937 -8.476 939 2HB LYS 633 2HB LYS 633 -11.227 11.757 -6.929 940 1HG LYS 633 1HG LYS 633 -13.549 11.716 -7.583 941 2HG LYS 633 2HG LYS 633 -13.005 13.370 -7.783 942 1HD LYS 633 1HD LYS 633 -12.411 12.235 -10.267 943 2HD LYS 633 2HD LYS 633 -13.901 11.425 -9.828 944 1HE LYS 633 1HE LYS 633 -14.423 14.083 -9.125 945 2HE LYS 633 2HE LYS 633 -13.451 14.255 -10.573 946 H GLN 634 H GLN 634 -8.727 13.267 -6.683 947 HA GLN 634 HA GLN 634 -9.977 15.474 -5.483 948 1HB GLN 634 1HB GLN 634 -8.683 14.198 -4.003 949 2HB GLN 634 2HB GLN 634 -7.361 14.015 -5.139 950 1HG GLN 634 1HG GLN 634 -6.406 16.049 -4.582 951 2HG GLN 634 2HG GLN 634 -7.952 16.828 -4.312 952 1HE2 GLN 634 1HE2 GLN 634 -9.129 16.354 -2.371 953 2HE2 GLN 634 2HE2 GLN 634 -8.299 15.929 -0.912 954 H SER 635 H SER 635 -7.420 15.047 -7.936 955 HA SER 635 HA SER 635 -6.581 17.744 -7.796 956 1HB SER 635 1HB SER 635 -5.725 15.326 -9.072 957 2HB SER 635 2HB SER 635 -5.958 16.510 -10.343 958 HG SER 635 HG SER 635 -3.787 16.383 -9.119 959 H LEU 636 H LEU 636 -9.233 16.020 -9.250 960 HA LEU 636 HA LEU 636 -9.635 17.592 -11.530 961 1HB LEU 636 1HB LEU 636 -10.965 15.484 -10.083 962 2HB LEU 636 2HB LEU 636 -12.128 16.697 -10.580 963 HG LEU 636 HG LEU 636 -11.827 14.804 -12.182 964 1HD1 LEU 636 2HD1 LEU 636 -11.330 17.646 -13.066 965 2HD1 LEU 636 3HD1 LEU 636 -11.563 16.315 -14.225 966 3HD1 LEU 636 1HD1 LEU 636 -12.851 16.722 -13.066 967 1HD2 LEU 636 1HD2 LEU 636 -9.427 14.454 -11.913 968 2HD2 LEU 636 2HD2 LEU 636 -9.843 14.750 -13.619 969 3HD2 LEU 636 3HD2 LEU 636 -9.100 16.042 -12.647 970 H THR 637 H THR 637 -11.023 17.805 -8.183 971 HA THR 637 HA THR 637 -12.383 20.242 -8.780 972 HB THR 637 HB THR 637 -13.363 18.880 -7.089 973 HG1 THR 637 1HG THR 637 -11.558 20.665 -5.631 974 1HG2 THR 637 2HG2 THR 637 -10.503 18.594 -6.083 975 2HG2 THR 637 3HG2 THR 637 -11.879 18.340 -4.983 976 3HG2 THR 637 1HG2 THR 637 -11.689 17.311 -6.423 977 H LYS 638 H LYS 638 -9.139 19.370 -7.702 978 HA LYS 638 HA LYS 638 -8.600 22.023 -6.732 979 1HB LYS 638 1HB LYS 638 -6.843 19.591 -7.163 980 2HB LYS 638 2HB LYS 638 -6.272 21.108 -6.498 981 1HG LYS 638 1HG LYS 638 -7.588 20.900 -4.534 982 2HG LYS 638 2HG LYS 638 -8.705 19.773 -5.279 983 1HD LYS 638 1HD LYS 638 -7.255 18.556 -3.719 984 2HD LYS 638 2HD LYS 638 -6.903 18.037 -5.355 985 1HE LYS 638 1HE LYS 638 -4.811 18.436 -4.072 986 2HE LYS 638 2HE LYS 638 -4.925 19.518 -5.446 987 H LEU 639 H LEU 639 -8.526 20.269 -9.770 988 HA LEU 639 HA LEU 639 -6.824 22.330 -10.949 989 1HB LEU 639 1HB LEU 639 -7.768 19.635 -11.922 990 2HB LEU 639 2HB LEU 639 -6.926 20.785 -12.943 991 HG LEU 639 HG LEU 639 -5.667 19.973 -10.345 992 1HD1 LEU 639 3HD1 LEU 639 -6.528 17.915 -11.644 993 2HD1 LEU 639 1HD1 LEU 639 -5.248 18.306 -12.817 994 3HD1 LEU 639 2HD1 LEU 639 -4.826 17.948 -11.125 995 1HD2 LEU 639 3HD2 LEU 639 -4.918 21.647 -12.407 996 2HD2 LEU 639 1HD2 LEU 639 -3.840 20.947 -11.175 997 3HD2 LEU 639 2HD2 LEU 639 -4.021 20.149 -12.756 998 H ALA 640 H ALA 640 -10.102 21.598 -10.334 999 HA ALA 640 HA ALA 640 -11.450 22.210 -12.607 1000 1HB ALA 640 1HB ALA 640 -13.266 22.825 -11.164 1001 2HB ALA 640 2HB ALA 640 -12.335 21.575 -10.306 1002 3HB ALA 640 3HB ALA 640 -12.154 23.286 -9.853 1003 H ALA 641 H ALA 641 -9.682 24.414 -10.397 1004 HA ALA 641 HA ALA 641 -10.654 26.815 -11.399 1005 1HB ALA 641 1HB ALA 641 -8.771 25.924 -9.509 1006 2HB ALA 641 3HB ALA 641 -9.255 27.608 -9.824 1007 3HB ALA 641 2HB ALA 641 -7.838 26.919 -10.652 1008 H ALA 642 H ALA 642 -8.296 24.480 -12.668 1009 HA ALA 642 HA ALA 642 -7.026 26.191 -14.486 1010 1HB ALA 642 1HB ALA 642 -6.556 23.714 -13.622 1011 2HB ALA 642 3HB ALA 642 -5.983 24.259 -15.216 1012 3HB ALA 642 2HB ALA 642 -7.465 23.281 -15.089 1013 H TRP 643 H TRP 643 -10.243 24.863 -14.352 1014 HA TRP 643 HA TRP 643 -10.620 25.132 -17.222 1015 1HB TRP 643 1HB TRP 643 -12.236 24.015 -14.956 1016 2HB TRP 643 2HB TRP 643 -13.021 24.456 -16.460 1017 HD1 TRP 643 HD TRP 643 -12.636 22.814 -18.549 1018 HE1 TRP 643 1HE TRP 643 -11.539 20.443 -18.922 1019 HE3 TRP 643 3HE TRP 643 -10.243 22.632 -14.066 1020 HZ2 TRP 643 2HZ TRP 643 -9.833 18.794 -17.337 1021 HZ3 TRP 643 3HZ TRP 643 -8.883 20.606 -13.557 1022 HH2 TRP 643 HH TRP 643 -8.657 18.730 -15.107 1023 H GLY 644 H GLY 644 -11.457 26.638 -14.067 1024 1HA GLY 644 2HA GLY 644 -12.843 28.808 -15.508 1025 2HA GLY 644 1HA GLY 644 -11.518 29.161 -14.417 1026 H GLY 645 H GLY 645 -11.748 27.972 -12.139 1027 1HA GLY 645 2HA GLY 645 -14.288 28.843 -11.070 1028 2HA GLY 645 1HA GLY 645 -12.890 28.264 -10.186 1029 H SER 646 H SER 646 -13.781 26.662 -8.891 1030 HA SER 646 HA SER 646 -14.367 24.227 -10.156 1031 1HB SER 646 1HB SER 646 -15.235 23.967 -7.514 1032 2HB SER 646 2HB SER 646 -13.626 23.610 -8.109 1033 HG SER 646 HG SER 646 -14.578 26.022 -6.851 1034 H GLY 647 H GLY 647 -16.425 22.960 -9.856 1035 1HA GLY 647 2HA GLY 647 -18.817 24.160 -8.984 1036 2HA GLY 647 1HA GLY 647 -18.658 22.722 -9.971 1037 H SER 648 H SER 648 -16.887 24.822 -11.744 1038 HA SER 648 HA SER 648 -18.934 26.459 -12.803 1039 1HB SER 648 1HB SER 648 -17.248 27.270 -14.311 1040 2HB SER 648 2HB SER 648 -16.452 27.001 -12.773 1041 HG SER 648 HG SER 648 -15.331 26.163 -14.756 1042 H GLU 649 H GLU 649 -19.908 26.302 -14.942 1043 HA GLU 649 HA GLU 649 -20.821 23.847 -15.605 1044 1HB GLU 649 1HB GLU 649 -21.365 24.916 -17.866 1045 2HB GLU 649 2HB GLU 649 -21.952 25.771 -16.454 1046 1HG GLU 649 1HG GLU 649 -19.472 26.925 -16.718 1047 2HG GLU 649 2HG GLU 649 -19.817 26.553 -18.395 1048 HE2 GLU 649 HE GLU 649 -21.499 29.559 -18.421 1049 H ALA 650 H ALA 650 -17.964 25.603 -16.957 1050 HA ALA 650 HA ALA 650 -17.336 23.774 -18.947 1051 1HB ALA 650 2HB ALA 650 -16.045 25.999 -17.489 1052 2HB ALA 650 3HB ALA 650 -14.908 24.792 -18.136 1053 3HB ALA 650 1HB ALA 650 -16.045 25.618 -19.227 1054 H TYR 651 H TYR 651 -15.854 24.081 -15.635 1055 HA TYR 651 HA TYR 651 -14.417 21.708 -15.785 1056 1HB TYR 651 1HB TYR 651 -13.911 23.297 -14.045 1057 2HB TYR 651 2HB TYR 651 -15.604 23.557 -13.672 1058 HD1 TYR 651 1HD TYR 651 -12.972 20.893 -13.480 1059 HD2 TYR 651 2HD TYR 651 -16.520 22.563 -11.770 1060 HE1 TYR 651 1HE TYR 651 -12.795 19.282 -11.521 1061 HE2 TYR 651 2HE TYR 651 -16.331 20.947 -9.816 1062 HH TYR 651 HH TYR 651 -15.063 19.485 -8.810 1063 H GLN 652 H GLN 652 -17.833 22.350 -15.012 1064 HA GLN 652 HA GLN 652 -18.369 20.020 -13.650 1065 1HB GLN 652 1HB GLN 652 -20.025 21.909 -15.333 1066 2HB GLN 652 2HB GLN 652 -20.756 20.438 -14.723 1067 1HG GLN 652 1HG GLN 652 -19.343 21.533 -12.513 1068 2HG GLN 652 2HG GLN 652 -20.108 22.905 -13.291 1069 1HE2 GLN 652 1HE2 GLN 652 -21.223 22.850 -11.158 1070 2HE2 GLN 652 2HE2 GLN 652 -22.692 21.943 -11.019 1071 H GLY 653 H GLY 653 -18.699 20.761 -17.194 1072 1HA GLY 653 2HA GLY 653 -18.697 19.420 -18.996 1073 2HA GLY 653 1HA GLY 653 -19.595 18.270 -18.026 1074 H VAL 654 H VAL 654 -16.391 19.328 -16.941 1075 HA VAL 654 HA VAL 654 -15.038 17.132 -18.206 1076 HB VAL 654 HB VAL 654 -14.242 19.289 -16.253 1077 1HG1 VAL 654 2HG1 VAL 654 -12.982 17.152 -15.837 1078 2HG1 VAL 654 3HG1 VAL 654 -12.379 17.250 -17.509 1079 3HG1 VAL 654 1HG1 VAL 654 -11.968 18.526 -16.339 1080 1HG2 VAL 654 2HG2 VAL 654 -14.592 19.353 -18.995 1081 2HG2 VAL 654 3HG2 VAL 654 -13.600 20.484 -18.042 1082 3HG2 VAL 654 1HG2 VAL 654 -12.842 19.075 -18.823 1083 H GLN 655 H GLN 655 -16.090 18.070 -14.872 1084 HA GLN 655 HA GLN 655 -15.015 15.992 -13.515 1085 1HB GLN 655 1HB GLN 655 -17.157 17.932 -13.115 1086 2HB GLN 655 2HB GLN 655 -17.586 16.401 -12.378 1087 1HG GLN 655 1HG GLN 655 -14.769 17.315 -11.924 1088 2HG GLN 655 2HG GLN 655 -16.014 18.281 -11.158 1089 1HE2 GLN 655 1HE2 GLN 655 -14.523 17.228 -9.405 1090 2HE2 GLN 655 2HE2 GLN 655 -15.159 15.806 -8.647 1091 H GLN 656 H GLN 656 -18.221 16.107 -15.210 1092 HA GLN 656 HA GLN 656 -18.901 13.493 -14.511 1093 1HB GLN 656 1HB GLN 656 -20.785 13.795 -15.911 1094 2HB GLN 656 2HB GLN 656 -20.412 15.415 -15.357 1095 1HG GLN 656 1HG GLN 656 -18.933 15.569 -17.537 1096 2HG GLN 656 2HG GLN 656 -19.860 14.183 -18.076 1097 1HE2 GLN 656 1HE2 GLN 656 -20.594 17.146 -16.232 1098 2HE2 GLN 656 2HE2 GLN 656 -21.921 17.686 -17.205 1099 H LYS 657 H LYS 657 -17.056 14.939 -17.209 1100 HA LYS 657 HA LYS 657 -17.070 12.642 -18.842 1101 1HB LYS 657 1HB LYS 657 -15.559 15.222 -18.732 1102 2HB LYS 657 2HB LYS 657 -14.900 13.922 -19.704 1103 1HG LYS 657 1HG LYS 657 -17.188 13.696 -20.816 1104 2HG LYS 657 2HG LYS 657 -17.693 15.131 -19.946 1105 1HD LYS 657 1HD LYS 657 -15.112 15.514 -21.329 1106 2HD LYS 657 2HD LYS 657 -16.398 15.076 -22.436 1107 1HE LYS 657 1HE LYS 657 -17.827 16.914 -21.440 1108 2HE LYS 657 2HE LYS 657 -16.472 17.383 -20.433 1109 H TRP 658 H TRP 658 -15.249 13.640 -15.982 1110 HA TRP 658 HA TRP 658 -13.116 11.791 -16.398 1111 1HB TRP 658 1HB TRP 658 -12.680 13.752 -15.129 1112 2HB TRP 658 2HB TRP 658 -14.024 13.446 -14.047 1113 HD1 TRP 658 HD TRP 658 -13.529 11.881 -11.945 1114 HE1 TRP 658 1HE TRP 658 -11.427 10.664 -10.913 1115 HE3 TRP 658 3HE TRP 658 -10.503 12.558 -15.975 1116 HZ2 TRP 658 2HZ TRP 658 -8.793 10.133 -11.877 1117 HZ3 TRP 658 3HZ TRP 658 -8.181 11.659 -15.848 1118 HH2 TRP 658 HH TRP 658 -7.314 10.482 -13.889 1119 H ASP 659 H ASP 659 -15.989 11.974 -14.167 1120 HA ASP 659 HA ASP 659 -15.624 9.454 -13.112 1121 1HB ASP 659 1HB ASP 659 -17.363 11.558 -12.708 1122 2HB ASP 659 2HB ASP 659 -18.438 10.396 -13.461 1123 HD2 ASP 659 HD ASP 659 -17.243 10.365 -9.806 1124 H ALA 660 H ALA 660 -17.130 10.662 -16.109 1125 HA ALA 660 HA ALA 660 -18.788 8.566 -16.768 1126 1HB ALA 660 2HB ALA 660 -18.974 10.392 -18.174 1127 2HB ALA 660 3HB ALA 660 -17.213 10.641 -18.263 1128 3HB ALA 660 1HB ALA 660 -17.974 9.326 -19.190 1129 H THR 661 H THR 661 -15.808 8.929 -18.716 1130 HA THR 661 HA THR 661 -15.550 6.248 -19.270 1131 HB THR 661 HB THR 661 -13.329 6.910 -20.090 1132 HG1 THR 661 1HG THR 661 -12.725 8.032 -18.089 1133 1HG2 THR 661 3HG2 THR 661 -15.535 8.150 -21.007 1134 2HG2 THR 661 1HG2 THR 661 -14.780 9.561 -20.226 1135 3HG2 THR 661 2HG2 THR 661 -13.915 8.686 -21.513 1136 H ALA 662 H ALA 662 -14.752 7.968 -16.316 1137 HA ALA 662 HA ALA 662 -12.783 6.317 -15.302 1138 1HB ALA 662 3HB ALA 662 -13.142 8.219 -14.041 1139 2HB ALA 662 2HB ALA 662 -14.047 7.039 -13.064 1140 3HB ALA 662 1HB ALA 662 -14.912 8.116 -14.187 1141 H THR 663 H THR 663 -16.092 6.184 -13.893 1142 HA THR 663 HA THR 663 -15.939 3.633 -12.960 1143 HB THR 663 HB THR 663 -17.775 4.970 -12.258 1144 HG1 THR 663 1HG THR 663 -19.605 3.694 -13.168 1145 1HG2 THR 663 3HG2 THR 663 -17.778 5.850 -15.048 1146 2HG2 THR 663 1HG2 THR 663 -19.409 5.324 -14.568 1147 3HG2 THR 663 2HG2 THR 663 -18.578 6.600 -13.646 1148 H GLU 664 H GLU 664 -16.285 4.663 -16.305 1149 HA GLU 664 HA GLU 664 -17.396 2.290 -17.253 1150 1HB GLU 664 1HB GLU 664 -17.417 4.378 -18.552 1151 2HB GLU 664 2HB GLU 664 -15.667 4.385 -18.639 1152 1HG GLU 664 1HG GLU 664 -16.483 3.497 -20.740 1153 2HG GLU 664 2HG GLU 664 -15.767 2.163 -19.858 1154 HE2 GLU 664 HE GLU 664 -19.406 3.260 -19.829 1155 H LEU 665 H LEU 665 -13.974 3.471 -17.022 1156 HA LEU 665 HA LEU 665 -12.970 0.968 -17.999 1157 1HB LEU 665 1HB LEU 665 -11.985 3.274 -18.380 1158 2HB LEU 665 2HB LEU 665 -11.435 3.223 -16.717 1159 HG LEU 665 HG LEU 665 -9.660 2.617 -18.285 1160 1HD1 LEU 665 3HD1 LEU 665 -10.244 1.382 -15.929 1161 2HD1 LEU 665 1HD1 LEU 665 -10.090 -0.012 -17.024 1162 3HD1 LEU 665 2HD1 LEU 665 -8.746 1.144 -16.860 1163 1HD2 LEU 665 3HD2 LEU 665 -11.149 1.644 -20.030 1164 2HD2 LEU 665 1HD2 LEU 665 -9.722 0.648 -19.655 1165 3HD2 LEU 665 2HD2 LEU 665 -11.320 0.191 -19.016 1166 H ASN 666 H ASN 666 -13.822 2.429 -14.910 1167 HA ASN 666 HA ASN 666 -12.177 0.783 -13.349 1168 1HB ASN 666 1HB ASN 666 -13.758 2.992 -12.870 1169 2HB ASN 666 2HB ASN 666 -14.783 1.736 -12.205 1170 1HD2 ASN 666 1HD2 ASN 666 -13.378 3.878 -10.859 1171 2HD2 ASN 666 2HD2 ASN 666 -12.320 3.165 -9.687 1172 H ASN 667 H ASN 667 -15.759 0.813 -14.057 1173 HA ASN 667 HA ASN 667 -16.354 -1.515 -12.747 1174 1HB ASN 667 1HB ASN 667 -18.470 -1.314 -13.758 1175 2HB ASN 667 2HB ASN 667 -17.864 0.317 -13.963 1176 1HD2 ASN 667 1HD2 ASN 667 -18.041 1.150 -15.889 1177 2HD2 ASN 667 2HD2 ASN 667 -18.111 0.307 -17.401 1178 H ALA 668 H ALA 668 -15.310 -0.857 -16.149 1179 HA ALA 668 HA ALA 668 -15.670 -3.416 -17.170 1180 1HB ALA 668 1HB ALA 668 -15.231 -1.287 -18.441 1181 2HB ALA 668 3HB ALA 668 -14.222 -2.658 -18.958 1182 3HB ALA 668 2HB ALA 668 -13.531 -1.387 -17.922 1183 H LEU 669 H LEU 669 -12.896 -1.887 -15.437 1184 HA LEU 669 HA LEU 669 -11.140 -4.037 -15.757 1185 1HB LEU 669 1HB LEU 669 -11.294 -1.543 -14.263 1186 2HB LEU 669 2HB LEU 669 -10.492 -2.806 -13.351 1187 HG LEU 669 HG LEU 669 -9.668 -2.308 -16.195 1188 1HD1 LEU 669 2HD1 LEU 669 -9.813 -0.119 -14.797 1189 2HD1 LEU 669 3HD1 LEU 669 -8.374 -0.761 -13.969 1190 3HD1 LEU 669 1HD1 LEU 669 -8.337 -0.476 -15.726 1191 1HD2 LEU 669 2HD2 LEU 669 -8.875 -4.203 -14.532 1192 2HD2 LEU 669 3HD2 LEU 669 -7.741 -3.410 -15.650 1193 3HD2 LEU 669 1HD2 LEU 669 -7.800 -2.913 -13.942 1194 H GLN 670 H GLN 670 -13.693 -3.308 -13.336 1195 HA GLN 670 HA GLN 670 -13.002 -5.346 -11.587 1196 1HB GLN 670 1HB GLN 670 -15.370 -3.597 -12.070 1197 2HB GLN 670 2HB GLN 670 -15.707 -5.087 -11.211 1198 1HG GLN 670 1HG GLN 670 -13.339 -4.133 -10.009 1199 2HG GLN 670 2HG GLN 670 -14.286 -2.683 -10.284 1200 1HE2 GLN 670 1HE2 GLN 670 -13.586 -4.838 -8.041 1201 2HE2 GLN 670 2HE2 GLN 670 -15.057 -4.938 -7.132 1202 H ASN 671 H ASN 671 -15.453 -5.226 -14.267 1203 HA ASN 671 HA ASN 671 -16.197 -7.898 -13.915 1204 1HB ASN 671 1HB ASN 671 -17.372 -5.886 -15.199 1205 2HB ASN 671 2HB ASN 671 -16.420 -6.425 -16.568 1206 1HD2 ASN 671 1HD2 ASN 671 -17.600 -7.565 -17.889 1207 2HD2 ASN 671 2HD2 ASN 671 -18.748 -8.797 -17.482 1208 H LEU 672 H LEU 672 -13.587 -6.197 -15.586 1209 HA LEU 672 HA LEU 672 -12.998 -8.307 -17.420 1210 1HB LEU 672 1HB LEU 672 -12.462 -6.139 -18.121 1211 2HB LEU 672 2HB LEU 672 -11.670 -5.738 -16.609 1212 HG LEU 672 HG LEU 672 -10.182 -6.103 -18.633 1213 1HD1 LEU 672 1HD1 LEU 672 -9.582 -6.238 -16.098 1214 2HD1 LEU 672 2HD1 LEU 672 -9.386 -7.977 -16.427 1215 3HD1 LEU 672 3HD1 LEU 672 -8.410 -6.787 -17.321 1216 1HD2 LEU 672 1HD2 LEU 672 -11.549 -8.256 -19.225 1217 2HD2 LEU 672 2HD2 LEU 672 -9.799 -8.184 -19.541 1218 3HD2 LEU 672 3HD2 LEU 672 -10.410 -9.047 -18.109 1219 H ALA 673 H ALA 673 -11.770 -7.171 -14.227 1220 HA ALA 673 HA ALA 673 -9.784 -9.248 -14.166 1221 1HB ALA 673 3HB ALA 673 -9.940 -6.785 -13.064 1222 2HB ALA 673 1HB ALA 673 -10.572 -7.748 -11.707 1223 3HB ALA 673 2HB ALA 673 -8.955 -8.094 -12.368 1224 H ARG 674 H ARG 674 -13.169 -8.942 -13.517 1225 HA ARG 674 HA ARG 674 -13.296 -10.749 -11.385 1226 1HB ARG 674 1HB ARG 674 -15.252 -9.533 -13.335 1227 2HB ARG 674 2HB ARG 674 -15.785 -10.941 -12.439 1228 1HG ARG 674 1HG ARG 674 -14.409 -8.878 -10.786 1229 2HG ARG 674 2HG ARG 674 -15.916 -8.344 -11.503 1230 1HD ARG 674 1HD ARG 674 -17.040 -9.451 -9.871 1231 2HD ARG 674 2HD ARG 674 -16.447 -10.964 -10.528 1232 HE ARG 674 HE ARG 674 -14.912 -11.099 -8.767 1233 2HH1 ARG 674 1HH ARG 674 -13.985 -8.831 -6.304 1234 1HH2 ARG 674 2HH2 ARG 674 -16.069 -7.758 -9.009 1235 2HH2 ARG 674 1HH2 ARG 674 -15.275 -7.247 -7.557 1236 H THR 675 H THR 675 -13.025 -11.043 -14.893 1237 HA THR 675 HA THR 675 -13.618 -13.919 -14.712 1238 HB THR 675 HB THR 675 -13.487 -12.031 -17.123 1239 HG1 THR 675 1HG THR 675 -15.238 -11.793 -15.417 1240 1HG2 THR 675 3HG2 THR 675 -13.141 -14.517 -17.611 1241 2HG2 THR 675 1HG2 THR 675 -14.715 -14.821 -16.837 1242 3HG2 THR 675 2HG2 THR 675 -14.627 -13.839 -18.319 1243 H ILE 676 H ILE 676 -11.064 -11.659 -14.740 1244 HA ILE 676 HA ILE 676 -9.271 -13.514 -16.095 1245 HB ILE 676 HB ILE 676 -9.106 -10.642 -15.246 1246 1HG1 ILE 676 1HG1 ILE 676 -8.874 -12.136 -17.864 1247 2HG1 ILE 676 2HG1 ILE 676 -10.093 -10.970 -17.390 1248 1HG2 ILE 676 1HG2 ILE 676 -6.920 -12.537 -15.249 1249 2HG2 ILE 676 2HG2 ILE 676 -6.673 -11.274 -16.479 1250 3HG2 ILE 676 3HG2 ILE 676 -6.943 -10.820 -14.779 1251 1HD1 ILE 676 2HD1 ILE 676 -7.995 -9.354 -17.073 1252 2HD1 ILE 676 3HD1 ILE 676 -7.223 -10.501 -18.193 1253 3HD1 ILE 676 1HD1 ILE 676 -8.693 -9.626 -18.687 1254 H SER 677 H SER 677 -9.601 -11.740 -12.944 1255 HA SER 677 HA SER 677 -7.502 -12.732 -11.639 1256 1HB SER 677 1HB SER 677 -8.802 -12.451 -9.557 1257 2HB SER 677 2HB SER 677 -9.112 -11.133 -10.670 1258 HG SER 677 HG SER 677 -11.162 -11.658 -10.202 1259 H GLU 678 H GLU 678 -10.446 -14.466 -12.615 1260 HA GLU 678 HA GLU 678 -10.145 -16.631 -10.884 1261 1HB GLU 678 1HB GLU 678 -11.605 -17.794 -12.696 1262 2HB GLU 678 2HB GLU 678 -12.278 -16.408 -11.862 1263 1HG GLU 678 1HG GLU 678 -12.427 -15.217 -13.792 1264 2HG GLU 678 2HG GLU 678 -10.745 -15.517 -14.181 1265 HE2 GLU 678 HE GLU 678 -12.443 -16.350 -16.729 1266 H ALA 679 H ALA 679 -8.755 -15.799 -14.065 1267 HA ALA 679 HA ALA 679 -7.904 -18.169 -15.022 1268 1HB ALA 679 3HB ALA 679 -5.958 -16.876 -15.929 1269 2HB ALA 679 2HB ALA 679 -6.400 -15.527 -14.856 1270 3HB ALA 679 1HB ALA 679 -7.517 -16.043 -16.142 1271 H GLY 680 H GLY 680 -6.848 -16.521 -12.069 1272 1HA GLY 680 2HA GLY 680 -5.669 -17.349 -10.324 1273 2HA GLY 680 1HA GLY 680 -4.398 -17.496 -11.521 1274 H GLN 681 H GLN 681 -7.103 -19.214 -9.906 1275 HA GLN 681 HA GLN 681 -5.835 -21.699 -10.762 1276 1HB GLN 681 1HB GLN 681 -6.825 -22.570 -8.495 1277 2HB GLN 681 2HB GLN 681 -5.338 -21.642 -8.475 1278 1HG GLN 681 1HG GLN 681 -6.365 -19.736 -7.581 1279 2HG GLN 681 2HG GLN 681 -7.929 -20.116 -8.275 1280 1HE2 GLN 681 1HE2 GLN 681 -7.284 -19.378 -5.568 1281 2HE2 GLN 681 2HE2 GLN 681 -7.799 -20.659 -4.523 1282 H ALA 682 H ALA 682 -8.842 -19.913 -9.997 1283 HA ALA 682 HA ALA 682 -10.733 -21.837 -10.161 1284 1HB ALA 682 3HB ALA 682 -10.787 -19.072 -11.439 1285 2HB ALA 682 1HB ALA 682 -12.210 -20.053 -11.015 1286 3HB ALA 682 2HB ALA 682 -11.140 -19.438 -9.733 1287 H MET 683 H MET 683 -9.844 -19.845 -13.068 1288 HA MET 683 HA MET 683 -11.029 -21.262 -14.948 1289 1HB MET 683 1HB MET 683 -9.596 -19.218 -15.288 1290 2HB MET 683 2HB MET 683 -8.155 -20.188 -15.058 1291 1HG MET 683 1HG MET 683 -9.483 -21.613 -17.046 1292 2HG MET 683 2HG MET 683 -9.916 -19.962 -17.442 1293 1HE MET 683 3HE MET 683 -8.289 -22.361 -18.581 1294 2HE MET 683 1HE MET 683 -6.855 -21.707 -19.406 1295 3HE MET 683 2HE MET 683 -6.683 -22.516 -17.830 1296 H ALA 684 H ALA 684 -8.116 -22.256 -13.152 1297 HA ALA 684 HA ALA 684 -7.579 -24.459 -14.918 1298 1HB ALA 684 1HB ALA 684 -6.026 -24.986 -12.835 1299 2HB ALA 684 2HB ALA 684 -5.635 -23.648 -13.942 1300 3HB ALA 684 3HB ALA 684 -6.429 -23.312 -12.384 1301 H SER 685 H SER 685 -8.981 -23.933 -11.623 1302 HA SER 685 HA SER 685 -9.293 -26.374 -10.713 1303 1HB SER 685 1HB SER 685 -11.367 -24.149 -10.806 1304 2HB SER 685 2HB SER 685 -11.610 -25.608 -9.866 1305 HG SER 685 HG SER 685 -9.336 -23.832 -9.584 1306 H THR 686 H THR 686 -12.271 -25.063 -12.267 1307 HA THR 686 HA THR 686 -12.362 -27.009 -14.327 1308 HB THR 686 HB THR 686 -13.517 -27.646 -11.634 1309 HG1 THR 686 1HG THR 686 -11.827 -28.871 -12.751 1310 1HG2 THR 686 3HG2 THR 686 -14.985 -28.081 -14.278 1311 2HG2 THR 686 1HG2 THR 686 -15.205 -29.167 -12.885 1312 3HG2 THR 686 2HG2 THR 686 -15.652 -27.450 -12.753 1313 H GLU 687 H GLU 687 -14.277 -26.803 -15.664 1314 HA GLU 687 HA GLU 687 -15.084 -24.125 -15.765 1315 1HB GLU 687 1HB GLU 687 -16.385 -24.803 -17.714 1316 2HB GLU 687 2HB GLU 687 -14.831 -25.611 -17.759 1317 1HG GLU 687 1HG GLU 687 -16.113 -27.484 -18.117 1318 2HG GLU 687 2HG GLU 687 -16.242 -27.483 -16.369 1319 HE2 GLU 687 HE GLU 687 -18.218 -27.952 -15.958 1320 H GLY 688 H GLY 688 -17.127 -23.151 -15.332 1321 1HA GLY 688 2HA GLY 688 -19.195 -24.820 -14.111 1322 2HA GLY 688 1HA GLY 688 -19.345 -23.159 -14.649 1323 H ASN 689 H ASN 689 -16.382 -23.504 -13.000 1324 HA ASN 689 HA ASN 689 -17.623 -22.952 -10.437 1325 1HB ASN 689 1HB ASN 689 -15.624 -24.677 -10.946 1326 2HB ASN 689 2HB ASN 689 -14.630 -23.239 -10.835 1327 1HD2 ASN 689 1HD2 ASN 689 -15.287 -25.750 -9.140 1328 2HD2 ASN 689 2HD2 ASN 689 -15.454 -25.143 -7.526 1329 H VAL 690 H VAL 690 -16.831 -21.256 -13.115 1330 HA VAL 690 HA VAL 690 -15.091 -19.263 -12.012 1331 HB VAL 690 HB VAL 690 -16.733 -18.887 -14.483 1332 1HG1 VAL 690 1HG1 VAL 690 -14.220 -17.876 -13.328 1333 2HG1 VAL 690 2HG1 VAL 690 -14.110 -18.293 -15.055 1334 3HG1 VAL 690 3HG1 VAL 690 -15.332 -17.125 -14.497 1335 1HG2 VAL 690 1HG2 VAL 690 -14.703 -21.042 -14.027 1336 2HG2 VAL 690 2HG2 VAL 690 -16.171 -21.045 -15.035 1337 3HG2 VAL 690 3HG2 VAL 690 -14.710 -20.197 -15.594 1338 H THR 691 H THR 691 -16.141 -16.839 -12.739 1339 HA THR 691 HA THR 691 -17.628 -16.037 -10.647 1340 HB THR 691 HB THR 691 -17.308 -15.107 -13.510 1341 HG1 THR 691 1HG THR 691 -16.331 -13.370 -12.162 1342 1HG2 THR 691 1HG2 THR 691 -19.016 -13.732 -11.369 1343 2HG2 THR 691 2HG2 THR 691 -18.524 -13.013 -12.921 1344 3HG2 THR 691 3HG2 THR 691 -19.638 -14.401 -12.897 1345 H GLY 692 H GLY 692 -18.917 -17.446 -13.700 1346 1HA GLY 692 2HA GLY 692 -20.862 -18.573 -14.003 1347 2HA GLY 692 1HA GLY 692 -21.561 -17.041 -13.517 1348 H MET 693 H MET 693 -19.579 -19.072 -11.332 1349 HA MET 693 HA MET 693 -21.997 -20.007 -10.049 1350 1HB MET 693 1HB MET 693 -19.526 -21.188 -10.602 1351 2HB MET 693 2HB MET 693 -19.325 -20.737 -8.920 1352 1HG MET 693 1HG MET 693 -21.489 -21.918 -8.373 1353 2HG MET 693 2HG MET 693 -21.619 -22.416 -10.048 1354 1HE MET 693 1HE MET 693 -21.767 -24.693 -9.757 1355 2HE MET 693 2HE MET 693 -20.539 -25.825 -9.142 1356 3HE MET 693 3HE MET 693 -21.564 -24.920 -8.003 1357 H PHE 694 H PHE 694 -18.788 -18.647 -8.981 1358 HA PHE 694 HA PHE 694 -19.330 -18.067 -6.433 1359 1HB PHE 694 1HB PHE 694 -18.046 -16.202 -8.520 1360 2HB PHE 694 2HB PHE 694 -17.720 -16.148 -6.799 1361 HD1 PHE 694 1HD PHE 694 -17.422 -19.020 -6.165 1362 HD2 PHE 694 2HD PHE 694 -16.014 -16.784 -9.485 1363 HE1 PHE 694 1HE PHE 694 -15.542 -20.655 -6.469 1364 HE2 PHE 694 2HE PHE 694 -14.134 -18.419 -9.790 1365 HZ PHE 694 HZ PHE 694 -13.921 -20.335 -8.278 1366 H ALA 695 H ALA 695 -21.150 -17.214 -5.530 1367 HA ALA 695 HA ALA 695 -23.037 -15.698 -6.752 1368 1HB ALA 695 1HB ALA 695 -22.124 -16.137 -3.939 1369 2HB ALA 695 3HB ALA 695 -23.711 -16.441 -4.687 1370 3HB ALA 695 2HB ALA 695 -23.247 -14.786 -4.224 No H/Q in entry = 1370 Start of MODEL 24 1 H ALA 1 H ALA 1 -9.213 33.439 -1.263 2 HA ALA 1 HA ALA 1 -6.575 34.696 -1.594 3 1HB ALA 1 3HB ALA 1 -7.565 31.877 -1.708 4 2HB ALA 1 1HB ALA 1 -6.320 32.345 -2.890 5 3HB ALA 1 2HB ALA 1 -6.003 32.519 -1.147 6 H GLU 2 H GLU 2 -5.819 34.246 -4.050 7 HA GLU 2 HA GLU 2 -8.107 34.818 -5.753 8 1HB GLU 2 1HB GLU 2 -5.540 36.412 -5.486 9 2HB GLU 2 2HB GLU 2 -6.455 36.442 -6.980 10 1HG GLU 2 1HG GLU 2 -8.379 36.804 -4.913 11 2HG GLU 2 2HG GLU 2 -7.014 37.802 -4.455 12 HE2 GLU 2 HE GLU 2 -7.825 40.223 -6.529 13 H MET 3 H MET 3 -4.635 33.861 -5.480 14 HA MET 3 HA MET 3 -4.501 32.923 -8.125 15 1HB MET 3 1HB MET 3 -2.805 32.164 -5.681 16 2HB MET 3 2HB MET 3 -2.325 31.964 -7.355 17 1HG MET 3 1HG MET 3 -2.914 34.642 -5.999 18 2HG MET 3 2HG MET 3 -1.315 34.013 -6.341 19 1HE MET 3 3HE MET 3 -3.144 36.559 -7.038 20 2HE MET 3 1HE MET 3 -3.186 36.909 -8.783 21 3HE MET 3 2HE MET 3 -4.460 35.909 -8.045 22 H LYS 4 H LYS 4 -6.678 31.701 -7.910 23 HA LYS 4 HA LYS 4 -6.295 29.100 -6.633 24 1HB LYS 4 1HB LYS 4 -8.711 28.856 -6.840 25 2HB LYS 4 2HB LYS 4 -8.303 30.340 -6.002 26 1HG LYS 4 1HG LYS 4 -8.369 31.148 -8.681 27 2HG LYS 4 2HG LYS 4 -9.659 29.965 -8.605 28 1HD LYS 4 1HD LYS 4 -10.808 31.166 -6.861 29 2HD LYS 4 2HD LYS 4 -9.410 32.165 -6.516 30 1HE LYS 4 1HE LYS 4 -9.788 33.575 -8.321 31 2HE LYS 4 2HE LYS 4 -10.438 32.296 -9.328 32 H THR 5 H THR 5 -6.458 30.764 -9.734 33 HA THR 5 HA THR 5 -6.445 28.144 -11.080 34 HB THR 5 HB THR 5 -7.363 29.374 -13.013 35 HG1 THR 5 1HG THR 5 -7.713 31.740 -12.577 36 1HG2 THR 5 1HG2 THR 5 -8.693 30.106 -10.357 37 2HG2 THR 5 2HG2 THR 5 -9.412 30.500 -11.937 38 3HG2 THR 5 3HG2 THR 5 -9.160 28.800 -11.473 39 H ASP 6 H ASP 6 -4.483 30.714 -10.030 40 HA ASP 6 HA ASP 6 -2.836 31.359 -11.977 41 1HB ASP 6 1HB ASP 6 -2.672 31.118 -9.132 42 2HB ASP 6 2HB ASP 6 -1.199 30.405 -9.759 43 HD2 ASP 6 HD ASP 6 0.407 32.355 -9.624 44 H ALA 7 H ALA 7 -0.838 30.430 -12.929 45 HA ALA 7 HA ALA 7 -1.073 27.671 -13.498 46 1HB ALA 7 2HB ALA 7 0.748 29.944 -14.194 47 2HB ALA 7 3HB ALA 7 1.362 28.293 -14.445 48 3HB ALA 7 1HB ALA 7 -0.132 28.819 -15.256 49 H ALA 8 H ALA 8 0.613 29.589 -11.054 50 HA ALA 8 HA ALA 8 2.531 27.593 -10.408 51 1HB ALA 8 1HB ALA 8 2.325 29.175 -8.184 52 2HB ALA 8 3HB ALA 8 1.648 30.252 -9.428 53 3HB ALA 8 2HB ALA 8 3.289 29.590 -9.621 54 H THR 9 H THR 9 -0.710 28.575 -9.148 55 HA THR 9 HA THR 9 -0.683 26.665 -7.043 56 HB THR 9 HB THR 9 -2.019 28.853 -7.203 57 HG1 THR 9 1HG THR 9 -3.338 26.248 -6.881 58 1HG2 THR 9 3HG2 THR 9 -3.499 27.116 -9.217 59 2HG2 THR 9 1HG2 THR 9 -4.387 28.300 -8.228 60 3HG2 THR 9 2HG2 THR 9 -3.100 28.847 -9.329 61 H LEU 10 H LEU 10 -1.588 26.594 -10.475 62 HA LEU 10 HA LEU 10 -3.063 24.172 -10.238 63 1HB LEU 10 1HB LEU 10 -1.999 25.831 -12.499 64 2HB LEU 10 2HB LEU 10 -2.639 24.229 -12.803 65 HG LEU 10 HG LEU 10 -4.104 26.624 -11.683 66 1HD1 LEU 10 3HD1 LEU 10 -3.750 26.417 -14.165 67 2HD1 LEU 10 1HD1 LEU 10 -4.738 24.937 -14.113 68 3HD1 LEU 10 2HD1 LEU 10 -5.449 26.500 -13.642 69 1HD2 LEU 10 3HD2 LEU 10 -4.779 23.722 -11.508 70 2HD2 LEU 10 1HD2 LEU 10 -5.121 25.054 -10.378 71 3HD2 LEU 10 2HD2 LEU 10 -6.090 24.874 -11.860 72 H ALA 11 H ALA 11 0.218 25.001 -11.566 73 HA ALA 11 HA ALA 11 1.007 22.414 -12.093 74 1HB ALA 11 2HB ALA 11 2.439 24.984 -11.404 75 2HB ALA 11 3HB ALA 11 3.355 23.478 -11.653 76 3HB ALA 11 1HB ALA 11 2.344 24.132 -12.964 77 H GLN 12 H GLN 12 0.656 24.144 -9.029 78 HA GLN 12 HA GLN 12 2.361 22.487 -7.554 79 1HB GLN 12 1HB GLN 12 0.854 24.811 -7.095 80 2HB GLN 12 2HB GLN 12 0.116 23.629 -6.033 81 1HG GLN 12 1HG GLN 12 1.942 23.538 -4.657 82 2HG GLN 12 2HG GLN 12 3.070 23.498 -5.998 83 1HE2 GLN 12 1HE2 GLN 12 3.034 25.638 -7.323 84 2HE2 GLN 12 2HE2 GLN 12 3.198 27.096 -6.402 85 H GLU 13 H GLU 13 -1.066 22.309 -8.540 86 HA GLU 13 HA GLU 13 -1.365 19.927 -6.912 87 1HB GLU 13 1HB GLU 13 -3.478 21.431 -8.516 88 2HB GLU 13 2HB GLU 13 -3.774 20.148 -7.360 89 1HG GLU 13 1HG GLU 13 -2.416 22.788 -6.645 90 2HG GLU 13 2HG GLU 13 -4.132 22.494 -6.447 91 HE2 GLU 13 HE GLU 13 -2.554 19.693 -4.276 92 H ALA 14 H ALA 14 -1.644 21.137 -10.307 93 HA ALA 14 HA ALA 14 -2.465 18.811 -11.517 94 1HB ALA 14 1HB ALA 14 -2.012 21.260 -12.388 95 2HB ALA 14 2HB ALA 14 -0.411 20.603 -12.803 96 3HB ALA 14 3HB ALA 14 -1.879 19.879 -13.503 97 H GLY 15 H GLY 15 0.881 19.917 -10.688 98 1HA GLY 15 2HA GLY 15 2.758 18.727 -10.324 99 2HA GLY 15 1HA GLY 15 2.375 17.947 -11.846 100 H ASN 16 H ASN 16 0.191 17.718 -9.036 101 HA ASN 16 HA ASN 16 1.303 15.207 -8.253 102 1HB ASN 16 1HB ASN 16 0.415 16.107 -6.324 103 2HB ASN 16 2HB ASN 16 -0.680 17.152 -7.209 104 1HD2 ASN 16 1HD2 ASN 16 -2.636 16.811 -6.478 105 2HD2 ASN 16 2HD2 ASN 16 -3.421 15.283 -6.260 106 H PHE 17 H PHE 17 -1.392 16.554 -10.164 107 HA PHE 17 HA PHE 17 -2.922 14.168 -10.248 108 1HB PHE 17 1HB PHE 17 -3.846 16.451 -10.638 109 2HB PHE 17 2HB PHE 17 -2.715 16.721 -11.949 110 HD1 PHE 17 1HD PHE 17 -5.586 14.585 -10.947 111 HD2 PHE 17 2HD PHE 17 -3.306 16.187 -14.147 112 HE1 PHE 17 1HE PHE 17 -7.277 13.718 -12.586 113 HE2 PHE 17 2HE PHE 17 -4.998 15.320 -15.786 114 HZ PHE 17 HZ PHE 17 -6.963 14.096 -14.986 115 H GLU 18 H GLU 18 -0.795 15.855 -12.671 116 HA GLU 18 HA GLU 18 -0.990 14.247 -14.746 117 1HB GLU 18 1HB GLU 18 1.257 15.789 -13.546 118 2HB GLU 18 2HB GLU 18 1.742 14.583 -14.721 119 1HG GLU 18 1HG GLU 18 0.773 15.705 -16.484 120 2HG GLU 18 2HG GLU 18 -0.615 16.208 -15.541 121 HE2 GLU 18 HE GLU 18 0.773 19.227 -16.089 122 H ARG 19 H ARG 19 0.694 13.473 -11.680 123 HA ARG 19 HA ARG 19 1.953 11.184 -12.618 124 1HB ARG 19 1HB ARG 19 1.995 12.626 -10.275 125 2HB ARG 19 2HB ARG 19 1.065 11.235 -9.756 126 1HG ARG 19 1HG ARG 19 2.828 9.709 -10.235 127 2HG ARG 19 2HG ARG 19 3.636 10.829 -11.313 128 1HD ARG 19 1HD ARG 19 3.708 12.299 -9.005 129 2HD ARG 19 2HD ARG 19 3.708 10.687 -8.318 130 HE ARG 19 HE ARG 19 5.609 10.590 -10.376 131 2HH1 ARG 19 1HH ARG 19 8.421 11.809 -8.741 132 1HH2 ARG 19 2HH2 ARG 19 5.166 12.495 -7.422 133 2HH2 ARG 19 1HH2 ARG 19 6.862 12.745 -7.180 134 H ILE 20 H ILE 20 -1.233 11.784 -11.018 135 HA ILE 20 HA ILE 20 -1.940 9.086 -10.743 136 HB ILE 20 HB ILE 20 -3.710 11.519 -11.006 137 1HG1 ILE 20 1HG1 ILE 20 -2.808 10.308 -8.402 138 2HG1 ILE 20 2HG1 ILE 20 -1.798 11.479 -9.226 139 1HG2 ILE 20 2HG2 ILE 20 -4.802 9.261 -11.262 140 2HG2 ILE 20 3HG2 ILE 20 -4.298 8.911 -9.591 141 3HG2 ILE 20 1HG2 ILE 20 -5.408 10.262 -9.922 142 1HD1 ILE 20 1HD1 ILE 20 -4.131 12.826 -9.390 143 2HD1 ILE 20 2HD1 ILE 20 -4.487 11.852 -7.943 144 3HD1 ILE 20 3HD1 ILE 20 -3.076 12.938 -7.961 145 H SER 21 H SER 21 -2.593 11.534 -13.327 146 HA SER 21 HA SER 21 -4.178 9.900 -14.868 147 1HB SER 21 1HB SER 21 -2.755 11.529 -16.675 148 2HB SER 21 2HB SER 21 -4.299 11.890 -15.929 149 HG SER 21 HG SER 21 -2.934 13.605 -15.415 150 H GLY 22 H GLY 22 -0.600 10.522 -15.020 151 1HA GLY 22 2HA GLY 22 1.090 9.296 -15.850 152 2HA GLY 22 1HA GLY 22 0.014 8.888 -17.172 153 H ASP 23 H ASP 23 0.029 8.090 -13.620 154 HA ASP 23 HA ASP 23 0.796 5.470 -13.974 155 1HB ASP 23 1HB ASP 23 -0.641 7.020 -11.819 156 2HB ASP 23 2HB ASP 23 -0.605 5.274 -11.681 157 HD2 ASP 23 HD ASP 23 1.675 8.023 -11.818 158 H LEU 24 H LEU 24 -2.356 7.146 -14.144 159 HA LEU 24 HA LEU 24 -4.024 4.920 -13.892 160 1HB LEU 24 1HB LEU 24 -4.221 7.723 -14.575 161 2HB LEU 24 2HB LEU 24 -5.264 6.762 -15.604 162 HG LEU 24 HG LEU 24 -5.285 6.824 -12.575 163 1HD1 LEU 24 2HD1 LEU 24 -6.758 8.277 -14.666 164 2HD1 LEU 24 3HD1 LEU 24 -7.787 7.534 -13.419 165 3HD1 LEU 24 1HD1 LEU 24 -6.499 8.669 -12.949 166 1HD2 LEU 24 3HD2 LEU 24 -5.964 4.658 -14.140 167 2HD2 LEU 24 1HD2 LEU 24 -6.551 4.988 -12.492 168 3HD2 LEU 24 2HD2 LEU 24 -7.523 5.483 -13.900 169 H LYS 25 H LYS 25 -2.321 6.387 -16.701 170 HA LYS 25 HA LYS 25 -3.556 4.611 -18.559 171 1HB LYS 25 1HB LYS 25 -1.013 6.133 -19.079 172 2HB LYS 25 2HB LYS 25 -2.304 5.720 -20.190 173 1HG LYS 25 1HG LYS 25 -3.369 7.304 -17.981 174 2HG LYS 25 2HG LYS 25 -2.005 8.134 -18.703 175 1HD LYS 25 1HD LYS 25 -4.328 6.993 -20.323 176 2HD LYS 25 2HD LYS 25 -4.262 8.654 -19.769 177 1HE LYS 25 1HE LYS 25 -2.309 7.286 -21.674 178 2HE LYS 25 2HE LYS 25 -3.436 8.567 -22.069 179 H THR 26 H THR 26 -0.531 4.704 -16.639 180 HA THR 26 HA THR 26 0.778 2.601 -17.935 181 HB THR 26 HB THR 26 0.862 3.902 -15.188 182 HG1 THR 26 1HG THR 26 1.970 5.020 -16.822 183 1HG2 THR 26 1HG2 THR 26 2.227 1.365 -16.114 184 2HG2 THR 26 2HG2 THR 26 3.182 2.548 -15.189 185 3HG2 THR 26 3HG2 THR 26 1.719 1.831 -14.473 186 H GLN 27 H GLN 27 -1.590 2.599 -15.216 187 HA GLN 27 HA GLN 27 -1.361 -0.166 -14.827 188 1HB GLN 27 1HB GLN 27 -3.577 1.789 -14.074 189 2HB GLN 27 2HB GLN 27 -3.490 0.136 -13.499 190 1HG GLN 27 1HG GLN 27 -1.212 2.127 -13.110 191 2HG GLN 27 2HG GLN 27 -2.506 1.938 -11.943 192 1HE2 GLN 27 1HE2 GLN 27 0.468 0.808 -13.062 193 2HE2 GLN 27 2HE2 GLN 27 0.622 -0.629 -12.107 194 H ILE 28 H ILE 28 -3.635 1.932 -16.693 195 HA ILE 28 HA ILE 28 -5.419 -0.043 -17.449 196 HB ILE 28 HB ILE 28 -4.562 2.579 -18.625 197 1HG1 ILE 28 1HG1 ILE 28 -7.145 1.608 -17.364 198 2HG1 ILE 28 2HG1 ILE 28 -5.916 2.574 -16.570 199 1HG2 ILE 28 1HG2 ILE 28 -6.609 0.679 -19.801 200 2HG2 ILE 28 2HG2 ILE 28 -6.412 2.388 -20.256 201 3HG2 ILE 28 3HG2 ILE 28 -5.095 1.229 -20.558 202 1HD1 ILE 28 1HD1 ILE 28 -6.238 4.254 -18.552 203 2HD1 ILE 28 2HD1 ILE 28 -7.751 3.365 -18.852 204 3HD1 ILE 28 3HD1 ILE 28 -7.494 4.183 -17.292 205 H ASP 29 H ASP 29 -2.526 1.215 -19.257 206 HA ASP 29 HA ASP 29 -2.708 -0.521 -21.345 207 1HB ASP 29 1HB ASP 29 -0.952 1.447 -20.524 208 2HB ASP 29 2HB ASP 29 0.052 0.022 -20.341 209 HD2 ASP 29 HD ASP 29 -1.343 2.129 -22.504 210 H GLN 30 H GLN 30 -1.217 -0.877 -18.080 211 HA GLN 30 HA GLN 30 0.201 -3.172 -18.491 212 1HB GLN 30 1HB GLN 30 -1.015 -1.781 -16.153 213 2HB GLN 30 2HB GLN 30 -0.664 -3.479 -15.899 214 1HG GLN 30 1HG GLN 30 1.676 -3.181 -16.433 215 2HG GLN 30 2HG GLN 30 1.399 -1.582 -17.093 216 1HE2 GLN 30 1HE2 GLN 30 2.775 -0.512 -15.769 217 2HE2 GLN 30 2HE2 GLN 30 2.531 -0.285 -14.069 218 H VAL 31 H VAL 31 -3.272 -2.760 -17.549 219 HA VAL 31 HA VAL 31 -3.777 -5.522 -17.330 220 HB VAL 31 HB VAL 31 -5.478 -3.061 -17.666 221 1HG1 VAL 31 3HG1 VAL 31 -6.259 -5.886 -17.997 222 2HG1 VAL 31 1HG1 VAL 31 -7.242 -4.981 -16.821 223 3HG1 VAL 31 2HG1 VAL 31 -7.094 -4.396 -18.496 224 1HG2 VAL 31 1HG2 VAL 31 -4.164 -4.095 -15.480 225 2HG2 VAL 31 2HG2 VAL 31 -5.576 -3.012 -15.420 226 3HG2 VAL 31 3HG2 VAL 31 -5.798 -4.774 -15.297 227 H GLU 32 H GLU 32 -4.508 -3.108 -19.948 228 HA GLU 32 HA GLU 32 -5.673 -4.749 -21.714 229 1HB GLU 32 1HB GLU 32 -3.948 -2.314 -21.942 230 2HB GLU 32 2HB GLU 32 -4.208 -3.213 -23.424 231 1HG GLU 32 1HG GLU 32 -6.739 -3.176 -22.798 232 2HG GLU 32 2HG GLU 32 -6.309 -1.957 -21.615 233 HE2 GLU 32 HE GLU 32 -7.674 -0.432 -23.439 234 H SER 33 H SER 33 -2.132 -4.356 -21.127 235 HA SER 33 HA SER 33 -1.427 -6.106 -23.214 236 1HB SER 33 1HB SER 33 -0.095 -4.442 -21.245 237 2HB SER 33 2HB SER 33 0.654 -6.027 -21.252 238 HG SER 33 HG SER 33 0.829 -4.011 -23.123 239 H THR 34 H THR 34 -1.469 -6.404 -19.586 240 HA THR 34 HA THR 34 -0.701 -9.058 -19.438 241 HB THR 34 HB THR 34 -2.154 -7.049 -17.739 242 HG1 THR 34 1HG THR 34 0.008 -7.192 -17.236 243 1HG2 THR 34 3HG2 THR 34 -3.451 -9.228 -17.402 244 2HG2 THR 34 1HG2 THR 34 -1.910 -9.999 -16.957 245 3HG2 THR 34 2HG2 THR 34 -2.565 -8.679 -15.959 246 H ALA 35 H ALA 35 -3.968 -7.642 -19.961 247 HA ALA 35 HA ALA 35 -5.433 -9.957 -19.694 248 1HB ALA 35 1HB ALA 35 -6.167 -8.053 -21.875 249 2HB ALA 35 3HB ALA 35 -5.978 -7.370 -20.242 250 3HB ALA 35 2HB ALA 35 -7.146 -8.682 -20.529 251 H GLY 36 H GLY 36 -3.241 -8.888 -22.271 252 1HA GLY 36 2HA GLY 36 -2.391 -10.012 -24.027 253 2HA GLY 36 1HA GLY 36 -4.063 -10.341 -24.437 254 H SER 37 H SER 37 -1.980 -11.468 -21.678 255 HA SER 37 HA SER 37 -1.681 -14.032 -22.736 256 1HB SER 37 1HB SER 37 -1.535 -13.424 -19.772 257 2HB SER 37 2HB SER 37 -0.569 -14.552 -20.702 258 HG SER 37 HG SER 37 0.737 -12.753 -20.308 259 H LEU 38 H LEU 38 -4.253 -12.416 -20.987 260 HA LEU 38 HA LEU 38 -5.410 -14.827 -19.952 261 1HB LEU 38 1HB LEU 38 -6.093 -11.920 -19.977 262 2HB LEU 38 2HB LEU 38 -7.369 -13.078 -19.659 263 HG LEU 38 HG LEU 38 -6.730 -12.709 -17.521 264 1HD1 LEU 38 1HD1 LEU 38 -6.251 -15.102 -18.036 265 2HD1 LEU 38 2HD1 LEU 38 -4.535 -14.671 -18.231 266 3HD1 LEU 38 3HD1 LEU 38 -5.333 -14.455 -16.655 267 1HD2 LEU 38 3HD2 LEU 38 -4.063 -11.945 -18.674 268 2HD2 LEU 38 1HD2 LEU 38 -5.202 -10.982 -17.701 269 3HD2 LEU 38 2HD2 LEU 38 -4.235 -12.263 -16.931 270 H GLN 39 H GLN 39 -6.549 -12.362 -22.376 271 HA GLN 39 HA GLN 39 -8.599 -13.846 -23.349 272 1HB GLN 39 1HB GLN 39 -8.056 -12.489 -25.555 273 2HB GLN 39 2HB GLN 39 -8.585 -11.647 -24.111 274 1HG GLN 39 1HG GLN 39 -5.701 -11.994 -24.002 275 2HG GLN 39 2HG GLN 39 -6.133 -11.295 -25.549 276 1HE2 GLN 39 1HE2 GLN 39 -7.852 -10.988 -22.475 277 2HE2 GLN 39 2HE2 GLN 39 -7.652 -9.280 -22.268 278 H GLY 40 H GLY 40 -5.166 -14.365 -23.717 279 1HA GLY 40 2HA GLY 40 -3.976 -15.605 -25.253 280 2HA GLY 40 1HA GLY 40 -5.452 -16.004 -26.109 281 H GLN 41 H GLN 41 -5.809 -16.340 -22.688 282 HA GLN 41 HA GLN 41 -5.471 -19.215 -23.012 283 1HB GLN 41 1HB GLN 41 -4.422 -17.406 -20.836 284 2HB GLN 41 2HB GLN 41 -4.890 -19.041 -20.412 285 1HG GLN 41 1HG GLN 41 -2.638 -19.351 -20.979 286 2HG GLN 41 2HG GLN 41 -3.423 -19.741 -22.497 287 1HE2 GLN 41 1HE2 GLN 41 -1.533 -17.431 -20.720 288 2HE2 GLN 41 2HE2 GLN 41 -1.050 -16.422 -22.042 289 H TRP 42 H TRP 42 -7.615 -19.839 -23.156 290 HA TRP 42 HA TRP 42 -9.201 -19.534 -20.787 291 1HB TRP 42 1HB TRP 42 -10.065 -18.190 -23.352 292 2HB TRP 42 2HB TRP 42 -11.148 -18.562 -22.025 293 HD1 TRP 42 HD TRP 42 -9.360 -15.686 -23.250 294 HE1 TRP 42 1HE TRP 42 -8.829 -13.842 -21.440 295 HE3 TRP 42 3HE TRP 42 -10.203 -18.659 -19.212 296 HZ2 TRP 42 2HZ TRP 42 -8.821 -13.833 -18.586 297 HZ3 TRP 42 3HZ TRP 42 -9.911 -17.654 -16.949 298 HH2 TRP 42 HH TRP 42 -9.244 -15.329 -16.601 299 H ARG 43 H ARG 43 -11.523 -20.619 -21.446 300 HA ARG 43 HA ARG 43 -10.871 -22.810 -23.244 301 1HB ARG 43 1HB ARG 43 -12.198 -24.314 -21.682 302 2HB ARG 43 2HB ARG 43 -10.705 -23.712 -20.989 303 1HG ARG 43 1HG ARG 43 -12.284 -23.355 -19.261 304 2HG ARG 43 2HG ARG 43 -12.142 -21.774 -20.004 305 1HD ARG 43 1HD ARG 43 -14.233 -21.973 -21.134 306 2HD ARG 43 2HD ARG 43 -14.258 -23.719 -20.985 307 HE ARG 43 HE ARG 43 -15.204 -21.813 -19.016 308 2HH1 ARG 43 1HH ARG 43 -15.702 -24.135 -16.481 309 1HH2 ARG 43 2HH2 ARG 43 -13.730 -25.019 -19.333 310 2HH2 ARG 43 1HH2 ARG 43 -14.354 -25.592 -17.822 311 H GLY 44 H GLY 44 -12.413 -20.215 -23.549 312 1HA GLY 44 2HA GLY 44 -14.979 -21.417 -24.374 313 2HA GLY 44 1HA GLY 44 -14.193 -20.041 -25.121 314 H ALA 45 H ALA 45 -16.163 -21.171 -22.400 315 HA ALA 45 HA ALA 45 -17.604 -18.920 -22.065 316 1HB ALA 45 1HB ALA 45 -18.253 -19.827 -19.948 317 2HB ALA 45 2HB ALA 45 -17.867 -21.220 -20.987 318 3HB ALA 45 3HB ALA 45 -16.701 -20.677 -19.756 319 H ALA 46 H ALA 46 -14.858 -19.783 -19.836 320 HA ALA 46 HA ALA 46 -14.686 -17.328 -18.621 321 1HB ALA 46 2HB ALA 46 -12.073 -18.294 -18.699 322 2HB ALA 46 3HB ALA 46 -13.310 -18.714 -17.491 323 3HB ALA 46 1HB ALA 46 -13.065 -19.756 -18.913 324 H GLY 47 H GLY 47 -13.648 -18.358 -21.842 325 1HA GLY 47 2HA GLY 47 -12.527 -17.296 -23.488 326 2HA GLY 47 1HA GLY 47 -11.798 -16.238 -22.296 327 H THR 48 H THR 48 -15.063 -16.877 -23.775 328 HA THR 48 HA THR 48 -15.360 -14.376 -24.902 329 HB THR 48 HB THR 48 -17.871 -15.065 -24.729 330 HG1 THR 48 1HG THR 48 -17.914 -16.484 -22.989 331 1HG2 THR 48 3HG2 THR 48 -16.324 -15.787 -26.647 332 2HG2 THR 48 1HG2 THR 48 -15.979 -17.261 -25.710 333 3HG2 THR 48 2HG2 THR 48 -17.634 -16.935 -26.278 334 H ALA 49 H ALA 49 -15.709 -15.377 -21.533 335 HA ALA 49 HA ALA 49 -17.250 -13.124 -20.756 336 1HB ALA 49 3HB ALA 49 -15.581 -15.201 -19.306 337 2HB ALA 49 1HB ALA 49 -16.413 -13.884 -18.447 338 3HB ALA 49 2HB ALA 49 -17.354 -15.066 -19.387 339 H ALA 50 H ALA 50 -13.732 -13.996 -20.506 340 HA ALA 50 HA ALA 50 -13.063 -11.411 -19.506 341 1HB ALA 50 3HB ALA 50 -11.150 -12.475 -18.979 342 2HB ALA 50 1HB ALA 50 -11.890 -13.958 -19.629 343 3HB ALA 50 2HB ALA 50 -10.867 -12.942 -20.673 344 H GLN 51 H GLN 51 -12.289 -13.158 -22.606 345 HA GLN 51 HA GLN 51 -11.096 -11.211 -23.944 346 1HB GLN 51 1HB GLN 51 -11.308 -13.228 -25.111 347 2HB GLN 51 2HB GLN 51 -13.027 -13.360 -24.797 348 1HG GLN 51 1HG GLN 51 -12.136 -11.007 -26.442 349 2HG GLN 51 2HG GLN 51 -12.026 -12.583 -27.201 350 1HE2 GLN 51 1HE2 GLN 51 -14.019 -10.003 -26.331 351 2HE2 GLN 51 2HE2 GLN 51 -15.566 -10.669 -26.738 352 H ALA 52 H ALA 52 -14.648 -11.513 -23.407 353 HA ALA 52 HA ALA 52 -15.287 -9.271 -25.030 354 1HB ALA 52 3HB ALA 52 -16.850 -11.130 -24.549 355 2HB ALA 52 2HB ALA 52 -17.525 -9.562 -24.044 356 3HB ALA 52 1HB ALA 52 -16.854 -10.676 -22.828 357 H ALA 53 H ALA 53 -14.721 -9.844 -21.513 358 HA ALA 53 HA ALA 53 -15.481 -7.332 -20.617 359 1HB ALA 53 3HB ALA 53 -13.183 -8.904 -19.437 360 2HB ALA 53 2HB ALA 53 -14.847 -9.530 -19.363 361 3HB ALA 53 1HB ALA 53 -14.448 -7.970 -18.605 362 H VAL 54 H VAL 54 -12.134 -8.547 -21.381 363 HA VAL 54 HA VAL 54 -10.867 -6.116 -21.084 364 HB VAL 54 HB VAL 54 -9.366 -7.782 -21.227 365 1HG1 VAL 54 1HG1 VAL 54 -11.364 -9.082 -23.039 366 2HG1 VAL 54 2HG1 VAL 54 -9.674 -9.637 -23.102 367 3HG1 VAL 54 3HG1 VAL 54 -10.576 -9.704 -21.569 368 1HG2 VAL 54 2HG2 VAL 54 -9.627 -6.988 -24.145 369 2HG2 VAL 54 3HG2 VAL 54 -8.589 -6.238 -22.908 370 3HG2 VAL 54 1HG2 VAL 54 -8.254 -7.895 -23.466 371 H VAL 55 H VAL 55 -12.692 -7.488 -23.847 372 HA VAL 55 HA VAL 55 -11.891 -5.663 -25.777 373 HB VAL 55 HB VAL 55 -14.175 -7.501 -25.314 374 1HG1 VAL 55 2HG1 VAL 55 -14.279 -5.160 -27.218 375 2HG1 VAL 55 3HG1 VAL 55 -15.152 -6.674 -27.556 376 3HG1 VAL 55 1HG1 VAL 55 -15.522 -5.743 -26.085 377 1HG2 VAL 55 2HG2 VAL 55 -11.994 -8.130 -26.409 378 2HG2 VAL 55 3HG2 VAL 55 -13.447 -8.478 -27.377 379 3HG2 VAL 55 1HG2 VAL 55 -12.439 -7.063 -27.762 380 H ARG 56 H ARG 56 -14.761 -5.576 -23.548 381 HA ARG 56 HA ARG 56 -15.603 -3.094 -24.415 382 1HB ARG 56 1HB ARG 56 -16.119 -4.872 -22.057 383 2HB ARG 56 2HB ARG 56 -16.538 -3.186 -21.831 384 1HG ARG 56 1HG ARG 56 -18.476 -4.435 -22.715 385 2HG ARG 56 2HG ARG 56 -17.946 -3.235 -23.878 386 1HD ARG 56 1HD ARG 56 -16.501 -5.733 -24.319 387 2HD ARG 56 2HD ARG 56 -18.225 -6.046 -24.294 388 HE ARG 56 HE ARG 56 -17.451 -3.710 -25.908 389 2HH1 ARG 56 1HH ARG 56 -18.211 -5.259 -28.922 390 1HH2 ARG 56 2HH2 ARG 56 -18.053 -7.202 -25.921 391 2HH2 ARG 56 1HH2 ARG 56 -18.344 -7.271 -27.627 392 H PHE 57 H PHE 57 -13.583 -4.099 -21.569 393 HA PHE 57 HA PHE 57 -13.248 -1.601 -20.453 394 1HB PHE 57 1HB PHE 57 -12.392 -3.350 -19.136 395 2HB PHE 57 2HB PHE 57 -11.911 -4.286 -20.537 396 HD1 PHE 57 1HD PHE 57 -10.909 -1.479 -18.351 397 HD2 PHE 57 2HD PHE 57 -9.679 -4.239 -21.330 398 HE1 PHE 57 1HE PHE 57 -8.516 -0.831 -17.963 399 HE2 PHE 57 2HE PHE 57 -7.285 -3.590 -20.942 400 HZ PHE 57 HZ PHE 57 -6.732 -1.894 -19.263 401 H GLN 58 H GLN 58 -11.505 -3.205 -23.157 402 HA GLN 58 HA GLN 58 -9.401 -1.420 -23.280 403 1HB GLN 58 1HB GLN 58 -10.729 -3.221 -25.330 404 2HB GLN 58 2HB GLN 58 -9.374 -2.202 -25.775 405 1HG GLN 58 1HG GLN 58 -8.796 -3.595 -23.272 406 2HG GLN 58 2HG GLN 58 -9.275 -4.748 -24.502 407 1HE2 GLN 58 1HE2 GLN 58 -6.939 -5.289 -23.981 408 2HE2 GLN 58 2HE2 GLN 58 -5.719 -4.594 -24.995 409 H GLU 59 H GLU 59 -12.499 -1.504 -25.188 410 HA GLU 59 HA GLU 59 -12.045 0.772 -26.621 411 1HB GLU 59 1HB GLU 59 -14.603 -0.533 -25.630 412 2HB GLU 59 2HB GLU 59 -14.645 0.892 -26.648 413 1HG GLU 59 1HG GLU 59 -12.948 -1.470 -27.493 414 2HG GLU 59 2HG GLU 59 -14.683 -1.539 -27.731 415 HE2 GLU 59 HE GLU 59 -12.691 -1.367 -29.698 416 H ALA 60 H ALA 60 -13.035 0.355 -23.238 417 HA ALA 60 HA ALA 60 -13.898 3.069 -22.934 418 1HB ALA 60 3HB ALA 60 -13.377 0.733 -21.071 419 2HB ALA 60 2HB ALA 60 -14.935 1.462 -21.526 420 3HB ALA 60 1HB ALA 60 -13.816 2.347 -20.463 421 H ALA 61 H ALA 61 -10.886 1.205 -22.662 422 HA ALA 61 HA ALA 61 -9.439 2.895 -21.021 423 1HB ALA 61 3HB ALA 61 -8.968 0.547 -22.228 424 2HB ALA 61 1HB ALA 61 -8.107 1.603 -23.373 425 3HB ALA 61 2HB ALA 61 -7.648 1.593 -21.653 426 H ASN 62 H ASN 62 -10.235 3.093 -24.515 427 HA ASN 62 HA ASN 62 -8.450 5.138 -25.090 428 1HB ASN 62 1HB ASN 62 -10.993 5.235 -26.608 429 2HB ASN 62 2HB ASN 62 -9.365 4.966 -27.198 430 1HD2 ASN 62 1HD2 ASN 62 -8.612 2.776 -25.674 431 2HD2 ASN 62 2HD2 ASN 62 -9.533 1.383 -26.134 432 H LYS 63 H LYS 63 -11.919 5.040 -24.053 433 HA LYS 63 HA LYS 63 -12.420 7.776 -24.277 434 1HB LYS 63 1HB LYS 63 -13.679 5.650 -22.521 435 2HB LYS 63 2HB LYS 63 -14.316 7.270 -22.718 436 1HG LYS 63 1HG LYS 63 -13.708 5.922 -25.292 437 2HG LYS 63 2HG LYS 63 -14.925 5.092 -24.342 438 1HD LYS 63 1HD LYS 63 -14.984 8.020 -25.206 439 2HD LYS 63 2HD LYS 63 -16.012 6.736 -25.811 440 1HE LYS 63 1HE LYS 63 -16.558 6.489 -23.155 441 2HE LYS 63 2HE LYS 63 -16.130 8.188 -23.184 442 H GLN 64 H GLN 64 -10.819 5.802 -21.781 443 HA GLN 64 HA GLN 64 -10.878 7.892 -19.870 444 1HB GLN 64 1HB GLN 64 -10.139 5.106 -19.962 445 2HB GLN 64 2HB GLN 64 -8.788 6.001 -19.297 446 1HG GLN 64 1HG GLN 64 -11.406 6.886 -18.225 447 2HG GLN 64 2HG GLN 64 -11.058 5.203 -17.884 448 1HE2 GLN 64 1HE2 GLN 64 -9.629 4.665 -16.369 449 2HE2 GLN 64 2HE2 GLN 64 -8.655 5.767 -15.452 450 H LYS 65 H LYS 65 -8.537 6.617 -22.286 451 HA LYS 65 HA LYS 65 -6.333 8.100 -21.458 452 1HB LYS 65 1HB LYS 65 -7.152 6.547 -23.826 453 2HB LYS 65 2HB LYS 65 -6.000 7.821 -24.171 454 1HG LYS 65 1HG LYS 65 -4.695 5.880 -23.607 455 2HG LYS 65 2HG LYS 65 -4.583 6.955 -22.228 456 1HD LYS 65 1HD LYS 65 -5.148 5.053 -21.061 457 2HD LYS 65 2HD LYS 65 -6.779 5.552 -21.465 458 1HE LYS 65 1HE LYS 65 -5.069 3.461 -22.873 459 2HE LYS 65 2HE LYS 65 -6.612 3.224 -22.075 460 H GLN 66 H GLN 66 -8.979 8.858 -23.804 461 HA GLN 66 HA GLN 66 -7.922 11.312 -24.549 462 1HB GLN 66 1HB GLN 66 -10.024 9.758 -25.369 463 2HB GLN 66 2HB GLN 66 -10.893 11.026 -24.527 464 1HG GLN 66 1HG GLN 66 -8.767 11.556 -26.655 465 2HG GLN 66 2HG GLN 66 -10.484 11.485 -26.995 466 1HE2 GLN 66 1HE2 GLN 66 -11.714 13.212 -26.699 467 2HE2 GLN 66 2HE2 GLN 66 -11.228 14.703 -25.963 468 H GLU 67 H GLU 67 -10.561 10.497 -22.180 469 HA GLU 67 HA GLU 67 -10.991 13.072 -21.343 470 1HB GLU 67 1HB GLU 67 -12.639 11.811 -20.421 471 2HB GLU 67 2HB GLU 67 -11.658 10.359 -20.441 472 1HG GLU 67 1HG GLU 67 -11.256 12.573 -18.383 473 2HG GLU 67 2HG GLU 67 -12.358 11.236 -18.120 474 HE2 GLU 67 HE GLU 67 -9.411 12.245 -17.656 475 H LEU 68 H LEU 68 -8.368 10.826 -20.626 476 HA LEU 68 HA LEU 68 -7.531 12.138 -18.240 477 1HB LEU 68 1HB LEU 68 -6.621 9.913 -19.958 478 2HB LEU 68 2HB LEU 68 -5.359 10.757 -19.083 479 HG LEU 68 HG LEU 68 -7.825 9.658 -17.720 480 1HD1 LEU 68 2HD1 LEU 68 -6.053 8.056 -19.031 481 2HD1 LEU 68 3HD1 LEU 68 -5.311 8.152 -17.415 482 3HD1 LEU 68 1HD1 LEU 68 -6.988 7.581 -17.592 483 1HD2 LEU 68 1HD2 LEU 68 -6.377 11.457 -16.628 484 2HD2 LEU 68 2HD2 LEU 68 -6.681 9.972 -15.694 485 3HD2 LEU 68 3HD2 LEU 68 -5.116 10.206 -16.509 486 H ASP 69 H ASP 69 -6.299 12.045 -21.657 487 HA ASP 69 HA ASP 69 -4.329 13.933 -21.207 488 1HB ASP 69 1HB ASP 69 -5.124 12.331 -23.312 489 2HB ASP 69 2HB ASP 69 -5.617 13.907 -23.901 490 HD2 ASP 69 HD ASP 69 -2.412 14.802 -24.732 491 H GLU 70 H GLU 70 -7.703 14.153 -22.546 492 HA GLU 70 HA GLU 70 -7.748 16.767 -23.223 493 1HB GLU 70 1HB GLU 70 -10.035 16.498 -23.403 494 2HB GLU 70 2HB GLU 70 -9.573 14.813 -23.271 495 1HG GLU 70 1HG GLU 70 -9.997 14.875 -20.814 496 2HG GLU 70 2HG GLU 70 -10.421 16.572 -20.920 497 HE2 GLU 70 HE GLU 70 -13.629 15.132 -21.139 498 H ILE 71 H ILE 71 -8.334 15.307 -19.965 499 HA ILE 71 HA ILE 71 -8.835 17.840 -18.761 500 HB ILE 71 HB ILE 71 -8.527 15.015 -17.842 501 1HG1 ILE 71 1HG1 ILE 71 -10.711 16.955 -17.123 502 2HG1 ILE 71 2HG1 ILE 71 -10.678 16.223 -18.714 503 1HG2 ILE 71 3HG2 ILE 71 -7.906 17.406 -16.236 504 2HG2 ILE 71 1HG2 ILE 71 -9.093 16.299 -15.506 505 3HG2 ILE 71 2HG2 ILE 71 -7.485 15.696 -15.975 506 1HD1 ILE 71 2HD1 ILE 71 -10.328 13.963 -17.357 507 2HD1 ILE 71 3HD1 ILE 71 -11.040 14.903 -16.023 508 3HD1 ILE 71 1HD1 ILE 71 -11.956 14.662 -17.531 509 H SER 72 H SER 72 -6.073 15.480 -18.666 510 HA SER 72 HA SER 72 -4.443 17.040 -17.113 511 1HB SER 72 1HB SER 72 -2.827 15.447 -17.549 512 2HB SER 72 2HB SER 72 -4.236 14.564 -18.101 513 HG SER 72 HG SER 72 -3.669 15.708 -20.280 514 H THR 73 H THR 73 -5.511 17.486 -20.390 515 HA THR 73 HA THR 73 -3.240 19.191 -21.066 516 HB THR 73 HB THR 73 -5.670 18.127 -22.593 517 HG1 THR 73 1HG THR 73 -4.103 16.652 -23.192 518 1HG2 THR 73 2HG2 THR 73 -4.301 20.481 -23.226 519 2HG2 THR 73 3HG2 THR 73 -3.370 19.242 -24.101 520 3HG2 THR 73 1HG2 THR 73 -5.114 19.427 -24.407 521 H ASN 74 H ASN 74 -6.669 19.344 -20.122 522 HA ASN 74 HA ASN 74 -7.324 21.817 -20.916 523 1HB ASN 74 1HB ASN 74 -8.101 19.997 -18.739 524 2HB ASN 74 2HB ASN 74 -8.262 21.666 -18.232 525 1HD2 ASN 74 1HD2 ASN 74 -9.708 19.123 -19.798 526 2HD2 ASN 74 2HD2 ASN 74 -10.969 19.945 -20.655 527 H ILE 75 H ILE 75 -5.682 20.885 -17.794 528 HA ILE 75 HA ILE 75 -5.309 23.480 -16.862 529 HB ILE 75 HB ILE 75 -3.551 21.095 -16.303 530 1HG1 ILE 75 1HG1 ILE 75 -5.517 21.233 -14.321 531 2HG1 ILE 75 2HG1 ILE 75 -6.403 21.447 -15.817 532 1HG2 ILE 75 2HG2 ILE 75 -3.255 23.642 -15.438 533 2HG2 ILE 75 3HG2 ILE 75 -4.332 22.997 -14.176 534 3HG2 ILE 75 1HG2 ILE 75 -2.772 22.205 -14.504 535 1HD1 ILE 75 2HD1 ILE 75 -5.042 19.419 -16.716 536 2HD1 ILE 75 3HD1 ILE 75 -4.612 19.129 -15.013 537 3HD1 ILE 75 1HD1 ILE 75 -6.318 19.089 -15.520 538 H ARG 76 H ARG 76 -3.203 21.332 -18.869 539 HA ARG 76 HA ARG 76 -1.007 22.906 -18.931 540 1HB ARG 76 1HB ARG 76 -2.104 20.705 -20.472 541 2HB ARG 76 2HB ARG 76 -1.385 21.850 -21.587 542 1HG ARG 76 1HG ARG 76 0.736 21.340 -20.918 543 2HG ARG 76 2HG ARG 76 0.315 21.430 -19.219 544 1HD ARG 76 1HD ARG 76 0.390 19.164 -19.111 545 2HD ARG 76 2HD ARG 76 -0.983 19.087 -20.197 546 HE ARG 76 HE ARG 76 0.464 18.598 -21.992 547 2HH1 ARG 76 1HH ARG 76 3.914 18.201 -22.072 548 1HH2 ARG 76 2HH2 ARG 76 2.360 19.631 -19.182 549 2HH2 ARG 76 1HH2 ARG 76 3.876 19.167 -19.879 550 H GLN 77 H GLN 77 -4.018 23.110 -20.909 551 HA GLN 77 HA GLN 77 -2.979 25.237 -22.480 552 1HB GLN 77 1HB GLN 77 -5.842 24.220 -22.200 553 2HB GLN 77 2HB GLN 77 -5.262 25.296 -23.456 554 1HG GLN 77 1HG GLN 77 -3.546 22.939 -23.304 555 2HG GLN 77 2HG GLN 77 -5.220 22.445 -23.462 556 1HE2 GLN 77 1HE2 GLN 77 -3.483 21.897 -25.446 557 2HE2 GLN 77 2HE2 GLN 77 -3.796 22.852 -26.857 558 H ALA 78 H ALA 78 -4.372 24.928 -19.339 559 HA ALA 78 HA ALA 78 -5.838 27.307 -19.185 560 1HB ALA 78 3HB ALA 78 -4.292 26.059 -16.899 561 2HB ALA 78 1HB ALA 78 -5.872 26.878 -16.862 562 3HB ALA 78 2HB ALA 78 -5.723 25.263 -17.596 563 H GLY 79 H GLY 79 -2.391 26.613 -19.291 564 1HA GLY 79 2HA GLY 79 -1.858 29.474 -18.751 565 2HA GLY 79 1HA GLY 79 -1.013 28.504 -19.940 566 H VAL 80 H VAL 80 -1.259 26.138 -17.856 567 HA VAL 80 HA VAL 80 0.604 27.066 -15.839 568 HB VAL 80 HB VAL 80 -0.461 24.275 -16.229 569 1HG1 VAL 80 3HG1 VAL 80 1.083 25.694 -14.185 570 2HG1 VAL 80 1HG1 VAL 80 -0.349 24.869 -13.523 571 3HG1 VAL 80 2HG1 VAL 80 0.861 23.947 -14.448 572 1HG2 VAL 80 3HG2 VAL 80 -1.862 26.701 -15.113 573 2HG2 VAL 80 1HG2 VAL 80 -2.476 25.454 -16.225 574 3HG2 VAL 80 2HG2 VAL 80 -2.234 25.071 -14.503 575 H GLN 81 H GLN 81 2.495 27.529 -17.054 576 HA GLN 81 HA GLN 81 3.804 25.100 -17.968 577 1HB GLN 81 1HB GLN 81 4.515 26.040 -20.006 578 2HB GLN 81 2HB GLN 81 2.860 26.600 -19.877 579 1HG GLN 81 1HG GLN 81 3.637 28.775 -18.965 580 2HG GLN 81 2HG GLN 81 5.298 28.218 -18.999 581 1HE2 GLN 81 1HE2 GLN 81 3.647 30.365 -20.406 582 2HE2 GLN 81 2HE2 GLN 81 4.059 30.223 -22.082 583 H TYR 82 H TYR 82 3.728 27.467 -15.724 584 HA TYR 82 HA TYR 82 6.596 27.306 -15.307 585 1HB TYR 82 1HB TYR 82 6.725 29.784 -15.109 586 2HB TYR 82 2HB TYR 82 6.061 29.396 -16.684 587 HD1 TYR 82 1HD TYR 82 3.390 29.244 -16.749 588 HD2 TYR 82 2HD TYR 82 5.653 31.399 -13.827 589 HE1 TYR 82 1HE TYR 82 1.369 30.704 -16.249 590 HE2 TYR 82 2HE TYR 82 3.625 32.851 -13.337 591 HH TYR 82 HH TYR 82 1.038 32.464 -13.568 592 H SER 83 H SER 83 6.850 26.647 -13.236 593 HA SER 83 HA SER 83 5.094 27.849 -11.269 594 1HB SER 83 1HB SER 83 4.461 25.792 -10.277 595 2HB SER 83 2HB SER 83 4.275 25.511 -11.997 596 HG SER 83 HG SER 83 5.399 23.760 -10.902 597 H ARG 84 H ARG 84 8.087 27.725 -12.350 598 HA ARG 84 HA ARG 84 9.660 26.586 -10.442 599 1HB ARG 84 1HB ARG 84 9.989 28.901 -12.357 600 2HB ARG 84 2HB ARG 84 11.238 28.656 -11.152 601 1HG ARG 84 1HG ARG 84 11.604 26.345 -11.923 602 2HG ARG 84 2HG ARG 84 10.250 26.459 -13.030 603 1HD ARG 84 1HD ARG 84 11.526 27.476 -14.621 604 2HD ARG 84 2HD ARG 84 12.115 28.670 -13.482 605 HE ARG 84 HE ARG 84 14.028 27.346 -13.082 606 2HH1 ARG 84 1HH ARG 84 15.017 24.335 -14.503 607 1HH2 ARG 84 2HH2 ARG 84 11.665 25.502 -14.971 608 2HH2 ARG 84 1HH2 ARG 84 12.773 24.222 -15.339 609 H ALA 85 H ALA 85 7.523 29.299 -10.185 610 HA ALA 85 HA ALA 85 8.995 30.539 -8.018 611 1HB ALA 85 2HB ALA 85 7.973 32.259 -9.092 612 2HB ALA 85 1HB ALA 85 6.545 31.778 -8.145 613 3HB ALA 85 3HB ALA 85 6.739 31.202 -9.817 614 H ASP 86 H ASP 86 8.680 28.010 -7.214 615 HA ASP 86 HA ASP 86 6.316 28.129 -5.510 616 1HB ASP 86 1HB ASP 86 6.921 26.167 -7.344 617 2HB ASP 86 2HB ASP 86 7.704 25.512 -5.920 618 HD2 ASP 86 HD ASP 86 5.878 24.026 -6.722 619 H GLU 87 H GLU 87 8.733 29.475 -4.812 620 HA GLU 87 HA GLU 87 10.675 28.079 -3.576 621 1HB GLU 87 1HB GLU 87 9.868 30.760 -3.730 622 2HB GLU 87 2HB GLU 87 9.868 30.437 -2.008 623 1HG GLU 87 1HG GLU 87 12.122 30.663 -2.011 624 2HG GLU 87 2HG GLU 87 12.232 29.202 -2.973 625 HE2 GLU 87 HE GLU 87 13.991 31.168 -3.301 626 H GLU 88 H GLU 88 7.347 28.698 -2.459 627 HA GLU 88 HA GLU 88 7.744 28.057 0.205 628 1HB GLU 88 1HB GLU 88 5.502 28.526 -1.607 629 2HB GLU 88 2HB GLU 88 5.123 27.227 -0.493 630 1HG GLU 88 1HG GLU 88 5.410 28.603 1.422 631 2HG GLU 88 2HG GLU 88 6.390 29.772 0.560 632 HE2 GLU 88 HE GLU 88 3.415 29.101 1.624 633 H GLN 89 H GLN 89 7.011 26.044 -2.689 634 HA GLN 89 HA GLN 89 6.949 23.695 -1.023 635 1HB GLN 89 1HB GLN 89 6.034 24.433 -3.727 636 2HB GLN 89 2HB GLN 89 6.809 22.862 -3.693 637 1HG GLN 89 1HG GLN 89 4.648 22.227 -3.122 638 2HG GLN 89 2HG GLN 89 5.295 22.506 -1.517 639 1HE2 GLN 89 1HE2 GLN 89 2.589 22.600 -2.134 640 2HE2 GLN 89 2HE2 GLN 89 1.984 24.208 -1.915 641 H GLN 90 H GLN 90 9.439 25.379 -1.401 642 HA GLN 90 HA GLN 90 11.174 24.230 -3.171 643 1HB GLN 90 1HB GLN 90 12.967 25.138 -1.697 644 2HB GLN 90 2HB GLN 90 11.682 26.299 -1.967 645 1HG GLN 90 1HG GLN 90 11.556 26.505 0.293 646 2HG GLN 90 2HG GLN 90 10.793 24.927 0.302 647 1HE2 GLN 90 1HE2 GLN 90 13.017 26.634 1.805 648 2HE2 GLN 90 2HE2 GLN 90 14.196 25.440 2.237 649 H GLN 91 H GLN 91 9.803 22.940 -0.223 650 HA GLN 91 HA GLN 91 11.875 20.914 -0.106 651 1HB GLN 91 1HB GLN 91 10.931 20.327 2.079 652 2HB GLN 91 2HB GLN 91 11.233 22.052 2.010 653 1HG GLN 91 1HG GLN 91 9.063 22.411 2.557 654 2HG GLN 91 2HG GLN 91 8.596 21.735 1.009 655 1HE2 GLN 91 1HE2 GLN 91 6.693 20.993 2.046 656 2HE2 GLN 91 2HE2 GLN 91 6.678 19.536 2.983 657 H ALA 92 H ALA 92 9.282 21.395 -1.975 658 HA ALA 92 HA ALA 92 8.040 18.792 -1.561 659 1HB ALA 92 3HB ALA 92 7.302 20.850 -3.655 660 2HB ALA 92 2HB ALA 92 6.799 21.039 -1.958 661 3HB ALA 92 1HB ALA 92 6.274 19.616 -2.889 662 H LEU 93 H LEU 93 10.833 18.874 -2.365 663 HA LEU 93 HA LEU 93 10.971 18.537 -5.184 664 1HB LEU 93 1HB LEU 93 13.255 17.609 -4.585 665 2HB LEU 93 2HB LEU 93 12.923 19.287 -4.206 666 HG LEU 93 HG LEU 93 14.161 17.756 -2.490 667 1HD1 LEU 93 2HD1 LEU 93 12.505 20.078 -2.263 668 2HD1 LEU 93 3HD1 LEU 93 12.319 19.091 -0.793 669 3HD1 LEU 93 1HD1 LEU 93 13.938 19.619 -1.311 670 1HD2 LEU 93 3HD2 LEU 93 11.278 16.953 -2.081 671 2HD2 LEU 93 1HD2 LEU 93 12.701 15.911 -2.319 672 3HD2 LEU 93 2HD2 LEU 93 12.508 16.823 -0.802 673 H SER 94 H SER 94 8.863 17.063 -4.846 674 HA SER 94 HA SER 94 9.640 14.371 -4.192 675 1HB SER 94 1HB SER 94 7.235 15.859 -4.052 676 2HB SER 94 2HB SER 94 6.951 14.671 -5.308 677 HG SER 94 HG SER 94 7.015 13.054 -3.867 678 H SER 95 H SER 95 10.642 15.966 -6.636 679 HA SER 95 HA SER 95 9.417 14.515 -8.791 680 1HB SER 95 1HB SER 95 9.896 16.749 -9.385 681 2HB SER 95 2HB SER 95 11.448 16.743 -8.572 682 HG SER 95 HG SER 95 12.405 15.721 -10.268 683 H GLN 96 H GLN 96 12.588 14.786 -7.077 684 HA GLN 96 HA GLN 96 13.864 12.915 -8.730 685 1HB GLN 96 1HB GLN 96 15.171 14.535 -7.478 686 2HB GLN 96 2HB GLN 96 14.502 13.989 -5.953 687 1HG GLN 96 1HG GLN 96 15.630 11.697 -7.311 688 2HG GLN 96 2HG GLN 96 16.818 12.985 -7.340 689 1HE2 GLN 96 1HE2 GLN 96 15.211 10.625 -5.487 690 2HE2 GLN 96 2HE2 GLN 96 15.919 10.945 -3.939 691 H MET 97 H MET 97 12.498 12.713 -5.367 692 HA MET 97 HA MET 97 13.066 10.162 -4.797 693 1HB MET 97 1HB MET 97 11.672 12.029 -3.534 694 2HB MET 97 2HB MET 97 10.276 11.298 -4.301 695 1HG MET 97 1HG MET 97 10.545 10.287 -2.096 696 2HG MET 97 2HG MET 97 10.928 9.072 -3.299 697 1HE MET 97 1HE MET 97 11.718 7.919 -1.339 698 2HE MET 97 2HE MET 97 13.441 7.886 -0.893 699 3HE MET 97 3HE MET 97 12.315 8.952 -0.018 700 H GLY 98 H GLY 98 12.748 8.242 -5.829 701 1HA GLY 98 2HA GLY 98 11.567 7.696 -8.125 702 2HA GLY 98 1HA GLY 98 10.159 7.730 -7.082 703 H PHE 99 H PHE 99 10.936 5.369 -8.435 704 HA PHE 99 HA PHE 99 11.738 3.728 -6.143 705 1HB PHE 99 1HB PHE 99 9.624 3.696 -8.163 706 2HB PHE 99 2HB PHE 99 10.608 2.262 -8.386 707 HD1 PHE 99 1HD PHE 99 7.903 3.647 -6.615 708 HD2 PHE 99 2HD PHE 99 11.096 0.883 -6.204 709 HE1 PHE 99 1HE PHE 99 6.683 2.517 -4.735 710 HE2 PHE 99 2HE PHE 99 9.876 -0.247 -4.324 711 HZ PHE 99 HZ PHE 99 7.684 0.584 -3.612 712 H MET 601 H MET 601 7.143 -17.399 -21.007 713 HA MET 601 HA MET 601 9.053 -17.959 -21.946 714 1HB MET 601 1HB MET 601 9.345 -17.423 -19.217 715 2HB MET 601 2HB MET 601 10.233 -18.926 -19.375 716 1HG MET 601 1HG MET 601 11.941 -17.931 -20.530 717 2HG MET 601 2HG MET 601 10.843 -17.044 -21.568 718 1HE MET 601 2HE MET 601 12.942 -15.363 -21.314 719 2HE MET 601 3HE MET 601 13.250 -14.386 -19.858 720 3HE MET 601 1HE MET 601 13.707 -16.106 -19.889 721 H THR 602 H THR 602 8.805 -20.440 -19.287 722 HA THR 602 HA THR 602 10.211 -22.448 -20.408 723 HB THR 602 HB THR 602 7.568 -22.607 -18.864 724 HG1 THR 602 1HG THR 602 10.402 -22.691 -18.110 725 1HG2 THR 602 1HG2 THR 602 9.800 -24.601 -19.429 726 2HG2 THR 602 2HG2 THR 602 8.879 -24.680 -17.908 727 3HG2 THR 602 3HG2 THR 602 8.041 -24.870 -19.467 728 H GLU 603 H GLU 603 6.746 -21.696 -21.117 729 HA GLU 603 HA GLU 603 7.143 -23.236 -23.557 730 1HB GLU 603 1HB GLU 603 4.652 -23.269 -21.795 731 2HB GLU 603 2HB GLU 603 4.782 -24.047 -23.360 732 1HG GLU 603 1HG GLU 603 7.054 -24.940 -21.909 733 2HG GLU 603 2HG GLU 603 5.738 -24.975 -20.752 734 HE2 GLU 603 HE GLU 603 5.590 -25.705 -24.247 735 H GLN 604 H GLN 604 7.024 -21.814 -25.237 736 HA GLN 604 HA GLN 604 6.026 -19.264 -24.971 737 1HB GLN 604 1HB GLN 604 7.033 -20.990 -27.148 738 2HB GLN 604 2HB GLN 604 5.871 -19.802 -27.704 739 1HG GLN 604 1HG GLN 604 7.335 -18.081 -27.412 740 2HG GLN 604 2HG GLN 604 7.767 -18.615 -25.800 741 1HE2 GLN 604 1HE2 GLN 604 9.065 -17.865 -28.598 742 2HE2 GLN 604 2HE2 GLN 604 10.407 -18.954 -28.710 743 H GLN 605 H GLN 605 4.487 -22.311 -26.083 744 HA GLN 605 HA GLN 605 2.310 -21.515 -27.332 745 1HB GLN 605 1HB GLN 605 2.375 -23.554 -25.064 746 2HB GLN 605 2HB GLN 605 1.112 -23.448 -26.274 747 1HG GLN 605 1HG GLN 605 3.498 -23.497 -27.781 748 2HG GLN 605 2HG GLN 605 3.794 -24.637 -26.483 749 1HE2 GLN 605 1HE2 GLN 605 3.526 -25.265 -29.222 750 2HE2 GLN 605 2HE2 GLN 605 2.147 -26.292 -29.438 751 H TRP 606 H TRP 606 2.709 -21.469 -23.728 752 HA TRP 606 HA TRP 606 1.169 -19.130 -23.468 753 1HB TRP 606 1HB TRP 606 -0.835 -19.883 -22.514 754 2HB TRP 606 2HB TRP 606 -0.646 -20.769 -24.015 755 HD1 TRP 606 HD TRP 606 0.056 -23.452 -23.742 756 HE1 TRP 606 1HE TRP 606 -0.388 -25.237 -21.850 757 HE3 TRP 606 3HE TRP 606 -1.041 -20.085 -20.092 758 HZ2 TRP 606 2HZ TRP 606 -1.131 -25.045 -19.101 759 HZ3 TRP 606 3HZ TRP 606 -1.615 -20.967 -17.833 760 HH2 TRP 606 HH TRP 606 -1.671 -23.354 -17.310 761 H ASN 607 H ASN 607 2.954 -18.479 -22.205 762 HA ASN 607 HA ASN 607 4.204 -20.074 -20.356 763 1HB ASN 607 1HB ASN 607 5.277 -18.021 -21.037 764 2HB ASN 607 2HB ASN 607 3.877 -17.054 -20.619 765 1HD2 ASN 607 1HD2 ASN 607 5.413 -15.767 -19.443 766 2HD2 ASN 607 2HD2 ASN 607 5.876 -16.198 -17.830 767 H PHE 608 H PHE 608 2.563 -21.176 -19.061 768 HA PHE 608 HA PHE 608 0.417 -19.983 -17.835 769 1HB PHE 608 1HB PHE 608 0.360 -22.064 -16.626 770 2HB PHE 608 2HB PHE 608 1.253 -22.478 -18.076 771 HD1 PHE 608 1HD PHE 608 3.609 -22.999 -17.979 772 HD2 PHE 608 2HD PHE 608 1.515 -21.843 -14.474 773 HE1 PHE 608 1HE PHE 608 5.522 -23.807 -16.570 774 HE2 PHE 608 2HE PHE 608 3.428 -22.650 -13.064 775 HZ PHE 608 HZ PHE 608 5.409 -23.623 -14.129 776 H ALA 609 H ALA 609 3.843 -20.219 -16.764 777 HA ALA 609 HA ALA 609 3.425 -19.335 -14.146 778 1HB ALA 609 3HB ALA 609 5.863 -18.974 -15.935 779 2HB ALA 609 2HB ALA 609 5.473 -20.460 -15.036 780 3HB ALA 609 1HB ALA 609 5.835 -18.957 -14.155 781 H GLY 610 H GLY 610 3.165 -17.724 -17.211 782 1HA GLY 610 2HA GLY 610 3.354 -15.481 -17.754 783 2HA GLY 610 1HA GLY 610 3.667 -15.079 -16.077 784 H ILE 611 H ILE 611 1.028 -16.646 -18.040 785 HA ILE 611 HA ILE 611 -0.860 -14.696 -17.505 786 HB ILE 611 HB ILE 611 -1.126 -16.186 -19.325 787 1HG1 ILE 611 1HG1 ILE 611 -3.165 -15.715 -17.406 788 2HG1 ILE 611 2HG1 ILE 611 -3.322 -15.927 -19.139 789 1HG2 ILE 611 1HG2 ILE 611 -1.063 -18.390 -17.259 790 2HG2 ILE 611 2HG2 ILE 611 -1.679 -18.628 -18.912 791 3HG2 ILE 611 3HG2 ILE 611 0.015 -18.143 -18.654 792 1HD1 ILE 611 3HD1 ILE 611 -3.103 -18.286 -17.223 793 2HD1 ILE 611 1HD1 ILE 611 -4.660 -17.566 -17.698 794 3HD1 ILE 611 2HD1 ILE 611 -3.612 -18.312 -18.929 795 H GLU 612 H GLU 612 0.466 -17.198 -15.467 796 HA GLU 612 HA GLU 612 -1.716 -17.609 -13.815 797 1HB GLU 612 1HB GLU 612 0.131 -19.126 -13.678 798 2HB GLU 612 2HB GLU 612 1.284 -17.835 -13.401 799 1HG GLU 612 1HG GLU 612 0.982 -17.998 -11.161 800 2HG GLU 612 2HG GLU 612 -0.731 -17.672 -11.339 801 HE2 GLU 612 HE GLU 612 0.911 -19.980 -9.835 802 H ALA 613 H ALA 613 1.036 -15.258 -13.609 803 HA ALA 613 HA ALA 613 -0.169 -14.014 -11.294 804 1HB ALA 613 3HB ALA 613 2.194 -14.174 -11.212 805 2HB ALA 613 2HB ALA 613 1.876 -12.474 -11.634 806 3HB ALA 613 1HB ALA 613 2.376 -13.626 -12.895 807 H ALA 614 H ALA 614 -0.274 -13.798 -14.766 808 HA ALA 614 HA ALA 614 -0.576 -11.160 -15.295 809 1HB ALA 614 3HB ALA 614 -2.101 -13.571 -16.349 810 2HB ALA 614 1HB ALA 614 -2.181 -11.954 -17.088 811 3HB ALA 614 2HB ALA 614 -0.633 -12.831 -17.031 812 H ALA 615 H ALA 615 -3.149 -13.430 -14.103 813 HA ALA 615 HA ALA 615 -5.183 -11.554 -13.984 814 1HB ALA 615 3HB ALA 615 -6.099 -13.592 -13.622 815 2HB ALA 615 1HB ALA 615 -4.589 -14.249 -12.947 816 3HB ALA 615 2HB ALA 615 -5.695 -13.316 -11.911 817 H SER 616 H SER 616 -2.812 -12.597 -11.441 818 HA SER 616 HA SER 616 -3.763 -11.006 -9.442 819 1HB SER 616 1HB SER 616 -1.576 -12.708 -9.840 820 2HB SER 616 2HB SER 616 -0.817 -11.164 -9.503 821 HG SER 616 HG SER 616 -1.497 -12.704 -7.642 822 H ALA 617 H ALA 617 -1.859 -10.194 -12.321 823 HA ALA 617 HA ALA 617 -0.960 -7.670 -11.355 824 1HB ALA 617 1HB ALA 617 -0.282 -9.359 -13.414 825 2HB ALA 617 3HB ALA 617 0.227 -7.658 -13.292 826 3HB ALA 617 2HB ALA 617 -1.190 -8.095 -14.277 827 H ILE 618 H ILE 618 -3.799 -8.925 -13.141 828 HA ILE 618 HA ILE 618 -4.766 -6.420 -13.962 829 HB ILE 618 HB ILE 618 -6.166 -9.052 -13.482 830 1HG1 ILE 618 1HG1 ILE 618 -4.316 -9.103 -15.138 831 2HG1 ILE 618 2HG1 ILE 618 -5.888 -9.454 -15.828 832 1HG2 ILE 618 1HG2 ILE 618 -7.361 -6.565 -13.803 833 2HG2 ILE 618 2HG2 ILE 618 -7.376 -7.268 -15.439 834 3HG2 ILE 618 3HG2 ILE 618 -8.112 -8.154 -14.082 835 1HD1 ILE 618 1HD1 ILE 618 -5.590 -6.623 -15.991 836 2HD1 ILE 618 2HD1 ILE 618 -4.039 -7.325 -16.513 837 3HD1 ILE 618 3HD1 ILE 618 -5.549 -7.796 -17.330 838 H GLN 619 H GLN 619 -5.497 -8.503 -11.087 839 HA GLN 619 HA GLN 619 -7.421 -6.966 -9.976 840 1HB GLN 619 1HB GLN 619 -5.548 -9.023 -9.089 841 2HB GLN 619 2HB GLN 619 -5.829 -7.864 -7.805 842 1HG GLN 619 1HG GLN 619 -8.121 -9.096 -9.391 843 2HG GLN 619 2HG GLN 619 -7.464 -9.869 -7.962 844 1HE2 GLN 619 1HE2 GLN 619 -9.859 -7.967 -9.034 845 2HE2 GLN 619 2HE2 GLN 619 -10.253 -7.052 -7.617 846 H GLY 620 H GLY 620 -3.926 -6.838 -8.949 847 1HA GLY 620 2HA GLY 620 -2.640 -5.112 -8.297 848 2HA GLY 620 1HA GLY 620 -4.054 -4.564 -7.419 849 H ASN 621 H ASN 621 -3.959 -4.897 -10.985 850 HA ASN 621 HA ASN 621 -3.310 -2.187 -11.406 851 1HB ASN 621 1HB ASN 621 -4.201 -4.526 -13.094 852 2HB ASN 621 2HB ASN 621 -4.419 -2.928 -13.781 853 1HD2 ASN 621 1HD2 ASN 621 -2.418 -1.440 -13.241 854 2HD2 ASN 621 2HD2 ASN 621 -0.878 -2.098 -13.685 855 H VAL 622 H VAL 622 -6.260 -4.160 -11.011 856 HA VAL 622 HA VAL 622 -8.085 -2.318 -12.101 857 HB VAL 622 HB VAL 622 -8.312 -4.610 -10.153 858 1HG1 VAL 622 2HG1 VAL 622 -10.426 -2.710 -11.146 859 2HG1 VAL 622 3HG1 VAL 622 -10.832 -4.410 -10.811 860 3HG1 VAL 622 1HG1 VAL 622 -10.178 -3.379 -9.516 861 1HG2 VAL 622 2HG2 VAL 622 -7.929 -4.563 -12.896 862 2HG2 VAL 622 3HG2 VAL 622 -8.572 -5.927 -11.950 863 3HG2 VAL 622 1HG2 VAL 622 -9.688 -4.783 -12.735 864 H THR 623 H THR 623 -7.168 -3.070 -8.663 865 HA THR 623 HA THR 623 -8.668 -0.938 -7.594 866 HB THR 623 HB THR 623 -7.302 -1.498 -5.546 867 HG1 THR 623 1HG THR 623 -5.277 -2.040 -6.386 868 1HG2 THR 623 1HG2 THR 623 -9.184 -3.108 -6.556 869 2HG2 THR 623 2HG2 THR 623 -7.791 -4.150 -6.931 870 3HG2 THR 623 3HG2 THR 623 -8.129 -3.688 -5.246 871 H SER 624 H SER 624 -5.362 -1.171 -8.909 872 HA SER 624 HA SER 624 -4.313 1.092 -7.829 873 1HB SER 624 1HB SER 624 -3.927 -0.282 -10.503 874 2HB SER 624 2HB SER 624 -3.043 1.186 -10.134 875 HG SER 624 HG SER 624 -1.729 -0.506 -9.460 876 H ILE 625 H ILE 625 -6.483 0.690 -10.680 877 HA ILE 625 HA ILE 625 -6.367 3.456 -11.369 878 HB ILE 625 HB ILE 625 -7.695 1.004 -12.338 879 1HG1 ILE 625 1HG1 ILE 625 -7.046 2.875 -14.383 880 2HG1 ILE 625 2HG1 ILE 625 -5.741 2.917 -13.214 881 1HG2 ILE 625 3HG2 ILE 625 -8.994 3.703 -12.477 882 2HG2 ILE 625 1HG2 ILE 625 -9.131 2.582 -13.853 883 3HG2 ILE 625 2HG2 ILE 625 -9.721 2.095 -12.246 884 1HD1 ILE 625 3HD1 ILE 625 -6.881 0.359 -14.432 885 2HD1 ILE 625 1HD1 ILE 625 -5.395 1.173 -14.978 886 3HD1 ILE 625 2HD1 ILE 625 -5.476 0.472 -13.344 887 H HIS 626 H HIS 626 -8.507 1.318 -9.439 888 HA HIS 626 HA HIS 626 -10.609 3.079 -9.132 889 1HB HIS 626 1HB HIS 626 -10.543 0.655 -8.514 890 2HB HIS 626 2HB HIS 626 -9.580 1.071 -7.110 891 HD1 HIS 626 1HD HIS 626 -11.640 0.001 -5.734 892 HD2 HIS 626 2HD HIS 626 -12.430 3.602 -7.736 893 HE1 HIS 626 1HE HIS 626 -13.797 0.921 -4.727 894 H SER 627 H SER 627 -7.660 2.612 -7.068 895 HA SER 627 HA SER 627 -8.385 4.748 -5.383 896 1HB SER 627 1HB SER 627 -6.089 2.872 -5.688 897 2HB SER 627 2HB SER 627 -5.686 4.415 -4.961 898 HG SER 627 HG SER 627 -6.475 2.539 -3.533 899 H LEU 628 H LEU 628 -6.233 4.316 -8.235 900 HA LEU 628 HA LEU 628 -4.860 6.690 -8.143 901 1HB LEU 628 1HB LEU 628 -5.702 4.793 -10.273 902 2HB LEU 628 2HB LEU 628 -5.111 6.363 -10.781 903 HG LEU 628 HG LEU 628 -3.530 4.639 -8.875 904 1HD1 LEU 628 2HD1 LEU 628 -4.096 4.100 -11.675 905 2HD1 LEU 628 3HD1 LEU 628 -2.356 4.332 -11.380 906 3HD1 LEU 628 1HD1 LEU 628 -3.258 3.104 -10.461 907 1HD2 LEU 628 3HD2 LEU 628 -2.998 7.087 -9.194 908 2HD2 LEU 628 1HD2 LEU 628 -1.666 5.953 -9.527 909 3HD2 LEU 628 2HD2 LEU 628 -2.565 6.692 -10.875 910 H LEU 629 H LEU 629 -8.086 6.002 -9.649 911 HA LEU 629 HA LEU 629 -8.492 8.629 -10.525 912 1HB LEU 629 1HB LEU 629 -9.944 6.124 -10.392 913 2HB LEU 629 2HB LEU 629 -10.994 7.482 -10.039 914 HG LEU 629 HG LEU 629 -9.375 8.116 -12.336 915 1HD1 LEU 629 1HD1 LEU 629 -10.877 5.491 -12.510 916 2HD1 LEU 629 2HD1 LEU 629 -10.245 6.409 -13.897 917 3HD1 LEU 629 3HD1 LEU 629 -9.124 5.737 -12.689 918 1HD2 LEU 629 1HD2 LEU 629 -11.673 8.976 -11.535 919 2HD2 LEU 629 2HD2 LEU 629 -11.403 8.757 -13.281 920 3HD2 LEU 629 3HD2 LEU 629 -12.331 7.545 -12.365 921 H ASP 630 H ASP 630 -9.067 6.963 -7.413 922 HA ASP 630 HA ASP 630 -10.715 8.885 -6.314 923 1HB ASP 630 1HB ASP 630 -10.247 6.591 -5.379 924 2HB ASP 630 2HB ASP 630 -8.641 7.124 -4.924 925 HD2 ASP 630 HD ASP 630 -10.921 6.213 -3.405 926 H GLU 631 H GLU 631 -7.171 8.602 -6.716 927 HA GLU 631 HA GLU 631 -6.591 10.702 -4.903 928 1HB GLU 631 1HB GLU 631 -5.100 8.821 -6.621 929 2HB GLU 631 2HB GLU 631 -4.358 10.406 -6.557 930 1HG GLU 631 1HG GLU 631 -5.068 8.626 -4.183 931 2HG GLU 631 2HG GLU 631 -3.458 9.042 -4.737 932 HE2 GLU 631 HE GLU 631 -5.192 11.135 -2.068 933 H GLY 632 H GLY 632 -6.955 10.334 -8.466 934 1HA GLY 632 2HA GLY 632 -6.940 11.855 -10.137 935 2HA GLY 632 1HA GLY 632 -6.126 12.994 -9.083 936 H LYS 633 H LYS 633 -9.271 11.342 -8.449 937 HA LYS 633 HA LYS 633 -10.975 13.289 -9.353 938 1HB LYS 633 1HB LYS 633 -11.454 10.935 -8.449 939 2HB LYS 633 2HB LYS 633 -11.460 11.660 -6.854 940 1HG LYS 633 1HG LYS 633 -13.750 11.659 -7.624 941 2HG LYS 633 2HG LYS 633 -13.199 13.322 -7.685 942 1HD LYS 633 1HD LYS 633 -12.484 12.322 -10.208 943 2HD LYS 633 2HD LYS 633 -14.019 11.538 -9.891 944 1HE LYS 633 1HE LYS 633 -14.507 14.159 -9.057 945 2HE LYS 633 2HE LYS 633 -13.441 14.396 -10.427 946 H GLN 634 H GLN 634 -8.974 13.182 -6.405 947 HA GLN 634 HA GLN 634 -10.308 15.330 -5.171 948 1HB GLN 634 1HB GLN 634 -7.625 13.975 -4.734 949 2HB GLN 634 2HB GLN 634 -8.099 15.371 -3.786 950 1HG GLN 634 1HG GLN 634 -10.174 13.234 -3.999 951 2HG GLN 634 2HG GLN 634 -8.723 12.768 -3.134 952 1HE2 GLN 634 1HE2 GLN 634 -11.709 13.937 -2.746 953 2HE2 GLN 634 2HE2 GLN 634 -11.547 14.878 -1.301 954 H SER 635 H SER 635 -7.789 15.017 -7.623 955 HA SER 635 HA SER 635 -6.845 17.677 -7.247 956 1HB SER 635 1HB SER 635 -5.961 15.330 -8.595 957 2HB SER 635 2HB SER 635 -6.187 16.536 -9.846 958 HG SER 635 HG SER 635 -4.816 17.992 -8.630 959 H LEU 636 H LEU 636 -9.216 15.938 -9.268 960 HA LEU 636 HA LEU 636 -9.604 17.606 -11.352 961 1HB LEU 636 1HB LEU 636 -11.129 15.636 -9.894 962 2HB LEU 636 2HB LEU 636 -12.178 16.920 -10.460 963 HG LEU 636 HG LEU 636 -11.928 14.928 -11.987 964 1HD1 LEU 636 1HD1 LEU 636 -12.824 17.072 -12.757 965 2HD1 LEU 636 2HD1 LEU 636 -11.177 17.629 -13.139 966 3HD1 LEU 636 3HD1 LEU 636 -11.882 16.261 -14.032 967 1HD2 LEU 636 3HD2 LEU 636 -9.259 15.152 -11.533 968 2HD2 LEU 636 1HD2 LEU 636 -9.981 14.299 -12.919 969 3HD2 LEU 636 2HD2 LEU 636 -9.404 15.972 -13.106 970 H THR 637 H THR 637 -10.628 18.095 -7.944 971 HA THR 637 HA THR 637 -12.059 20.499 -8.554 972 HB THR 637 HB THR 637 -12.694 20.323 -6.321 973 HG1 THR 637 1HG THR 637 -10.920 19.495 -4.788 974 1HG2 THR 637 2HG2 THR 637 -12.510 17.850 -7.393 975 2HG2 THR 637 3HG2 THR 637 -11.244 17.679 -6.153 976 3HG2 THR 637 1HG2 THR 637 -12.911 18.081 -5.675 977 H LYS 638 H LYS 638 -8.738 19.653 -7.542 978 HA LYS 638 HA LYS 638 -8.038 22.340 -6.950 979 1HB LYS 638 1HB LYS 638 -6.163 20.060 -7.613 980 2HB LYS 638 2HB LYS 638 -5.823 21.493 -6.664 981 1HG LYS 638 1HG LYS 638 -7.872 20.603 -5.181 982 2HG LYS 638 2HG LYS 638 -7.459 19.066 -5.916 983 1HD LYS 638 1HD LYS 638 -5.142 20.635 -4.864 984 2HD LYS 638 2HD LYS 638 -6.263 20.058 -3.648 985 1HE LYS 638 1HE LYS 638 -6.062 17.763 -5.031 986 2HE LYS 638 2HE LYS 638 -4.543 18.465 -5.552 987 H LEU 639 H LEU 639 -8.197 20.325 -9.859 988 HA LEU 639 HA LEU 639 -6.678 22.291 -11.364 989 1HB LEU 639 1HB LEU 639 -7.860 19.605 -12.068 990 2HB LEU 639 2HB LEU 639 -7.082 20.657 -13.235 991 HG LEU 639 HG LEU 639 -5.378 19.209 -12.692 992 1HD1 LEU 639 2HD1 LEU 639 -4.753 21.620 -12.306 993 2HD1 LEU 639 3HD1 LEU 639 -4.928 21.309 -10.562 994 3HD1 LEU 639 1HD1 LEU 639 -3.711 20.418 -11.508 995 1HD2 LEU 639 3HD2 LEU 639 -6.758 18.156 -10.822 996 2HD2 LEU 639 1HD2 LEU 639 -4.987 18.132 -10.640 997 3HD2 LEU 639 2HD2 LEU 639 -5.960 19.315 -9.732 998 H ALA 640 H ALA 640 -9.937 21.541 -10.435 999 HA ALA 640 HA ALA 640 -11.439 22.249 -12.585 1000 1HB ALA 640 2HB ALA 640 -12.170 21.484 -10.272 1001 2HB ALA 640 3HB ALA 640 -11.964 23.168 -9.735 1002 3HB ALA 640 1HB ALA 640 -13.160 22.775 -10.994 1003 H ALA 641 H ALA 641 -9.542 24.353 -10.384 1004 HA ALA 641 HA ALA 641 -10.598 26.792 -11.201 1005 1HB ALA 641 3HB ALA 641 -8.995 27.636 -9.820 1006 2HB ALA 641 1HB ALA 641 -8.772 25.931 -9.361 1007 3HB ALA 641 2HB ALA 641 -7.698 26.675 -10.570 1008 H ALA 642 H ALA 642 -8.356 24.528 -12.747 1009 HA ALA 642 HA ALA 642 -7.174 26.340 -14.534 1010 1HB ALA 642 1HB ALA 642 -6.693 23.801 -13.837 1011 2HB ALA 642 3HB ALA 642 -6.172 24.456 -15.409 1012 3HB ALA 642 2HB ALA 642 -7.658 23.481 -15.299 1013 H TRP 643 H TRP 643 -10.315 24.696 -14.418 1014 HA TRP 643 HA TRP 643 -10.882 25.210 -17.188 1015 1HB TRP 643 1HB TRP 643 -12.407 24.056 -14.871 1016 2HB TRP 643 2HB TRP 643 -13.232 24.503 -16.351 1017 HD1 TRP 643 HD TRP 643 -12.889 22.877 -18.463 1018 HE1 TRP 643 1HE TRP 643 -11.803 20.508 -18.875 1019 HE3 TRP 643 3HE TRP 643 -10.403 22.664 -14.033 1020 HZ2 TRP 643 2HZ TRP 643 -10.065 18.848 -17.336 1021 HZ3 TRP 643 3HZ TRP 643 -9.034 20.634 -13.566 1022 HH2 TRP 643 HH TRP 643 -8.843 18.767 -15.132 1023 H GLY 644 H GLY 644 -11.538 26.621 -13.946 1024 1HA GLY 644 2HA GLY 644 -13.013 28.827 -15.231 1025 2HA GLY 644 1HA GLY 644 -11.606 29.160 -14.241 1026 H GLY 645 H GLY 645 -11.839 27.320 -12.139 1027 1HA GLY 645 2HA GLY 645 -14.362 28.206 -10.875 1028 2HA GLY 645 1HA GLY 645 -12.839 27.968 -10.041 1029 H SER 646 H SER 646 -14.111 26.512 -8.596 1030 HA SER 646 HA SER 646 -14.234 23.867 -9.803 1031 1HB SER 646 1HB SER 646 -14.362 23.516 -7.036 1032 2HB SER 646 2HB SER 646 -12.932 23.328 -8.031 1033 HG SER 646 HG SER 646 -12.420 24.796 -6.382 1034 H GLY 647 H GLY 647 -16.428 24.682 -10.662 1035 1HA GLY 647 2HA GLY 647 -18.541 25.152 -8.797 1036 2HA GLY 647 1HA GLY 647 -18.533 23.491 -9.356 1037 H SER 648 H SER 648 -17.297 26.154 -11.385 1038 HA SER 648 HA SER 648 -19.591 26.889 -12.646 1039 1HB SER 648 1HB SER 648 -16.710 27.057 -13.142 1040 2HB SER 648 2HB SER 648 -17.591 26.890 -14.648 1041 HG SER 648 HG SER 648 -18.319 28.894 -14.452 1042 H GLU 649 H GLU 649 -20.563 26.259 -14.720 1043 HA GLU 649 HA GLU 649 -21.043 23.607 -14.955 1044 1HB GLU 649 1HB GLU 649 -21.931 24.158 -17.234 1045 2HB GLU 649 2HB GLU 649 -22.472 25.275 -15.998 1046 1HG GLU 649 1HG GLU 649 -20.403 26.730 -16.690 1047 2HG GLU 649 2HG GLU 649 -20.343 25.721 -18.122 1048 HE2 GLU 649 HE GLU 649 -21.124 28.514 -17.665 1049 H ALA 650 H ALA 650 -18.476 25.576 -16.518 1050 HA ALA 650 HA ALA 650 -17.589 23.841 -18.426 1051 1HB ALA 650 1HB ALA 650 -16.537 26.086 -16.852 1052 2HB ALA 650 3HB ALA 650 -16.316 25.700 -18.575 1053 3HB ALA 650 2HB ALA 650 -15.269 24.941 -17.352 1054 H TYR 651 H TYR 651 -15.913 24.140 -15.221 1055 HA TYR 651 HA TYR 651 -14.548 21.776 -15.376 1056 1HB TYR 651 1HB TYR 651 -14.027 23.314 -13.606 1057 2HB TYR 651 2HB TYR 651 -15.717 23.588 -13.229 1058 HD1 TYR 651 1HD TYR 651 -13.276 20.727 -13.193 1059 HD2 TYR 651 2HD TYR 651 -16.479 22.754 -11.208 1060 HE1 TYR 651 1HE TYR 651 -13.113 19.096 -11.249 1061 HE2 TYR 651 2HE TYR 651 -16.304 21.117 -9.270 1062 HH TYR 651 HH TYR 651 -14.717 19.661 -8.284 1063 H GLN 652 H GLN 652 -17.935 22.364 -14.360 1064 HA GLN 652 HA GLN 652 -18.377 19.952 -13.127 1065 1HB GLN 652 1HB GLN 652 -20.212 21.818 -14.675 1066 2HB GLN 652 2HB GLN 652 -20.821 20.385 -13.872 1067 1HG GLN 652 1HG GLN 652 -19.103 21.773 -12.012 1068 2HG GLN 652 2HG GLN 652 -20.194 22.952 -12.714 1069 1HE2 GLN 652 1HE2 GLN 652 -20.217 22.158 -10.035 1070 2HE2 GLN 652 2HE2 GLN 652 -21.712 21.361 -9.674 1071 H GLY 653 H GLY 653 -18.940 20.894 -16.593 1072 1HA GLY 653 2HA GLY 653 -19.034 19.660 -18.468 1073 2HA GLY 653 1HA GLY 653 -19.883 18.457 -17.517 1074 H VAL 654 H VAL 654 -16.620 19.440 -16.546 1075 HA VAL 654 HA VAL 654 -15.347 17.326 -18.016 1076 HB VAL 654 HB VAL 654 -14.448 19.364 -15.983 1077 1HG1 VAL 654 3HG1 VAL 654 -13.194 17.187 -15.740 1078 2HG1 VAL 654 1HG1 VAL 654 -12.639 17.398 -17.418 1079 3HG1 VAL 654 2HG1 VAL 654 -12.191 18.592 -16.176 1080 1HG2 VAL 654 2HG2 VAL 654 -14.916 19.587 -18.689 1081 2HG2 VAL 654 3HG2 VAL 654 -13.843 20.638 -17.734 1082 3HG2 VAL 654 1HG2 VAL 654 -13.168 19.255 -18.629 1083 H GLN 655 H GLN 655 -16.277 18.036 -14.596 1084 HA GLN 655 HA GLN 655 -15.127 15.903 -13.401 1085 1HB GLN 655 1HB GLN 655 -17.352 17.731 -12.840 1086 2HB GLN 655 2HB GLN 655 -17.632 16.152 -12.134 1087 1HG GLN 655 1HG GLN 655 -14.848 17.000 -11.744 1088 2HG GLN 655 2HG GLN 655 -15.963 18.194 -11.109 1089 1HE2 GLN 655 1HE2 GLN 655 -14.411 16.986 -9.352 1090 2HE2 GLN 655 2HE2 GLN 655 -15.260 15.829 -8.382 1091 H GLN 656 H GLN 656 -18.281 16.044 -15.155 1092 HA GLN 656 HA GLN 656 -18.980 13.409 -14.540 1093 1HB GLN 656 1HB GLN 656 -19.921 15.518 -16.460 1094 2HB GLN 656 2HB GLN 656 -20.414 13.868 -16.786 1095 1HG GLN 656 1HG GLN 656 -21.916 13.886 -15.079 1096 2HG GLN 656 2HG GLN 656 -20.719 14.470 -13.940 1097 1HE2 GLN 656 1HE2 GLN 656 -19.971 16.857 -15.100 1098 2HE2 GLN 656 2HE2 GLN 656 -21.285 17.986 -15.065 1099 H LYS 657 H LYS 657 -17.034 14.936 -17.113 1100 HA LYS 657 HA LYS 657 -16.990 12.681 -18.814 1101 1HB LYS 657 1HB LYS 657 -15.236 15.137 -18.578 1102 2HB LYS 657 2HB LYS 657 -14.996 13.908 -19.803 1103 1HG LYS 657 1HG LYS 657 -17.160 14.308 -20.787 1104 2HG LYS 657 2HG LYS 657 -17.711 15.225 -19.398 1105 1HD LYS 657 1HD LYS 657 -15.930 16.963 -19.906 1106 2HD LYS 657 2HD LYS 657 -15.526 16.071 -21.359 1107 1HE LYS 657 1HE LYS 657 -17.973 16.304 -22.078 1108 2HE LYS 657 2HE LYS 657 -18.212 17.370 -20.708 1109 H TRP 658 H TRP 658 -15.076 13.763 -15.997 1110 HA TRP 658 HA TRP 658 -13.000 11.874 -16.368 1111 1HB TRP 658 1HB TRP 658 -12.538 13.816 -15.102 1112 2HB TRP 658 2HB TRP 658 -13.913 13.561 -14.045 1113 HD1 TRP 658 HD TRP 658 -13.518 11.978 -11.926 1114 HE1 TRP 658 1HE TRP 658 -11.464 10.746 -10.819 1115 HE3 TRP 658 3HE TRP 658 -10.349 12.615 -15.851 1116 HZ2 TRP 658 2HZ TRP 658 -8.804 10.188 -11.689 1117 HZ3 TRP 658 3HZ TRP 658 -8.042 11.697 -15.641 1118 HH2 TRP 658 HH TRP 658 -7.253 10.518 -13.650 1119 H ASP 659 H ASP 659 -15.889 12.057 -14.160 1120 HA ASP 659 HA ASP 659 -15.513 9.521 -13.118 1121 1HB ASP 659 1HB ASP 659 -16.994 11.371 -12.201 1122 2HB ASP 659 2HB ASP 659 -18.141 11.035 -13.482 1123 HD2 ASP 659 HD ASP 659 -16.440 9.238 -11.049 1124 H ALA 660 H ALA 660 -17.065 10.790 -16.066 1125 HA ALA 660 HA ALA 660 -18.758 8.718 -16.718 1126 1HB ALA 660 2HB ALA 660 -18.933 10.617 -18.054 1127 2HB ALA 660 3HB ALA 660 -17.170 10.767 -18.255 1128 3HB ALA 660 1HB ALA 660 -18.063 9.506 -19.139 1129 H THR 661 H THR 661 -15.790 9.106 -18.691 1130 HA THR 661 HA THR 661 -15.571 6.437 -19.324 1131 HB THR 661 HB THR 661 -13.359 7.097 -20.157 1132 HG1 THR 661 1HG THR 661 -12.398 8.998 -19.209 1133 1HG2 THR 661 2HG2 THR 661 -15.555 8.409 -20.995 1134 2HG2 THR 661 3HG2 THR 661 -14.761 9.776 -20.178 1135 3HG2 THR 661 1HG2 THR 661 -13.933 8.931 -21.509 1136 H ALA 662 H ALA 662 -14.747 8.059 -16.328 1137 HA ALA 662 HA ALA 662 -12.782 6.355 -15.381 1138 1HB ALA 662 3HB ALA 662 -13.091 8.231 -14.070 1139 2HB ALA 662 2HB ALA 662 -14.009 7.044 -13.112 1140 3HB ALA 662 1HB ALA 662 -14.865 8.164 -14.198 1141 H THR 663 H THR 663 -16.080 6.247 -13.942 1142 HA THR 663 HA THR 663 -15.972 3.683 -13.056 1143 HB THR 663 HB THR 663 -17.794 5.035 -12.347 1144 HG1 THR 663 1HG THR 663 -19.183 3.353 -12.719 1145 1HG2 THR 663 3HG2 THR 663 -17.770 5.953 -15.123 1146 2HG2 THR 663 1HG2 THR 663 -19.410 5.438 -14.662 1147 3HG2 THR 663 2HG2 THR 663 -18.573 6.691 -13.716 1148 H GLU 664 H GLU 664 -16.379 4.774 -16.392 1149 HA GLU 664 HA GLU 664 -17.489 2.432 -17.377 1150 1HB GLU 664 1HB GLU 664 -17.520 4.449 -18.708 1151 2HB GLU 664 2HB GLU 664 -15.775 4.592 -18.663 1152 1HG GLU 664 1HG GLU 664 -16.192 3.668 -20.805 1153 2HG GLU 664 2HG GLU 664 -15.716 2.278 -19.850 1154 HE2 GLU 664 HE GLU 664 -16.925 0.901 -21.073 1155 H LEU 665 H LEU 665 -14.042 3.539 -17.132 1156 HA LEU 665 HA LEU 665 -13.085 1.032 -18.135 1157 1HB LEU 665 1HB LEU 665 -12.032 3.288 -18.499 1158 2HB LEU 665 2HB LEU 665 -11.545 3.267 -16.816 1159 HG LEU 665 HG LEU 665 -9.696 2.610 -18.225 1160 1HD1 LEU 665 3HD1 LEU 665 -10.405 1.357 -15.964 1161 2HD1 LEU 665 1HD1 LEU 665 -10.394 -0.037 -17.070 1162 3HD1 LEU 665 2HD1 LEU 665 -8.931 0.958 -16.878 1163 1HD2 LEU 665 3HD2 LEU 665 -11.040 1.774 -20.131 1164 2HD2 LEU 665 1HD2 LEU 665 -9.719 0.675 -19.667 1165 3HD2 LEU 665 2HD2 LEU 665 -11.395 0.299 -19.201 1166 H ASN 666 H ASN 666 -13.803 2.522 -14.998 1167 HA ASN 666 HA ASN 666 -12.244 0.819 -13.459 1168 1HB ASN 666 1HB ASN 666 -13.802 3.014 -12.948 1169 2HB ASN 666 2HB ASN 666 -14.886 1.765 -12.370 1170 1HD2 ASN 666 1HD2 ASN 666 -13.584 3.786 -10.836 1171 2HD2 ASN 666 2HD2 ASN 666 -12.564 3.020 -9.664 1172 H ASN 667 H ASN 667 -15.739 0.778 -14.466 1173 HA ASN 667 HA ASN 667 -16.426 -1.518 -13.110 1174 1HB ASN 667 1HB ASN 667 -17.517 -0.377 -15.736 1175 2HB ASN 667 2HB ASN 667 -18.315 -1.638 -14.819 1176 1HD2 ASN 667 1HD2 ASN 667 -19.034 1.170 -15.532 1177 2HD2 ASN 667 2HD2 ASN 667 -19.470 1.949 -14.048 1178 H ALA 668 H ALA 668 -15.463 -0.969 -16.583 1179 HA ALA 668 HA ALA 668 -15.606 -3.546 -17.488 1180 1HB ALA 668 3HB ALA 668 -14.981 -1.211 -18.596 1181 2HB ALA 668 1HB ALA 668 -13.318 -1.791 -18.335 1182 3HB ALA 668 2HB ALA 668 -14.448 -2.745 -19.326 1183 H LEU 669 H LEU 669 -12.932 -1.901 -15.702 1184 HA LEU 669 HA LEU 669 -11.114 -4.007 -15.882 1185 1HB LEU 669 1HB LEU 669 -11.389 -1.478 -14.497 1186 2HB LEU 669 2HB LEU 669 -10.656 -2.686 -13.460 1187 HG LEU 669 HG LEU 669 -9.625 -2.231 -16.255 1188 1HD1 LEU 669 3HD1 LEU 669 -9.790 -0.082 -14.778 1189 2HD1 LEU 669 1HD1 LEU 669 -8.406 -0.798 -13.918 1190 3HD1 LEU 669 2HD1 LEU 669 -8.289 -0.450 -15.660 1191 1HD2 LEU 669 2HD2 LEU 669 -9.016 -4.167 -14.499 1192 2HD2 LEU 669 3HD2 LEU 669 -7.844 -3.490 -15.654 1193 3HD2 LEU 669 1HD2 LEU 669 -7.862 -2.921 -13.967 1194 H GLN 670 H GLN 670 -13.808 -3.315 -13.611 1195 HA GLN 670 HA GLN 670 -13.136 -5.301 -11.790 1196 1HB GLN 670 1HB GLN 670 -15.523 -3.619 -12.403 1197 2HB GLN 670 2HB GLN 670 -15.860 -5.102 -11.532 1198 1HG GLN 670 1HG GLN 670 -13.565 -4.059 -10.256 1199 2HG GLN 670 2HG GLN 670 -14.548 -2.647 -10.587 1200 1HE2 GLN 670 1HE2 GLN 670 -13.857 -4.136 -8.098 1201 2HE2 GLN 670 2HE2 GLN 670 -15.359 -4.486 -7.309 1202 H ASN 671 H ASN 671 -15.456 -5.283 -14.584 1203 HA ASN 671 HA ASN 671 -16.159 -7.966 -14.215 1204 1HB ASN 671 1HB ASN 671 -17.332 -6.014 -15.579 1205 2HB ASN 671 2HB ASN 671 -16.295 -6.528 -16.895 1206 1HD2 ASN 671 1HD2 ASN 671 -16.347 -8.792 -17.525 1207 2HD2 ASN 671 2HD2 ASN 671 -17.829 -9.684 -17.424 1208 H LEU 672 H LEU 672 -13.516 -6.231 -15.796 1209 HA LEU 672 HA LEU 672 -12.796 -8.355 -17.566 1210 1HB LEU 672 1HB LEU 672 -12.273 -6.193 -18.284 1211 2HB LEU 672 2HB LEU 672 -11.574 -5.739 -16.742 1212 HG LEU 672 HG LEU 672 -9.945 -6.074 -18.628 1213 1HD1 LEU 672 3HD1 LEU 672 -9.510 -6.283 -16.068 1214 2HD1 LEU 672 1HD1 LEU 672 -9.291 -8.012 -16.430 1215 3HD1 LEU 672 2HD1 LEU 672 -8.260 -6.799 -17.225 1216 1HD2 LEU 672 2HD2 LEU 672 -11.151 -8.108 -19.535 1217 2HD2 LEU 672 3HD2 LEU 672 -9.378 -8.230 -19.422 1218 3HD2 LEU 672 1HD2 LEU 672 -10.405 -9.032 -18.210 1219 H ALA 673 H ALA 673 -11.795 -7.173 -14.318 1220 HA ALA 673 HA ALA 673 -9.755 -9.204 -14.141 1221 1HB ALA 673 3HB ALA 673 -9.958 -6.724 -13.112 1222 2HB ALA 673 1HB ALA 673 -10.677 -7.638 -11.765 1223 3HB ALA 673 2HB ALA 673 -9.027 -8.014 -12.315 1224 H ARG 674 H ARG 674 -13.168 -8.925 -13.637 1225 HA ARG 674 HA ARG 674 -13.362 -10.685 -11.472 1226 1HB ARG 674 1HB ARG 674 -15.253 -9.542 -13.530 1227 2HB ARG 674 2HB ARG 674 -15.805 -10.929 -12.612 1228 1HG ARG 674 1HG ARG 674 -14.513 -8.789 -10.983 1229 2HG ARG 674 2HG ARG 674 -16.011 -8.315 -11.758 1230 1HD ARG 674 1HD ARG 674 -15.652 -10.779 -9.982 1231 2HD ARG 674 2HD ARG 674 -16.406 -9.277 -9.485 1232 HE ARG 674 HE ARG 674 -17.599 -11.352 -11.161 1233 2HH1 ARG 674 1HH ARG 674 -20.539 -9.597 -11.743 1234 1HH2 ARG 674 2HH2 ARG 674 -17.708 -7.903 -10.356 1235 2HH2 ARG 674 1HH2 ARG 674 -19.349 -7.708 -10.872 1236 H THR 675 H THR 675 -13.006 -11.047 -14.977 1237 HA THR 675 HA THR 675 -13.557 -13.926 -14.752 1238 HB THR 675 HB THR 675 -13.353 -12.075 -17.187 1239 HG1 THR 675 1HG THR 675 -15.538 -11.865 -16.784 1240 1HG2 THR 675 3HG2 THR 675 -12.938 -14.594 -17.572 1241 2HG2 THR 675 1HG2 THR 675 -14.584 -14.864 -16.949 1242 3HG2 THR 675 2HG2 THR 675 -14.338 -13.912 -18.433 1243 H ILE 676 H ILE 676 -11.020 -11.657 -14.701 1244 HA ILE 676 HA ILE 676 -9.160 -13.525 -15.947 1245 HB ILE 676 HB ILE 676 -9.053 -10.631 -15.168 1246 1HG1 ILE 676 1HG1 ILE 676 -8.674 -12.186 -17.736 1247 2HG1 ILE 676 2HG1 ILE 676 -9.947 -11.047 -17.346 1248 1HG2 ILE 676 2HG2 ILE 676 -6.845 -12.516 -15.066 1249 2HG2 ILE 676 3HG2 ILE 676 -6.565 -11.233 -16.267 1250 3HG2 ILE 676 1HG2 ILE 676 -6.917 -10.807 -14.575 1251 1HD1 ILE 676 1HD1 ILE 676 -7.935 -9.350 -16.978 1252 2HD1 ILE 676 2HD1 ILE 676 -7.050 -10.504 -18.005 1253 3HD1 ILE 676 3HD1 ILE 676 -8.516 -9.705 -18.622 1254 H SER 677 H SER 677 -9.613 -11.663 -12.862 1255 HA SER 677 HA SER 677 -7.561 -12.639 -11.459 1256 1HB SER 677 1HB SER 677 -8.993 -11.000 -10.464 1257 2HB SER 677 2HB SER 677 -10.411 -12.017 -10.618 1258 HG SER 677 HG SER 677 -9.963 -12.484 -8.563 1259 H GLU 678 H GLU 678 -10.513 -14.345 -12.460 1260 HA GLU 678 HA GLU 678 -10.360 -16.440 -10.647 1261 1HB GLU 678 1HB GLU 678 -11.651 -17.654 -12.613 1262 2HB GLU 678 2HB GLU 678 -12.410 -16.334 -11.744 1263 1HG GLU 678 1HG GLU 678 -12.361 -14.935 -13.560 1264 2HG GLU 678 2HG GLU 678 -10.743 -15.425 -14.022 1265 HE2 GLU 678 HE GLU 678 -10.595 -17.449 -15.040 1266 H ALA 679 H ALA 679 -8.553 -15.676 -13.581 1267 HA ALA 679 HA ALA 679 -7.727 -18.047 -14.537 1268 1HB ALA 679 3HB ALA 679 -6.073 -15.555 -13.971 1269 2HB ALA 679 1HB ALA 679 -5.578 -16.874 -15.059 1270 3HB ALA 679 2HB ALA 679 -7.018 -15.899 -15.440 1271 H GLY 680 H GLY 680 -7.034 -16.653 -11.356 1272 1HA GLY 680 2HA GLY 680 -6.239 -17.701 -9.508 1273 2HA GLY 680 1HA GLY 680 -4.785 -17.812 -10.479 1274 H GLN 681 H GLN 681 -7.789 -19.520 -9.510 1275 HA GLN 681 HA GLN 681 -6.485 -21.986 -10.368 1276 1HB GLN 681 1HB GLN 681 -6.874 -21.299 -7.761 1277 2HB GLN 681 2HB GLN 681 -8.410 -22.081 -8.077 1278 1HG GLN 681 1HG GLN 681 -7.307 -24.140 -8.786 1279 2HG GLN 681 2HG GLN 681 -5.734 -23.369 -8.772 1280 1HE2 GLN 681 1HE2 GLN 681 -4.605 -24.251 -7.213 1281 2HE2 GLN 681 2HE2 GLN 681 -5.095 -24.477 -5.567 1282 H ALA 682 H ALA 682 -9.543 -20.174 -9.838 1283 HA ALA 682 HA ALA 682 -11.451 -21.936 -10.475 1284 1HB ALA 682 3HB ALA 682 -11.061 -19.057 -11.358 1285 2HB ALA 682 1HB ALA 682 -12.569 -19.955 -11.654 1286 3HB ALA 682 2HB ALA 682 -12.015 -19.671 -9.986 1287 H MET 683 H MET 683 -9.906 -19.887 -13.054 1288 HA MET 683 HA MET 683 -10.865 -21.077 -15.204 1289 1HB MET 683 1HB MET 683 -9.243 -19.185 -15.221 1290 2HB MET 683 2HB MET 683 -7.955 -20.248 -14.691 1291 1HG MET 683 1HG MET 683 -8.623 -21.635 -16.884 1292 2HG MET 683 2HG MET 683 -9.299 -20.102 -17.397 1293 1HE MET 683 3HE MET 683 -6.906 -22.312 -17.657 1294 2HE MET 683 1HE MET 683 -5.624 -21.439 -18.530 1295 3HE MET 683 2HE MET 683 -5.434 -21.800 -16.797 1296 H ALA 684 H ALA 684 -8.540 -22.502 -12.942 1297 HA ALA 684 HA ALA 684 -7.941 -24.679 -14.761 1298 1HB ALA 684 3HB ALA 684 -6.342 -25.337 -13.093 1299 2HB ALA 684 1HB ALA 684 -6.244 -23.565 -13.233 1300 3HB ALA 684 2HB ALA 684 -7.107 -24.303 -11.862 1301 H SER 685 H SER 685 -9.665 -24.039 -11.648 1302 HA SER 685 HA SER 685 -10.341 -26.606 -11.058 1303 1HB SER 685 1HB SER 685 -11.795 -23.976 -10.602 1304 2HB SER 685 2HB SER 685 -12.424 -25.485 -9.973 1305 HG SER 685 HG SER 685 -9.683 -24.842 -9.464 1306 H THR 686 H THR 686 -13.183 -24.636 -11.823 1307 HA THR 686 HA THR 686 -13.756 -25.583 -14.378 1308 HB THR 686 HB THR 686 -13.770 -27.737 -12.750 1309 HG1 THR 686 1HG THR 686 -15.565 -28.415 -14.293 1310 1HG2 THR 686 2HG2 THR 686 -15.671 -26.493 -11.366 1311 2HG2 THR 686 3HG2 THR 686 -16.703 -26.957 -12.740 1312 3HG2 THR 686 1HG2 THR 686 -15.880 -28.211 -11.783 1313 H GLU 687 H GLU 687 -16.434 -25.639 -14.537 1314 HA GLU 687 HA GLU 687 -17.039 -22.962 -13.826 1315 1HB GLU 687 1HB GLU 687 -17.741 -24.406 -15.939 1316 2HB GLU 687 2HB GLU 687 -19.080 -24.904 -14.924 1317 1HG GLU 687 1HG GLU 687 -19.563 -22.426 -14.497 1318 2HG GLU 687 2HG GLU 687 -18.352 -22.044 -15.705 1319 HE2 GLU 687 HE GLU 687 -19.491 -21.453 -17.380 1320 H GLY 688 H GLY 688 -18.266 -22.206 -12.121 1321 1HA GLY 688 2HA GLY 688 -19.721 -24.217 -10.518 1322 2HA GLY 688 1HA GLY 688 -20.139 -22.521 -10.654 1323 H ASN 689 H ASN 689 -16.767 -22.673 -10.629 1324 HA ASN 689 HA ASN 689 -16.172 -23.222 -8.009 1325 1HB ASN 689 1HB ASN 689 -14.751 -22.457 -10.262 1326 2HB ASN 689 2HB ASN 689 -14.619 -21.005 -9.289 1327 1HD2 ASN 689 1HD2 ASN 689 -13.411 -20.970 -7.467 1328 2HD2 ASN 689 2HD2 ASN 689 -12.403 -22.270 -6.924 1329 H VAL 690 H VAL 690 -16.597 -19.994 -9.666 1330 HA VAL 690 HA VAL 690 -17.050 -18.792 -7.038 1331 HB VAL 690 HB VAL 690 -16.381 -16.770 -7.959 1332 1HG1 VAL 690 2HG1 VAL 690 -14.720 -18.974 -8.190 1333 2HG1 VAL 690 3HG1 VAL 690 -14.573 -18.186 -9.779 1334 3HG1 VAL 690 1HG1 VAL 690 -14.220 -17.269 -8.295 1335 1HG2 VAL 690 1HG2 VAL 690 -17.514 -17.854 -10.429 1336 2HG2 VAL 690 2HG2 VAL 690 -17.331 -16.166 -9.897 1337 3HG2 VAL 690 3HG2 VAL 690 -15.976 -17.000 -10.695 1338 H THR 691 H THR 691 -18.709 -16.817 -7.255 1339 HA THR 691 HA THR 691 -21.069 -17.894 -8.657 1340 HB THR 691 HB THR 691 -22.377 -17.038 -6.742 1341 HG1 THR 691 1HG THR 691 -21.042 -16.032 -5.007 1342 1HG2 THR 691 2HG2 THR 691 -20.941 -19.273 -6.505 1343 2HG2 THR 691 3HG2 THR 691 -19.965 -18.287 -5.388 1344 3HG2 THR 691 1HG2 THR 691 -21.694 -18.556 -5.060 1345 H GLY 692 H GLY 692 -18.734 -15.488 -8.690 1346 1HA GLY 692 2HA GLY 692 -18.597 -13.500 -9.727 1347 2HA GLY 692 1HA GLY 692 -20.178 -13.134 -9.066 1348 H MET 693 H MET 693 -18.622 -15.084 -11.709 1349 HA MET 693 HA MET 693 -20.771 -14.140 -13.429 1350 1HB MET 693 1HB MET 693 -19.179 -14.587 -15.279 1351 2HB MET 693 2HB MET 693 -18.388 -13.604 -14.063 1352 1HG MET 693 1HG MET 693 -17.863 -16.214 -13.185 1353 2HG MET 693 2HG MET 693 -17.777 -16.367 -14.929 1354 1HE MET 693 2HE MET 693 -16.573 -15.395 -11.819 1355 2HE MET 693 3HE MET 693 -14.824 -15.290 -12.133 1356 3HE MET 693 1HE MET 693 -15.794 -13.804 -11.993 1357 H PHE 694 H PHE 694 -19.227 -17.006 -12.039 1358 HA PHE 694 HA PHE 694 -20.574 -18.795 -13.852 1359 1HB PHE 694 1HB PHE 694 -18.910 -19.089 -11.280 1360 2HB PHE 694 2HB PHE 694 -19.486 -20.468 -12.196 1361 HD1 PHE 694 1HD PHE 694 -16.585 -19.386 -11.503 1362 HD2 PHE 694 2HD PHE 694 -19.024 -19.341 -14.975 1363 HE1 PHE 694 1HE PHE 694 -14.532 -19.287 -12.944 1364 HE2 PHE 694 2HE PHE 694 -16.971 -19.241 -16.416 1365 HZ PHE 694 HZ PHE 694 -14.750 -19.216 -15.383 1366 H ALA 695 H ALA 695 -22.074 -20.492 -13.099 1367 HA ALA 695 HA ALA 695 -23.299 -20.133 -10.527 1368 1HB ALA 695 2HB ALA 695 -25.352 -19.274 -11.183 1369 2HB ALA 695 1HB ALA 695 -25.167 -19.825 -12.865 1370 3HB ALA 695 3HB ALA 695 -24.266 -18.401 -12.290 No H/Q in entry = 1370 Start of MODEL 25 1 H ALA 1 H ALA 1 -10.603 35.281 -4.449 2 HA ALA 1 HA ALA 1 -9.745 33.490 -3.291 3 1HB ALA 1 2HB ALA 1 -8.797 31.520 -4.528 4 2HB ALA 1 1HB ALA 1 -9.300 32.289 -6.053 5 3HB ALA 1 3HB ALA 1 -10.524 31.803 -4.855 6 H GLU 2 H GLU 2 -7.371 32.737 -2.973 7 HA GLU 2 HA GLU 2 -5.742 34.980 -3.787 8 1HB GLU 2 1HB GLU 2 -6.035 33.977 -1.345 9 2HB GLU 2 2HB GLU 2 -4.824 32.827 -1.875 10 1HG GLU 2 1HG GLU 2 -3.532 34.567 -0.923 11 2HG GLU 2 2HG GLU 2 -3.440 34.898 -2.642 12 HE2 GLU 2 HE GLU 2 -4.170 36.637 -3.315 13 H MET 3 H MET 3 -5.516 31.354 -3.575 14 HA MET 3 HA MET 3 -3.947 31.463 -6.011 15 1HB MET 3 1HB MET 3 -2.383 29.724 -4.980 16 2HB MET 3 2HB MET 3 -2.267 31.304 -4.231 17 1HG MET 3 1HG MET 3 -4.104 30.375 -2.564 18 2HG MET 3 2HG MET 3 -3.603 28.801 -3.152 19 1HE MET 3 3HE MET 3 -3.284 31.381 -0.769 20 2HE MET 3 1HE MET 3 -3.136 29.814 0.062 21 3HE MET 3 2HE MET 3 -1.814 31.002 0.160 22 H LYS 4 H LYS 4 -6.402 30.838 -6.465 23 HA LYS 4 HA LYS 4 -6.773 27.975 -6.005 24 1HB LYS 4 1HB LYS 4 -8.647 29.230 -5.275 25 2HB LYS 4 2HB LYS 4 -8.656 30.228 -6.715 26 1HG LYS 4 1HG LYS 4 -9.655 28.587 -8.030 27 2HG LYS 4 2HG LYS 4 -8.917 27.268 -7.144 28 1HD LYS 4 1HD LYS 4 -10.717 27.064 -5.771 29 2HD LYS 4 2HD LYS 4 -10.709 28.775 -5.394 30 1HE LYS 4 1HE LYS 4 -11.684 28.046 -8.134 31 2HE LYS 4 2HE LYS 4 -12.711 27.555 -6.801 32 H THR 5 H THR 5 -7.022 30.459 -8.646 33 HA THR 5 HA THR 5 -6.660 28.290 -10.579 34 HB THR 5 HB THR 5 -7.545 29.935 -12.175 35 HG1 THR 5 1HG THR 5 -7.441 32.103 -11.586 36 1HG2 THR 5 2HG2 THR 5 -8.944 29.730 -9.499 37 2HG2 THR 5 3HG2 THR 5 -9.559 30.904 -10.687 38 3HG2 THR 5 1HG2 THR 5 -9.494 29.173 -11.098 39 H ASP 6 H ASP 6 -4.816 30.514 -8.800 40 HA ASP 6 HA ASP 6 -3.101 31.660 -10.451 41 1HB ASP 6 1HB ASP 6 -2.742 30.230 -7.821 42 2HB ASP 6 2HB ASP 6 -1.295 30.767 -8.650 43 HD2 ASP 6 HD ASP 6 -1.631 33.783 -7.114 44 H ALA 7 H ALA 7 -1.756 30.945 -12.117 45 HA ALA 7 HA ALA 7 -1.652 28.361 -12.987 46 1HB ALA 7 1HB ALA 7 -0.248 30.894 -13.480 47 2HB ALA 7 2HB ALA 7 0.766 29.467 -13.804 48 3HB ALA 7 3HB ALA 7 -0.799 29.653 -14.631 49 H ALA 8 H ALA 8 0.068 29.882 -10.318 50 HA ALA 8 HA ALA 8 2.150 27.935 -10.203 51 1HB ALA 8 1HB ALA 8 2.018 29.103 -7.714 52 2HB ALA 8 3HB ALA 8 1.260 30.345 -8.739 53 3HB ALA 8 2HB ALA 8 2.904 29.771 -9.105 54 H THR 9 H THR 9 -0.989 28.518 -8.500 55 HA THR 9 HA THR 9 -0.711 26.265 -6.799 56 HB THR 9 HB THR 9 -2.241 28.505 -6.796 57 HG1 THR 9 1HG THR 9 -2.321 27.241 -4.950 58 1HG2 THR 9 1HG2 THR 9 -4.076 26.261 -7.790 59 2HG2 THR 9 2HG2 THR 9 -4.603 27.853 -7.194 60 3HG2 THR 9 3HG2 THR 9 -3.683 27.731 -8.712 61 H LEU 10 H LEU 10 -1.995 26.764 -10.085 62 HA LEU 10 HA LEU 10 -3.382 24.323 -10.213 63 1HB LEU 10 1HB LEU 10 -2.306 26.261 -12.240 64 2HB LEU 10 2HB LEU 10 -3.031 24.746 -12.739 65 HG LEU 10 HG LEU 10 -4.444 26.796 -11.013 66 1HD1 LEU 10 1HD1 LEU 10 -4.597 26.393 -14.013 67 2HD1 LEU 10 2HD1 LEU 10 -5.675 27.433 -13.052 68 3HD1 LEU 10 3HD1 LEU 10 -3.938 27.808 -13.158 69 1HD2 LEU 10 1HD2 LEU 10 -5.041 24.089 -11.663 70 2HD2 LEU 10 2HD2 LEU 10 -6.017 25.260 -10.745 71 3HD2 LEU 10 3HD2 LEU 10 -6.211 25.131 -12.509 72 H ALA 11 H ALA 11 -0.104 25.301 -11.441 73 HA ALA 11 HA ALA 11 0.619 22.774 -12.329 74 1HB ALA 11 1HB ALA 11 1.881 25.373 -11.765 75 2HB ALA 11 3HB ALA 11 2.169 24.229 -13.098 76 3HB ALA 11 2HB ALA 11 2.981 23.993 -11.531 77 H GLN 12 H GLN 12 0.388 24.150 -9.087 78 HA GLN 12 HA GLN 12 2.149 22.323 -7.883 79 1HB GLN 12 1HB GLN 12 0.817 24.632 -7.101 80 2HB GLN 12 2HB GLN 12 -0.031 23.399 -6.188 81 1HG GLN 12 1HG GLN 12 1.706 23.758 -4.707 82 2HG GLN 12 2HG GLN 12 2.485 22.546 -5.705 83 1HE2 GLN 12 1HE2 GLN 12 4.489 23.032 -6.121 84 2HE2 GLN 12 2HE2 GLN 12 5.144 24.593 -6.487 85 H GLU 13 H GLU 13 -1.389 22.398 -8.523 86 HA GLU 13 HA GLU 13 -1.650 19.846 -7.195 87 1HB GLU 13 1HB GLU 13 -4.027 20.190 -7.329 88 2HB GLU 13 2HB GLU 13 -3.324 21.724 -6.859 89 1HG GLU 13 1HG GLU 13 -3.314 21.723 -9.709 90 2HG GLU 13 2HG GLU 13 -4.873 21.071 -9.245 91 HE2 GLU 13 HE GLU 13 -5.942 24.232 -9.023 92 H ALA 14 H ALA 14 -1.448 21.311 -10.404 93 HA ALA 14 HA ALA 14 -2.601 19.132 -11.811 94 1HB ALA 14 2HB ALA 14 -2.228 21.629 -12.495 95 2HB ALA 14 3HB ALA 14 -0.597 21.084 -12.957 96 3HB ALA 14 1HB ALA 14 -2.029 20.359 -13.727 97 H GLY 15 H GLY 15 0.636 19.966 -10.566 98 1HA GLY 15 2HA GLY 15 2.576 18.831 -10.543 99 2HA GLY 15 1HA GLY 15 2.137 18.144 -12.094 100 H ASN 16 H ASN 16 0.151 17.810 -9.126 101 HA ASN 16 HA ASN 16 1.226 15.268 -8.512 102 1HB ASN 16 1HB ASN 16 0.304 16.093 -6.562 103 2HB ASN 16 2HB ASN 16 -0.825 17.121 -7.422 104 1HD2 ASN 16 1HD2 ASN 16 -2.826 16.680 -6.947 105 2HD2 ASN 16 2HD2 ASN 16 -3.534 15.119 -6.697 106 H PHE 17 H PHE 17 -1.424 16.624 -10.455 107 HA PHE 17 HA PHE 17 -2.912 14.204 -10.632 108 1HB PHE 17 1HB PHE 17 -3.872 16.502 -10.918 109 2HB PHE 17 2HB PHE 17 -2.772 16.821 -12.245 110 HD1 PHE 17 1HD PHE 17 -5.556 14.565 -11.241 111 HD2 PHE 17 2HD PHE 17 -3.431 16.379 -14.435 112 HE1 PHE 17 1HE PHE 17 -7.268 13.710 -12.866 113 HE2 PHE 17 2HE PHE 17 -5.143 15.523 -16.060 114 HZ PHE 17 HZ PHE 17 -7.041 14.199 -15.256 115 H GLU 18 H GLU 18 -0.870 16.081 -12.992 116 HA GLU 18 HA GLU 18 -0.990 14.552 -15.124 117 1HB GLU 18 1HB GLU 18 1.141 16.186 -13.877 118 2HB GLU 18 2HB GLU 18 1.754 14.995 -15.007 119 1HG GLU 18 1HG GLU 18 0.905 16.103 -16.816 120 2HG GLU 18 2HG GLU 18 -0.646 16.362 -16.042 121 HE2 GLU 18 HE GLU 18 0.180 18.340 -17.369 122 H ARG 19 H ARG 19 0.721 13.715 -12.090 123 HA ARG 19 HA ARG 19 2.059 11.512 -13.134 124 1HB ARG 19 1HB ARG 19 2.110 12.869 -10.750 125 2HB ARG 19 2HB ARG 19 1.207 11.450 -10.256 126 1HG ARG 19 1HG ARG 19 2.996 9.997 -10.626 127 2HG ARG 19 2HG ARG 19 3.675 10.980 -11.909 128 1HD ARG 19 1HD ARG 19 3.775 12.582 -9.536 129 2HD ARG 19 2HD ARG 19 4.330 10.986 -9.073 130 HE ARG 19 HE ARG 19 5.583 11.667 -11.547 131 2HH1 ARG 19 1HH ARG 19 8.498 13.051 -10.264 132 1HH2 ARG 19 2HH2 ARG 19 5.636 12.668 -8.149 133 2HH2 ARG 19 1HH2 ARG 19 7.277 13.221 -8.209 134 H ILE 20 H ILE 20 -1.110 11.934 -11.441 135 HA ILE 20 HA ILE 20 -1.719 9.204 -11.271 136 HB ILE 20 HB ILE 20 -3.560 11.596 -11.377 137 1HG1 ILE 20 1HG1 ILE 20 -2.626 10.256 -8.853 138 2HG1 ILE 20 2HG1 ILE 20 -1.614 11.462 -9.622 139 1HG2 ILE 20 3HG2 ILE 20 -4.634 9.365 -11.762 140 2HG2 ILE 20 1HG2 ILE 20 -4.060 8.875 -10.150 141 3HG2 ILE 20 2HG2 ILE 20 -5.204 10.228 -10.313 142 1HD1 ILE 20 1HD1 ILE 20 -3.957 12.813 -9.708 143 2HD1 ILE 20 2HD1 ILE 20 -4.282 11.784 -8.293 144 3HD1 ILE 20 3HD1 ILE 20 -2.875 12.874 -8.296 145 H SER 21 H SER 21 -2.414 11.725 -13.761 146 HA SER 21 HA SER 21 -4.070 10.247 -15.333 147 1HB SER 21 1HB SER 21 -2.326 11.774 -17.041 148 2HB SER 21 2HB SER 21 -3.966 12.145 -16.550 149 HG SER 21 HG SER 21 -2.793 13.849 -15.756 150 H GLY 22 H GLY 22 -0.449 10.558 -15.557 151 1HA GLY 22 2HA GLY 22 1.107 9.231 -16.487 152 2HA GLY 22 1HA GLY 22 -0.098 8.746 -17.664 153 H ASP 23 H ASP 23 0.013 8.304 -14.060 154 HA ASP 23 HA ASP 23 0.799 5.678 -14.114 155 1HB ASP 23 1HB ASP 23 -0.563 7.510 -12.193 156 2HB ASP 23 2HB ASP 23 -0.839 5.806 -11.886 157 HD2 ASP 23 HD ASP 23 1.868 5.255 -10.317 158 H LEU 24 H LEU 24 -2.400 7.264 -14.464 159 HA LEU 24 HA LEU 24 -3.962 4.946 -14.133 160 1HB LEU 24 1HB LEU 24 -4.320 7.742 -14.801 161 2HB LEU 24 2HB LEU 24 -5.346 6.723 -15.791 162 HG LEU 24 HG LEU 24 -5.262 6.780 -12.762 163 1HD1 LEU 24 1HD1 LEU 24 -6.655 8.389 -14.664 164 2HD1 LEU 24 2HD1 LEU 24 -7.838 7.357 -13.824 165 3HD1 LEU 24 3HD1 LEU 24 -6.753 8.414 -12.887 166 1HD2 LEU 24 2HD2 LEU 24 -5.904 4.598 -14.314 167 2HD2 LEU 24 3HD2 LEU 24 -6.459 4.898 -12.650 168 3HD2 LEU 24 1HD2 LEU 24 -7.488 5.358 -14.028 169 H LYS 25 H LYS 25 -2.530 6.600 -17.008 170 HA LYS 25 HA LYS 25 -3.665 4.760 -18.840 171 1HB LYS 25 1HB LYS 25 -3.180 6.698 -19.920 172 2HB LYS 25 2HB LYS 25 -1.791 7.057 -18.914 173 1HG LYS 25 1HG LYS 25 -0.327 5.822 -20.233 174 2HG LYS 25 2HG LYS 25 -1.549 4.654 -20.696 175 1HD LYS 25 1HD LYS 25 -0.920 6.047 -22.636 176 2HD LYS 25 2HD LYS 25 -2.600 6.318 -22.215 177 1HE LYS 25 1HE LYS 25 -2.104 8.537 -22.151 178 2HE LYS 25 2HE LYS 25 -1.261 8.215 -20.649 179 H THR 26 H THR 26 -0.601 4.976 -16.993 180 HA THR 26 HA THR 26 0.773 2.957 -18.358 181 HB THR 26 HB THR 26 0.880 4.222 -15.594 182 HG1 THR 26 1HG THR 26 2.611 3.944 -17.951 183 1HG2 THR 26 2HG2 THR 26 2.297 1.756 -16.589 184 2HG2 THR 26 3HG2 THR 26 3.293 2.991 -15.782 185 3HG2 THR 26 1HG2 THR 26 1.926 2.246 -14.918 186 H GLN 27 H GLN 27 -1.159 2.743 -15.292 187 HA GLN 27 HA GLN 27 -0.886 0.024 -15.046 188 1HB GLN 27 1HB GLN 27 -3.112 1.899 -14.147 189 2HB GLN 27 2HB GLN 27 -3.030 0.218 -13.657 190 1HG GLN 27 1HG GLN 27 -0.796 2.253 -13.200 191 2HG GLN 27 2HG GLN 27 -1.989 1.812 -11.994 192 1HE2 GLN 27 1HE2 GLN 27 0.815 0.848 -13.784 193 2HE2 GLN 27 2HE2 GLN 27 1.199 -0.597 -12.910 194 H ILE 28 H ILE 28 -3.447 1.970 -16.709 195 HA ILE 28 HA ILE 28 -5.123 -0.096 -17.401 196 HB ILE 28 HB ILE 28 -4.527 2.622 -18.426 197 1HG1 ILE 28 1HG1 ILE 28 -7.078 1.215 -17.580 198 2HG1 ILE 28 2HG1 ILE 28 -6.078 2.221 -16.550 199 1HG2 ILE 28 3HG2 ILE 28 -5.728 0.457 -20.087 200 2HG2 ILE 28 1HG2 ILE 28 -6.482 2.069 -20.139 201 3HG2 ILE 28 2HG2 ILE 28 -4.764 1.875 -20.564 202 1HD1 ILE 28 3HD1 ILE 28 -6.396 4.041 -18.439 203 2HD1 ILE 28 1HD1 ILE 28 -7.787 3.035 -18.910 204 3HD1 ILE 28 2HD1 ILE 28 -7.713 3.743 -17.279 205 H ASP 29 H ASP 29 -2.068 1.021 -18.921 206 HA ASP 29 HA ASP 29 -2.322 -0.529 -21.206 207 1HB ASP 29 1HB ASP 29 -0.475 1.292 -20.142 208 2HB ASP 29 2HB ASP 29 0.439 -0.201 -20.190 209 HD2 ASP 29 HD ASP 29 1.644 -0.051 -21.872 210 H GLN 30 H GLN 30 -0.903 -1.083 -17.931 211 HA GLN 30 HA GLN 30 0.413 -3.422 -18.424 212 1HB GLN 30 1HB GLN 30 -1.083 -2.600 -15.896 213 2HB GLN 30 2HB GLN 30 0.136 -3.855 -15.975 214 1HG GLN 30 1HG GLN 30 0.513 -0.872 -16.463 215 2HG GLN 30 2HG GLN 30 1.239 -1.845 -15.200 216 1HE2 GLN 30 1HE2 GLN 30 2.457 -0.159 -17.249 217 2HE2 GLN 30 2HE2 GLN 30 3.559 -1.149 -18.145 218 H VAL 31 H VAL 31 -3.033 -2.914 -17.410 219 HA VAL 31 HA VAL 31 -3.686 -5.627 -17.292 220 HB VAL 31 HB VAL 31 -5.251 -3.083 -17.670 221 1HG1 VAL 31 2HG1 VAL 31 -6.492 -4.852 -18.830 222 2HG1 VAL 31 3HG1 VAL 31 -6.390 -5.885 -17.384 223 3HG1 VAL 31 1HG1 VAL 31 -7.320 -4.368 -17.330 224 1HG2 VAL 31 2HG2 VAL 31 -4.092 -4.285 -15.443 225 2HG2 VAL 31 3HG2 VAL 31 -5.350 -3.026 -15.434 226 3HG2 VAL 31 1HG2 VAL 31 -5.808 -4.742 -15.332 227 H GLU 32 H GLU 32 -4.300 -3.179 -19.913 228 HA GLU 32 HA GLU 32 -5.420 -4.836 -21.714 229 1HB GLU 32 1HB GLU 32 -3.833 -2.320 -21.845 230 2HB GLU 32 2HB GLU 32 -3.909 -3.215 -23.350 231 1HG GLU 32 1HG GLU 32 -6.512 -3.380 -22.768 232 2HG GLU 32 2HG GLU 32 -6.170 -1.991 -21.756 233 HE2 GLU 32 HE GLU 32 -5.495 -1.601 -25.706 234 H SER 33 H SER 33 -1.954 -4.496 -20.876 235 HA SER 33 HA SER 33 -1.132 -6.140 -23.040 236 1HB SER 33 1HB SER 33 0.106 -4.447 -21.056 237 2HB SER 33 2HB SER 33 0.871 -6.022 -20.978 238 HG SER 33 HG SER 33 0.923 -4.089 -23.030 239 H THR 34 H THR 34 -1.229 -6.488 -19.416 240 HA THR 34 HA THR 34 -0.426 -9.131 -19.292 241 HB THR 34 HB THR 34 -1.919 -7.160 -17.592 242 HG1 THR 34 1HG THR 34 -0.138 -8.023 -16.201 243 1HG2 THR 34 3HG2 THR 34 -3.193 -9.413 -17.376 244 2HG2 THR 34 1HG2 THR 34 -1.664 -10.088 -16.763 245 3HG2 THR 34 2HG2 THR 34 -2.473 -8.771 -15.880 246 H ALA 35 H ALA 35 -3.735 -7.774 -19.767 247 HA ALA 35 HA ALA 35 -5.152 -10.112 -19.584 248 1HB ALA 35 1HB ALA 35 -6.882 -8.894 -20.532 249 2HB ALA 35 2HB ALA 35 -5.801 -7.574 -20.022 250 3HB ALA 35 3HB ALA 35 -5.818 -8.104 -21.721 251 H GLY 36 H GLY 36 -2.810 -9.094 -21.993 252 1HA GLY 36 2HA GLY 36 -1.952 -10.155 -23.778 253 2HA GLY 36 1HA GLY 36 -3.610 -10.476 -24.245 254 H SER 37 H SER 37 -1.738 -11.644 -21.366 255 HA SER 37 HA SER 37 -1.374 -14.202 -22.470 256 1HB SER 37 1HB SER 37 -1.218 -13.295 -19.561 257 2HB SER 37 2HB SER 37 -0.577 -14.800 -20.189 258 HG SER 37 HG SER 37 0.238 -12.248 -21.264 259 H LEU 38 H LEU 38 -3.983 -12.575 -20.789 260 HA LEU 38 HA LEU 38 -5.188 -14.969 -19.781 261 1HB LEU 38 1HB LEU 38 -5.880 -12.063 -19.882 262 2HB LEU 38 2HB LEU 38 -7.151 -13.228 -19.566 263 HG LEU 38 HG LEU 38 -6.572 -12.836 -17.422 264 1HD1 LEU 38 3HD1 LEU 38 -5.939 -15.222 -17.961 265 2HD1 LEU 38 1HD1 LEU 38 -4.244 -14.681 -17.987 266 3HD1 LEU 38 2HD1 LEU 38 -5.201 -14.534 -16.494 267 1HD2 LEU 38 3HD2 LEU 38 -3.876 -12.022 -18.492 268 2HD2 LEU 38 1HD2 LEU 38 -5.105 -11.039 -17.659 269 3HD2 LEU 38 2HD2 LEU 38 -4.159 -12.241 -16.748 270 H GLN 39 H GLN 39 -6.319 -12.522 -22.224 271 HA GLN 39 HA GLN 39 -8.276 -14.102 -23.267 272 1HB GLN 39 1HB GLN 39 -7.919 -12.638 -25.377 273 2HB GLN 39 2HB GLN 39 -8.308 -11.820 -23.876 274 1HG GLN 39 1HG GLN 39 -5.460 -12.100 -23.917 275 2HG GLN 39 2HG GLN 39 -5.922 -11.569 -25.522 276 1HE2 GLN 39 1HE2 GLN 39 -7.426 -10.960 -22.363 277 2HE2 GLN 39 2HE2 GLN 39 -7.288 -9.234 -22.376 278 H GLY 40 H GLY 40 -4.834 -14.458 -23.512 279 1HA GLY 40 2HA GLY 40 -3.497 -15.625 -24.950 280 2HA GLY 40 1HA GLY 40 -4.853 -15.885 -26.029 281 H GLN 41 H GLN 41 -6.067 -16.647 -23.017 282 HA GLN 41 HA GLN 41 -5.874 -19.423 -23.594 283 1HB GLN 41 1HB GLN 41 -3.819 -19.385 -22.403 284 2HB GLN 41 2HB GLN 41 -4.407 -18.224 -21.229 285 1HG GLN 41 1HG GLN 41 -6.103 -20.025 -20.486 286 2HG GLN 41 2HG GLN 41 -5.208 -21.156 -21.481 287 1HE2 GLN 41 1HE2 GLN 41 -5.486 -19.708 -18.479 288 2HE2 GLN 41 2HE2 GLN 41 -3.971 -20.160 -17.772 289 H TRP 42 H TRP 42 -7.934 -20.133 -23.273 290 HA TRP 42 HA TRP 42 -9.279 -19.603 -20.822 291 1HB TRP 42 1HB TRP 42 -10.216 -18.186 -23.316 292 2HB TRP 42 2HB TRP 42 -11.270 -18.522 -21.957 293 HD1 TRP 42 HD TRP 42 -9.289 -15.757 -23.188 294 HE1 TRP 42 1HE TRP 42 -8.596 -13.987 -21.358 295 HE3 TRP 42 3HE TRP 42 -10.312 -18.718 -19.183 296 HZ2 TRP 42 2HZ TRP 42 -8.553 -14.023 -18.505 297 HZ3 TRP 42 3HZ TRP 42 -9.917 -17.774 -16.910 298 HH2 TRP 42 HH TRP 42 -9.069 -15.512 -16.536 299 H ARG 43 H ARG 43 -10.916 -21.175 -20.522 300 HA ARG 43 HA ARG 43 -11.451 -22.824 -22.850 301 1HB ARG 43 1HB ARG 43 -10.570 -23.750 -20.079 302 2HB ARG 43 2HB ARG 43 -11.390 -24.830 -21.189 303 1HG ARG 43 1HG ARG 43 -8.926 -23.278 -22.065 304 2HG ARG 43 2HG ARG 43 -8.769 -24.788 -21.190 305 1HD ARG 43 1HD ARG 43 -10.721 -25.136 -23.316 306 2HD ARG 43 2HD ARG 43 -9.267 -24.428 -23.991 307 HE ARG 43 HE ARG 43 -8.533 -26.564 -22.214 308 2HH1 ARG 43 1HH ARG 43 -8.213 -29.046 -24.622 309 1HH2 ARG 43 2HH2 ARG 43 -9.986 -26.037 -25.402 310 2HH2 ARG 43 1HH2 ARG 43 -9.468 -27.567 -26.028 311 H GLY 44 H GLY 44 -13.637 -22.419 -23.154 312 1HA GLY 44 2HA GLY 44 -15.384 -22.739 -20.791 313 2HA GLY 44 1HA GLY 44 -15.806 -23.182 -22.433 314 H ALA 45 H ALA 45 -16.621 -21.013 -20.180 315 HA ALA 45 HA ALA 45 -17.216 -18.983 -22.185 316 1HB ALA 45 2HB ALA 45 -18.719 -20.237 -20.206 317 2HB ALA 45 1HB ALA 45 -19.166 -18.748 -21.072 318 3HB ALA 45 3HB ALA 45 -18.346 -18.649 -19.495 319 H ALA 46 H ALA 46 -15.033 -19.687 -19.593 320 HA ALA 46 HA ALA 46 -14.657 -17.244 -18.402 321 1HB ALA 46 3HB ALA 46 -12.118 -18.288 -18.549 322 2HB ALA 46 1HB ALA 46 -13.351 -18.785 -17.366 323 3HB ALA 46 2HB ALA 46 -13.115 -19.730 -18.856 324 H GLY 47 H GLY 47 -13.729 -18.394 -21.643 325 1HA GLY 47 2HA GLY 47 -12.660 -17.386 -23.353 326 2HA GLY 47 1HA GLY 47 -11.873 -16.317 -22.208 327 H THR 48 H THR 48 -15.166 -16.917 -23.634 328 HA THR 48 HA THR 48 -15.429 -14.402 -24.754 329 HB THR 48 HB THR 48 -17.911 -15.060 -24.714 330 HG1 THR 48 1HG THR 48 -18.023 -16.281 -22.797 331 1HG2 THR 48 3HG2 THR 48 -15.877 -17.220 -25.478 332 2HG2 THR 48 1HG2 THR 48 -17.598 -17.261 -25.931 333 3HG2 THR 48 2HG2 THR 48 -16.543 -15.971 -26.557 334 H ALA 49 H ALA 49 -15.817 -15.437 -21.399 335 HA ALA 49 HA ALA 49 -17.348 -13.181 -20.612 336 1HB ALA 49 3HB ALA 49 -15.681 -15.252 -19.142 337 2HB ALA 49 1HB ALA 49 -16.586 -13.967 -18.307 338 3HB ALA 49 2HB ALA 49 -17.453 -15.173 -19.288 339 H ALA 50 H ALA 50 -13.835 -14.068 -20.439 340 HA ALA 50 HA ALA 50 -13.115 -11.562 -19.310 341 1HB ALA 50 1HB ALA 50 -11.030 -12.504 -19.165 342 2HB ALA 50 2HB ALA 50 -11.957 -14.001 -19.429 343 3HB ALA 50 3HB ALA 50 -11.121 -13.219 -20.792 344 H GLN 51 H GLN 51 -12.785 -13.047 -22.611 345 HA GLN 51 HA GLN 51 -11.549 -11.059 -23.885 346 1HB GLN 51 1HB GLN 51 -12.009 -12.942 -25.195 347 2HB GLN 51 2HB GLN 51 -13.694 -13.002 -24.718 348 1HG GLN 51 1HG GLN 51 -12.871 -10.538 -26.201 349 2HG GLN 51 2HG GLN 51 -12.821 -12.024 -27.129 350 1HE2 GLN 51 1HE2 GLN 51 -14.698 -9.488 -26.192 351 2HE2 GLN 51 2HE2 GLN 51 -16.286 -10.133 -26.446 352 H ALA 52 H ALA 52 -15.156 -11.305 -23.467 353 HA ALA 52 HA ALA 52 -15.727 -8.850 -24.657 354 1HB ALA 52 1HB ALA 52 -17.206 -10.917 -23.906 355 2HB ALA 52 2HB ALA 52 -17.395 -9.964 -22.414 356 3HB ALA 52 3HB ALA 52 -17.904 -9.281 -23.976 357 H ALA 53 H ALA 53 -14.653 -9.762 -21.381 358 HA ALA 53 HA ALA 53 -15.281 -7.242 -20.222 359 1HB ALA 53 1HB ALA 53 -13.207 -9.195 -19.204 360 2HB ALA 53 3HB ALA 53 -14.943 -9.577 -19.122 361 3HB ALA 53 2HB ALA 53 -14.307 -8.145 -18.279 362 H VAL 54 H VAL 54 -12.524 -8.673 -21.975 363 HA VAL 54 HA VAL 54 -10.740 -6.554 -21.262 364 HB VAL 54 HB VAL 54 -10.504 -8.551 -23.514 365 1HG1 VAL 54 2HG1 VAL 54 -8.901 -6.475 -23.079 366 2HG1 VAL 54 3HG1 VAL 54 -8.201 -7.577 -21.869 367 3HG1 VAL 54 1HG1 VAL 54 -8.263 -8.059 -23.581 368 1HG2 VAL 54 2HG2 VAL 54 -10.851 -9.178 -20.803 369 2HG2 VAL 54 3HG2 VAL 54 -10.230 -10.245 -22.084 370 3HG2 VAL 54 1HG2 VAL 54 -9.098 -9.301 -21.086 371 H VAL 55 H VAL 55 -12.855 -7.414 -24.049 372 HA VAL 55 HA VAL 55 -11.969 -5.360 -25.729 373 HB VAL 55 HB VAL 55 -13.508 -7.509 -26.027 374 1HG1 VAL 55 1HG1 VAL 55 -15.469 -5.224 -25.668 375 2HG1 VAL 55 2HG1 VAL 55 -15.859 -6.738 -26.519 376 3HG1 VAL 55 3HG1 VAL 55 -15.422 -6.774 -24.794 377 1HG2 VAL 55 3HG2 VAL 55 -13.261 -4.987 -27.624 378 2HG2 VAL 55 1HG2 VAL 55 -12.695 -6.635 -27.990 379 3HG2 VAL 55 2HG2 VAL 55 -14.418 -6.226 -28.165 380 H ARG 56 H ARG 56 -14.785 -5.560 -23.447 381 HA ARG 56 HA ARG 56 -15.713 -3.035 -23.946 382 1HB ARG 56 1HB ARG 56 -15.962 -5.040 -21.737 383 2HB ARG 56 2HB ARG 56 -16.366 -3.394 -21.290 384 1HG ARG 56 1HG ARG 56 -18.423 -3.826 -22.170 385 2HG ARG 56 2HG ARG 56 -17.659 -3.639 -23.736 386 1HD ARG 56 1HD ARG 56 -17.213 -6.068 -23.859 387 2HD ARG 56 2HD ARG 56 -17.834 -6.297 -22.237 388 HE ARG 56 HE ARG 56 -19.409 -6.090 -24.639 389 2HH1 ARG 56 1HH ARG 56 -22.481 -5.624 -23.088 390 1HH2 ARG 56 2HH2 ARG 56 -19.462 -5.145 -21.225 391 2HH2 ARG 56 1HH2 ARG 56 -21.192 -5.099 -21.137 392 H PHE 57 H PHE 57 -13.334 -4.228 -21.485 393 HA PHE 57 HA PHE 57 -12.961 -1.754 -20.232 394 1HB PHE 57 1HB PHE 57 -12.125 -3.608 -19.027 395 2HB PHE 57 2HB PHE 57 -11.649 -4.457 -20.484 396 HD1 PHE 57 1HD PHE 57 -10.654 -1.772 -18.147 397 HD2 PHE 57 2HD PHE 57 -9.426 -4.339 -21.295 398 HE1 PHE 57 1HE PHE 57 -8.263 -1.122 -17.744 399 HE2 PHE 57 2HE PHE 57 -7.035 -3.689 -20.892 400 HZ PHE 57 HZ PHE 57 -6.482 -2.088 -19.122 401 H GLN 58 H GLN 58 -11.303 -3.382 -22.993 402 HA GLN 58 HA GLN 58 -9.208 -1.607 -23.192 403 1HB GLN 58 1HB GLN 58 -10.624 -3.369 -25.221 404 2HB GLN 58 2HB GLN 58 -9.253 -2.380 -25.682 405 1HG GLN 58 1HG GLN 58 -8.651 -3.804 -23.207 406 2HG GLN 58 2HG GLN 58 -9.199 -4.939 -24.424 407 1HE2 GLN 58 1HE2 GLN 58 -6.828 -5.488 -23.890 408 2HE2 GLN 58 2HE2 GLN 58 -5.630 -4.848 -24.966 409 H GLU 59 H GLU 59 -12.340 -1.664 -25.050 410 HA GLU 59 HA GLU 59 -11.919 0.616 -26.469 411 1HB GLU 59 1HB GLU 59 -14.450 -0.680 -25.404 412 2HB GLU 59 2HB GLU 59 -14.525 0.766 -26.392 413 1HG GLU 59 1HG GLU 59 -12.751 -1.359 -27.486 414 2HG GLU 59 2HG GLU 59 -14.437 -1.822 -27.378 415 HE2 GLU 59 HE GLU 59 -15.310 -1.415 -29.322 416 H ALA 60 H ALA 60 -12.925 0.201 -23.071 417 HA ALA 60 HA ALA 60 -13.653 2.954 -22.757 418 1HB ALA 60 3HB ALA 60 -13.237 0.616 -20.860 419 2HB ALA 60 2HB ALA 60 -14.777 1.323 -21.404 420 3HB ALA 60 1HB ALA 60 -13.713 2.242 -20.312 421 H ALA 61 H ALA 61 -10.743 0.946 -22.492 422 HA ALA 61 HA ALA 61 -9.233 2.532 -20.799 423 1HB ALA 61 2HB ALA 61 -8.745 0.207 -21.732 424 2HB ALA 61 1HB ALA 61 -7.362 1.327 -21.682 425 3HB ALA 61 3HB ALA 61 -8.200 1.016 -23.221 426 H ASN 62 H ASN 62 -10.220 2.972 -24.178 427 HA ASN 62 HA ASN 62 -8.255 4.950 -24.679 428 1HB ASN 62 1HB ASN 62 -10.690 5.044 -26.365 429 2HB ASN 62 2HB ASN 62 -9.024 4.796 -26.846 430 1HD2 ASN 62 1HD2 ASN 62 -8.350 2.592 -25.313 431 2HD2 ASN 62 2HD2 ASN 62 -9.227 1.198 -25.849 432 H LYS 63 H LYS 63 -11.757 4.786 -23.801 433 HA LYS 63 HA LYS 63 -12.405 7.453 -24.099 434 1HB LYS 63 1HB LYS 63 -13.680 5.148 -23.274 435 2HB LYS 63 2HB LYS 63 -13.668 6.108 -21.808 436 1HG LYS 63 1HG LYS 63 -15.664 6.765 -22.939 437 2HG LYS 63 2HG LYS 63 -14.538 8.074 -23.238 438 1HD LYS 63 1HD LYS 63 -15.575 7.566 -25.357 439 2HD LYS 63 2HD LYS 63 -13.934 6.959 -25.448 440 1HE LYS 63 1HE LYS 63 -14.624 4.787 -25.641 441 2HE LYS 63 2HE LYS 63 -15.793 4.949 -24.346 442 H GLN 64 H GLN 64 -10.763 5.721 -21.414 443 HA GLN 64 HA GLN 64 -10.802 7.996 -19.741 444 1HB GLN 64 1HB GLN 64 -9.782 5.220 -19.644 445 2HB GLN 64 2HB GLN 64 -8.762 6.359 -18.788 446 1HG GLN 64 1HG GLN 64 -11.781 6.290 -18.385 447 2HG GLN 64 2HG GLN 64 -10.701 5.274 -17.452 448 1HE2 GLN 64 1HE2 GLN 64 -9.758 6.055 -15.707 449 2HE2 GLN 64 2HE2 GLN 64 -9.721 7.713 -15.207 450 H LYS 65 H LYS 65 -8.286 6.359 -21.779 451 HA LYS 65 HA LYS 65 -6.169 7.996 -21.186 452 1HB LYS 65 1HB LYS 65 -6.921 6.123 -23.312 453 2HB LYS 65 2HB LYS 65 -5.849 7.389 -23.875 454 1HG LYS 65 1HG LYS 65 -4.292 5.841 -23.076 455 2HG LYS 65 2HG LYS 65 -4.487 6.855 -21.660 456 1HD LYS 65 1HD LYS 65 -4.812 4.789 -20.661 457 2HD LYS 65 2HD LYS 65 -6.471 5.131 -21.109 458 1HE LYS 65 1HE LYS 65 -6.106 2.916 -21.902 459 2HE LYS 65 2HE LYS 65 -5.970 3.908 -23.340 460 H GLN 66 H GLN 66 -9.033 8.604 -23.205 461 HA GLN 66 HA GLN 66 -7.913 10.896 -24.422 462 1HB GLN 66 1HB GLN 66 -9.775 9.486 -25.390 463 2HB GLN 66 2HB GLN 66 -10.847 10.106 -24.150 464 1HG GLN 66 1HG GLN 66 -11.317 11.683 -25.763 465 2HG GLN 66 2HG GLN 66 -9.914 12.476 -25.075 466 1HE2 GLN 66 1HE2 GLN 66 -11.225 12.137 -27.845 467 2HE2 GLN 66 2HE2 GLN 66 -9.902 11.812 -28.915 468 H GLU 67 H GLU 67 -10.390 10.351 -21.818 469 HA GLU 67 HA GLU 67 -10.755 13.035 -21.270 470 1HB GLU 67 1HB GLU 67 -11.387 10.439 -19.968 471 2HB GLU 67 2HB GLU 67 -11.283 11.793 -18.859 472 1HG GLU 67 1HG GLU 67 -13.598 11.402 -19.844 473 2HG GLU 67 2HG GLU 67 -12.984 13.031 -20.043 474 HE2 GLU 67 HE GLU 67 -14.591 12.320 -22.759 475 H LEU 68 H LEU 68 -8.136 10.838 -20.505 476 HA LEU 68 HA LEU 68 -7.201 12.233 -18.214 477 1HB LEU 68 1HB LEU 68 -6.032 10.162 -20.058 478 2HB LEU 68 2HB LEU 68 -5.089 10.891 -18.774 479 HG LEU 68 HG LEU 68 -7.694 9.403 -18.346 480 1HD1 LEU 68 3HD1 LEU 68 -5.540 8.147 -19.222 481 2HD1 LEU 68 1HD1 LEU 68 -5.052 8.280 -17.515 482 3HD1 LEU 68 2HD1 LEU 68 -6.569 7.454 -17.945 483 1HD2 LEU 68 3HD2 LEU 68 -6.482 11.229 -16.687 484 2HD2 LEU 68 1HD2 LEU 68 -7.592 9.934 -16.178 485 3HD2 LEU 68 2HD2 LEU 68 -5.832 9.680 -16.098 486 H ASP 69 H ASP 69 -5.940 11.999 -21.620 487 HA ASP 69 HA ASP 69 -4.071 13.979 -21.306 488 1HB ASP 69 1HB ASP 69 -4.725 12.273 -23.299 489 2HB ASP 69 2HB ASP 69 -5.511 13.702 -23.940 490 HD2 ASP 69 HD ASP 69 -2.561 12.252 -23.256 491 H GLU 70 H GLU 70 -7.458 14.082 -22.642 492 HA GLU 70 HA GLU 70 -7.553 16.695 -23.342 493 1HB GLU 70 1HB GLU 70 -9.823 16.357 -23.584 494 2HB GLU 70 2HB GLU 70 -9.322 14.686 -23.421 495 1HG GLU 70 1HG GLU 70 -9.825 14.746 -20.988 496 2HG GLU 70 2HG GLU 70 -10.259 16.440 -21.101 497 HE2 GLU 70 HE GLU 70 -11.186 13.869 -23.358 498 H ILE 71 H ILE 71 -8.211 15.227 -20.099 499 HA ILE 71 HA ILE 71 -8.818 17.731 -18.906 500 HB ILE 71 HB ILE 71 -8.223 14.979 -17.840 501 1HG1 ILE 71 1HG1 ILE 71 -10.781 16.605 -17.914 502 2HG1 ILE 71 2HG1 ILE 71 -10.359 15.349 -19.060 503 1HG2 ILE 71 2HG2 ILE 71 -8.214 17.532 -16.416 504 2HG2 ILE 71 3HG2 ILE 71 -9.395 16.371 -15.764 505 3HG2 ILE 71 1HG2 ILE 71 -7.678 15.918 -15.891 506 1HD1 ILE 71 3HD1 ILE 71 -10.128 14.559 -16.192 507 2HD1 ILE 71 1HD1 ILE 71 -11.779 14.894 -16.767 508 3HD1 ILE 71 2HD1 ILE 71 -10.791 13.652 -17.573 509 H SER 72 H SER 72 -5.934 15.527 -18.833 510 HA SER 72 HA SER 72 -4.398 17.116 -17.222 511 1HB SER 72 1HB SER 72 -3.339 15.443 -19.537 512 2HB SER 72 2HB SER 72 -2.499 15.842 -18.051 513 HG SER 72 HG SER 72 -3.660 13.631 -18.335 514 H THR 73 H THR 73 -5.372 17.520 -20.573 515 HA THR 73 HA THR 73 -3.258 19.459 -21.094 516 HB THR 73 HB THR 73 -5.453 18.098 -22.718 517 HG1 THR 73 1HG THR 73 -3.587 16.877 -22.795 518 1HG2 THR 73 3HG2 THR 73 -4.806 20.679 -23.291 519 2HG2 THR 73 1HG2 THR 73 -3.399 19.871 -24.023 520 3HG2 THR 73 2HG2 THR 73 -5.044 19.461 -24.567 521 H ASN 74 H ASN 74 -6.697 19.278 -20.237 522 HA ASN 74 HA ASN 74 -7.488 21.753 -21.032 523 1HB ASN 74 1HB ASN 74 -8.303 19.778 -18.960 524 2HB ASN 74 2HB ASN 74 -8.762 21.421 -18.560 525 1HD2 ASN 74 1HD2 ASN 74 -9.346 18.680 -20.502 526 2HD2 ASN 74 2HD2 ASN 74 -10.656 19.284 -21.461 527 H ILE 75 H ILE 75 -5.204 20.776 -18.558 528 HA ILE 75 HA ILE 75 -5.461 23.099 -16.925 529 HB ILE 75 HB ILE 75 -3.097 21.245 -17.042 530 1HG1 ILE 75 1HG1 ILE 75 -5.150 19.871 -17.056 531 2HG1 ILE 75 2HG1 ILE 75 -4.222 19.697 -15.580 532 1HG2 ILE 75 1HG2 ILE 75 -3.166 23.381 -15.621 533 2HG2 ILE 75 2HG2 ILE 75 -4.357 22.518 -14.618 534 3HG2 ILE 75 3HG2 ILE 75 -2.717 21.857 -14.818 535 1HD1 ILE 75 1HD1 ILE 75 -6.558 21.639 -15.832 536 2HD1 ILE 75 2HD1 ILE 75 -6.741 19.964 -15.258 537 3HD1 ILE 75 3HD1 ILE 75 -5.740 21.115 -14.340 538 H ARG 76 H ARG 76 -3.041 21.946 -19.375 539 HA ARG 76 HA ARG 76 -1.400 24.082 -19.287 540 1HB ARG 76 1HB ARG 76 -2.203 22.756 -21.914 541 2HB ARG 76 2HB ARG 76 -0.635 23.410 -21.486 542 1HG ARG 76 1HG ARG 76 -0.884 21.587 -19.482 543 2HG ARG 76 2HG ARG 76 -1.892 20.804 -20.682 544 1HD ARG 76 1HD ARG 76 0.559 21.785 -21.934 545 2HD ARG 76 2HD ARG 76 0.955 20.791 -20.547 546 HE ARG 76 HE ARG 76 -0.436 19.909 -23.003 547 2HH1 ARG 76 1HH ARG 76 -0.371 16.568 -22.056 548 1HH2 ARG 76 2HH2 ARG 76 0.529 19.099 -19.691 549 2HH2 ARG 76 1HH2 ARG 76 0.342 17.393 -19.922 550 H GLN 77 H GLN 77 -4.673 23.846 -20.591 551 HA GLN 77 HA GLN 77 -4.436 26.145 -22.236 552 1HB GLN 77 1HB GLN 77 -6.751 24.419 -21.304 553 2HB GLN 77 2HB GLN 77 -7.042 25.897 -22.199 554 1HG GLN 77 1HG GLN 77 -4.935 24.360 -23.505 555 2HG GLN 77 2HG GLN 77 -6.336 23.339 -23.251 556 1HE2 GLN 77 1HE2 GLN 77 -6.224 23.453 -25.653 557 2HE2 GLN 77 2HE2 GLN 77 -7.117 24.698 -26.461 558 H ALA 78 H ALA 78 -5.119 25.468 -18.852 559 HA ALA 78 HA ALA 78 -6.594 27.792 -18.272 560 1HB ALA 78 3HB ALA 78 -4.816 26.614 -16.193 561 2HB ALA 78 1HB ALA 78 -6.560 26.967 -16.141 562 3HB ALA 78 2HB ALA 78 -5.973 25.499 -16.958 563 H GLY 79 H GLY 79 -3.218 27.176 -18.977 564 1HA GLY 79 2HA GLY 79 -2.613 29.978 -18.256 565 2HA GLY 79 1HA GLY 79 -1.897 29.086 -19.585 566 H VAL 80 H VAL 80 -1.916 26.599 -17.632 567 HA VAL 80 HA VAL 80 0.087 27.397 -15.717 568 HB VAL 80 HB VAL 80 -0.743 24.577 -16.311 569 1HG1 VAL 80 2HG1 VAL 80 0.530 26.072 -14.104 570 2HG1 VAL 80 3HG1 VAL 80 -0.714 24.903 -13.597 571 3HG1 VAL 80 1HG1 VAL 80 0.675 24.360 -14.569 572 1HG2 VAL 80 1HG2 VAL 80 -2.418 26.720 -14.992 573 2HG2 VAL 80 2HG2 VAL 80 -2.875 25.578 -16.279 574 3HG2 VAL 80 3HG2 VAL 80 -2.627 24.993 -14.616 575 H GLN 81 H GLN 81 1.874 28.094 -16.959 576 HA GLN 81 HA GLN 81 3.230 25.875 -18.254 577 1HB GLN 81 1HB GLN 81 3.764 27.103 -20.203 578 2HB GLN 81 2HB GLN 81 2.076 27.485 -19.923 579 1HG GLN 81 1HG GLN 81 2.633 29.681 -19.905 580 2HG GLN 81 2HG GLN 81 3.494 29.407 -18.403 581 1HE2 GLN 81 1HE2 GLN 81 3.732 30.453 -21.534 582 2HE2 GLN 81 2HE2 GLN 81 5.445 30.375 -21.777 583 H TYR 82 H TYR 82 3.215 27.850 -15.704 584 HA TYR 82 HA TYR 82 6.051 27.737 -15.387 585 1HB TYR 82 1HB TYR 82 6.389 30.157 -15.339 586 2HB TYR 82 2HB TYR 82 5.472 29.858 -16.802 587 HD1 TYR 82 1HD TYR 82 2.740 29.714 -16.144 588 HD2 TYR 82 2HD TYR 82 5.749 32.092 -14.250 589 HE1 TYR 82 1HE TYR 82 0.961 31.350 -15.356 590 HE2 TYR 82 2HE TYR 82 3.960 33.720 -13.468 591 HH TYR 82 HH TYR 82 1.838 34.125 -13.324 592 H SER 83 H SER 83 6.396 27.257 -13.276 593 HA SER 83 HA SER 83 4.647 28.497 -11.338 594 1HB SER 83 1HB SER 83 3.446 26.547 -11.246 595 2HB SER 83 2HB SER 83 4.718 25.602 -11.994 596 HG SER 83 HG SER 83 4.496 24.916 -9.832 597 H ARG 84 H ARG 84 7.257 25.965 -11.631 598 HA ARG 84 HA ARG 84 8.523 27.104 -9.328 599 1HB ARG 84 1HB ARG 84 8.561 24.546 -10.754 600 2HB ARG 84 2HB ARG 84 10.200 25.102 -10.479 601 1HG ARG 84 1HG ARG 84 9.112 25.636 -8.021 602 2HG ARG 84 2HG ARG 84 8.115 24.276 -8.496 603 1HD ARG 84 1HD ARG 84 9.929 22.781 -8.562 604 2HD ARG 84 2HD ARG 84 11.099 24.042 -8.895 605 HE ARG 84 HE ARG 84 9.805 24.255 -6.258 606 2HH1 ARG 84 1HH ARG 84 12.700 23.427 -4.527 607 1HH2 ARG 84 2HH2 ARG 84 12.559 22.960 -8.072 608 2HH2 ARG 84 1HH2 ARG 84 13.562 22.791 -6.670 609 H ALA 85 H ALA 85 10.074 25.838 -12.349 610 HA ALA 85 HA ALA 85 11.470 28.417 -12.575 611 1HB ALA 85 2HB ALA 85 13.177 27.015 -11.858 612 2HB ALA 85 1HB ALA 85 13.288 26.795 -13.620 613 3HB ALA 85 3HB ALA 85 12.462 25.575 -12.622 614 H ASP 86 H ASP 86 11.228 25.390 -14.563 615 HA ASP 86 HA ASP 86 9.970 27.030 -16.608 616 1HB ASP 86 1HB ASP 86 11.982 24.874 -17.315 617 2HB ASP 86 2HB ASP 86 11.410 26.193 -18.316 618 HD2 ASP 86 HD ASP 86 13.356 25.490 -15.586 619 H GLU 87 H GLU 87 8.582 25.354 -14.805 620 HA GLU 87 HA GLU 87 8.340 22.764 -15.146 621 1HB GLU 87 1HB GLU 87 6.773 24.686 -14.019 622 2HB GLU 87 2HB GLU 87 5.731 24.218 -15.347 623 1HG GLU 87 1HG GLU 87 6.612 21.751 -14.365 624 2HG GLU 87 2HG GLU 87 6.456 22.710 -12.906 625 HE2 GLU 87 HE GLU 87 3.943 20.751 -13.518 626 H GLU 88 H GLU 88 7.222 25.247 -17.496 627 HA GLU 88 HA GLU 88 5.720 23.771 -19.151 628 1HB GLU 88 1HB GLU 88 6.131 26.167 -19.473 629 2HB GLU 88 2HB GLU 88 7.810 25.869 -19.877 630 1HG GLU 88 1HG GLU 88 6.575 24.221 -21.699 631 2HG GLU 88 2HG GLU 88 5.357 25.471 -21.540 632 HE2 GLU 88 HE GLU 88 6.403 25.991 -23.992 633 H GLN 89 H GLN 89 9.341 24.059 -19.266 634 HA GLN 89 HA GLN 89 9.540 22.183 -21.352 635 1HB GLN 89 1HB GLN 89 11.571 23.366 -19.419 636 2HB GLN 89 2HB GLN 89 12.025 22.233 -20.676 637 1HG GLN 89 1HG GLN 89 10.813 23.833 -22.331 638 2HG GLN 89 2HG GLN 89 10.797 24.998 -21.022 639 1HE2 GLN 89 1HE2 GLN 89 12.417 24.022 -23.679 640 2HE2 GLN 89 2HE2 GLN 89 14.016 24.597 -23.346 641 H GLN 90 H GLN 90 9.140 21.969 -17.892 642 HA GLN 90 HA GLN 90 10.359 19.405 -17.679 643 1HB GLN 90 1HB GLN 90 10.035 21.273 -15.850 644 2HB GLN 90 2HB GLN 90 8.439 20.576 -15.649 645 1HG GLN 90 1HG GLN 90 9.378 18.389 -15.101 646 2HG GLN 90 2HG GLN 90 10.992 18.909 -15.540 647 1HE2 GLN 90 1HE2 GLN 90 10.407 17.800 -13.091 648 2HE2 GLN 90 2HE2 GLN 90 10.601 18.972 -11.830 649 H GLN 91 H GLN 91 7.629 20.405 -19.246 650 HA GLN 91 HA GLN 91 5.490 19.111 -18.436 651 1HB GLN 91 1HB GLN 91 5.590 20.350 -20.549 652 2HB GLN 91 2HB GLN 91 6.617 19.127 -21.269 653 1HG GLN 91 1HG GLN 91 4.419 17.644 -20.353 654 2HG GLN 91 2HG GLN 91 3.685 19.136 -20.907 655 1HE2 GLN 91 1HE2 GLN 91 4.491 19.960 -23.048 656 2HE2 GLN 91 2HE2 GLN 91 4.713 18.811 -24.325 657 H ALA 92 H ALA 92 7.464 17.388 -20.937 658 HA ALA 92 HA ALA 92 7.202 14.963 -19.299 659 1HB ALA 92 3HB ALA 92 5.590 14.586 -20.949 660 2HB ALA 92 1HB ALA 92 6.510 15.463 -22.194 661 3HB ALA 92 2HB ALA 92 7.039 13.847 -21.670 662 H LEU 93 H LEU 93 8.673 15.531 -22.540 663 HA LEU 93 HA LEU 93 11.287 15.075 -21.280 664 1HB LEU 93 1HB LEU 93 9.986 13.770 -23.618 665 2HB LEU 93 2HB LEU 93 11.707 14.085 -23.716 666 HG LEU 93 HG LEU 93 11.407 11.851 -22.940 667 1HD1 LEU 93 1HD1 LEU 93 13.124 13.429 -21.814 668 2HD1 LEU 93 2HD1 LEU 93 12.063 13.306 -20.390 669 3HD1 LEU 93 3HD1 LEU 93 12.798 11.839 -21.081 670 1HD2 LEU 93 3HD2 LEU 93 9.047 12.258 -22.109 671 2HD2 LEU 93 1HD2 LEU 93 10.051 11.160 -21.132 672 3HD2 LEU 93 2HD2 LEU 93 9.778 12.834 -20.592 673 H SER 94 H SER 94 10.710 17.611 -21.250 674 HA SER 94 HA SER 94 11.737 18.659 -23.772 675 1HB SER 94 1HB SER 94 9.474 19.438 -22.139 676 2HB SER 94 2HB SER 94 10.618 20.765 -22.182 677 HG SER 94 HG SER 94 9.815 19.385 -24.587 678 H SER 95 H SER 95 11.947 18.608 -20.204 679 HA SER 95 HA SER 95 14.169 20.454 -20.314 680 1HB SER 95 1HB SER 95 12.237 20.519 -18.565 681 2HB SER 95 2HB SER 95 13.032 19.148 -17.817 682 HG SER 95 HG SER 95 14.791 21.245 -18.409 683 H GLN 96 H GLN 96 13.353 17.180 -18.942 684 HA GLN 96 HA GLN 96 15.925 16.532 -18.230 685 1HB GLN 96 1HB GLN 96 13.348 15.170 -18.527 686 2HB GLN 96 2HB GLN 96 14.672 14.107 -18.960 687 1HG GLN 96 1HG GLN 96 15.759 15.119 -16.714 688 2HG GLN 96 2HG GLN 96 14.080 15.423 -16.311 689 1HE2 GLN 96 1HE2 GLN 96 12.565 13.630 -16.458 690 2HE2 GLN 96 2HE2 GLN 96 13.088 12.024 -16.074 691 H MET 97 H MET 97 14.139 16.015 -21.326 692 HA MET 97 HA MET 97 16.000 14.442 -22.568 693 1HB MET 97 1HB MET 97 13.583 15.377 -23.253 694 2HB MET 97 2HB MET 97 14.501 16.634 -24.056 695 1HG MET 97 1HG MET 97 14.848 13.633 -24.535 696 2HG MET 97 2HG MET 97 13.974 14.726 -25.591 697 1HE MET 97 2HE MET 97 17.125 13.327 -24.321 698 2HE MET 97 3HE MET 97 16.991 12.839 -26.027 699 3HE MET 97 1HE MET 97 18.351 13.858 -25.497 700 H GLY 98 H GLY 98 18.171 15.068 -22.199 701 1HA GLY 98 2HA GLY 98 18.947 17.726 -23.218 702 2HA GLY 98 1HA GLY 98 19.730 16.276 -23.814 703 H PHE 99 H PHE 99 21.790 16.387 -22.960 704 HA PHE 99 HA PHE 99 22.252 15.645 -20.361 705 1HB PHE 99 1HB PHE 99 24.555 16.108 -20.969 706 2HB PHE 99 2HB PHE 99 23.769 15.742 -22.492 707 HD1 PHE 99 1HD PHE 99 25.475 18.263 -20.547 708 HD2 PHE 99 2HD PHE 99 23.149 17.603 -24.035 709 HE1 PHE 99 1HE PHE 99 26.230 20.472 -21.469 710 HE2 PHE 99 2HE PHE 99 23.904 19.812 -24.957 711 HZ PHE 99 HZ PHE 99 25.436 21.220 -23.663 712 H MET 601 H MET 601 5.638 -21.515 -16.608 713 HA MET 601 HA MET 601 8.188 -21.436 -18.006 714 1HB MET 601 1HB MET 601 7.692 -20.907 -15.196 715 2HB MET 601 2HB MET 601 8.545 -22.434 -15.302 716 1HG MET 601 1HG MET 601 9.814 -20.637 -17.155 717 2HG MET 601 2HG MET 601 9.595 -19.755 -15.657 718 1HE MET 601 3HE MET 601 10.879 -19.713 -13.983 719 2HE MET 601 1HE MET 601 12.112 -20.857 -13.400 720 3HE MET 601 2HE MET 601 12.448 -19.830 -14.815 721 H THR 602 H THR 602 6.189 -23.354 -15.643 722 HA THR 602 HA THR 602 7.229 -25.815 -15.971 723 HB THR 602 HB THR 602 4.322 -24.888 -15.750 724 HG1 THR 602 1HG THR 602 5.088 -24.656 -13.688 725 1HG2 THR 602 2HG2 THR 602 4.618 -27.359 -16.515 726 2HG2 THR 602 3HG2 THR 602 5.444 -27.615 -14.959 727 3HG2 THR 602 1HG2 THR 602 3.740 -27.100 -14.988 728 H GLU 603 H GLU 603 5.039 -24.144 -18.286 729 HA GLU 603 HA GLU 603 5.885 -26.153 -20.211 730 1HB GLU 603 1HB GLU 603 3.170 -25.665 -19.248 731 2HB GLU 603 2HB GLU 603 3.268 -25.377 -20.974 732 1HG GLU 603 1HG GLU 603 4.216 -27.909 -19.550 733 2HG GLU 603 2HG GLU 603 2.730 -27.759 -20.465 734 HE2 GLU 603 HE GLU 603 5.134 -29.483 -22.012 735 H GLN 604 H GLN 604 7.002 -25.111 -21.798 736 HA GLN 604 HA GLN 604 7.074 -22.383 -22.032 737 1HB GLN 604 1HB GLN 604 8.172 -22.846 -24.264 738 2HB GLN 604 2HB GLN 604 8.863 -23.734 -22.921 739 1HG GLN 604 1HG GLN 604 7.608 -25.758 -23.538 740 2HG GLN 604 2HG GLN 604 6.733 -24.885 -24.780 741 1HE2 GLN 604 1HE2 GLN 604 8.584 -27.227 -24.814 742 2HE2 GLN 604 2HE2 GLN 604 9.794 -26.869 -26.001 743 H GLN 605 H GLN 605 5.082 -24.828 -23.780 744 HA GLN 605 HA GLN 605 4.069 -23.398 -25.780 745 1HB GLN 605 1HB GLN 605 1.949 -24.738 -25.473 746 2HB GLN 605 2HB GLN 605 3.416 -25.697 -25.439 747 1HG GLN 605 1HG GLN 605 3.313 -26.023 -23.093 748 2HG GLN 605 2HG GLN 605 2.289 -24.623 -22.840 749 1HE2 GLN 605 1HE2 GLN 605 2.419 -27.944 -23.155 750 2HE2 GLN 605 2HE2 GLN 605 0.739 -28.307 -23.374 751 H TRP 606 H TRP 606 3.465 -22.920 -22.319 752 HA TRP 606 HA TRP 606 2.355 -20.358 -22.807 753 1HB TRP 606 1HB TRP 606 0.507 -22.605 -22.547 754 2HB TRP 606 2HB TRP 606 0.241 -21.368 -21.334 755 HD1 TRP 606 HD TRP 606 -0.270 -22.024 -25.033 756 HE1 TRP 606 1HE TRP 606 -1.513 -20.031 -26.236 757 HE3 TRP 606 3HE TRP 606 0.103 -18.759 -21.153 758 HZ2 TRP 606 2HZ TRP 606 -2.185 -17.372 -25.447 759 HZ3 TRP 606 3HZ TRP 606 -0.873 -16.485 -21.451 760 HH2 TRP 606 HH TRP 606 -1.987 -15.773 -23.507 761 H ASN 607 H ASN 607 4.075 -19.738 -21.415 762 HA ASN 607 HA ASN 607 4.874 -20.963 -19.165 763 1HB ASN 607 1HB ASN 607 4.638 -17.975 -19.776 764 2HB ASN 607 2HB ASN 607 5.481 -18.574 -18.361 765 1HD2 ASN 607 1HD2 ASN 607 7.399 -19.684 -18.553 766 2HD2 ASN 607 2HD2 ASN 607 8.348 -19.715 -20.002 767 H PHE 608 H PHE 608 3.173 -21.834 -17.842 768 HA PHE 608 HA PHE 608 0.816 -20.633 -17.191 769 1HB PHE 608 1HB PHE 608 2.517 -22.838 -16.380 770 2HB PHE 608 2HB PHE 608 1.989 -22.048 -14.908 771 HD1 PHE 608 1HD PHE 608 -0.076 -22.592 -13.998 772 HD2 PHE 608 2HD PHE 608 0.638 -23.420 -18.098 773 HE1 PHE 608 1HE PHE 608 -2.271 -23.800 -14.136 774 HE2 PHE 608 2HE PHE 608 -1.558 -24.629 -18.236 775 HZ PHE 608 HZ PHE 608 -2.986 -24.804 -16.253 776 H ALA 609 H ALA 609 3.977 -20.420 -15.423 777 HA ALA 609 HA ALA 609 3.022 -18.836 -13.335 778 1HB ALA 609 2HB ALA 609 5.773 -19.165 -14.591 779 2HB ALA 609 1HB ALA 609 5.121 -20.017 -13.171 780 3HB ALA 609 3HB ALA 609 5.474 -18.275 -13.079 781 H GLY 610 H GLY 610 3.416 -18.164 -16.696 782 1HA GLY 610 2HA GLY 610 3.601 -16.232 -17.882 783 2HA GLY 610 1HA GLY 610 4.006 -15.356 -16.419 784 H ILE 611 H ILE 611 1.165 -17.210 -17.750 785 HA ILE 611 HA ILE 611 -0.489 -14.905 -17.616 786 HB ILE 611 HB ILE 611 -0.768 -16.574 -19.333 787 1HG1 ILE 611 1HG1 ILE 611 -3.018 -16.031 -17.431 788 2HG1 ILE 611 2HG1 ILE 611 -2.749 -15.418 -19.051 789 1HG2 ILE 611 3HG2 ILE 611 -0.281 -18.438 -17.374 790 2HG2 ILE 611 1HG2 ILE 611 -2.026 -18.633 -17.667 791 3HG2 ILE 611 2HG2 ILE 611 -0.875 -18.784 -19.016 792 1HD1 ILE 611 2HD1 ILE 611 -2.948 -18.129 -19.544 793 2HD1 ILE 611 3HD1 ILE 611 -4.069 -17.928 -18.176 794 3HD1 ILE 611 1HD1 ILE 611 -4.302 -16.979 -19.664 795 H GLU 612 H GLU 612 0.475 -17.422 -15.386 796 HA GLU 612 HA GLU 612 -1.789 -17.450 -13.791 797 1HB GLU 612 1HB GLU 612 -0.098 -19.172 -13.572 798 2HB GLU 612 2HB GLU 612 1.143 -17.997 -13.183 799 1HG GLU 612 1HG GLU 612 -0.315 -17.362 -11.131 800 2HG GLU 612 2HG GLU 612 -1.243 -18.809 -11.471 801 HE2 GLU 612 HE GLU 612 0.585 -19.462 -8.998 802 H ALA 613 H ALA 613 1.080 -15.296 -13.894 803 HA ALA 613 HA ALA 613 0.185 -13.880 -11.534 804 1HB ALA 613 2HB ALA 613 2.589 -14.344 -11.953 805 2HB ALA 613 1HB ALA 613 2.253 -12.598 -11.859 806 3HB ALA 613 3HB ALA 613 2.504 -13.373 -13.442 807 H ALA 614 H ALA 614 -0.292 -13.857 -14.976 808 HA ALA 614 HA ALA 614 -0.567 -11.176 -15.526 809 1HB ALA 614 1HB ALA 614 -2.175 -13.548 -16.557 810 2HB ALA 614 2HB ALA 614 -2.071 -11.953 -17.338 811 3HB ALA 614 3HB ALA 614 -0.619 -12.974 -17.202 812 H ALA 615 H ALA 615 -3.105 -13.511 -14.370 813 HA ALA 615 HA ALA 615 -5.143 -11.649 -14.158 814 1HB ALA 615 1HB ALA 615 -6.289 -13.456 -13.424 815 2HB ALA 615 2HB ALA 615 -4.792 -14.365 -13.739 816 3HB ALA 615 3HB ALA 615 -5.137 -13.757 -12.102 817 H SER 616 H SER 616 -2.776 -12.805 -11.657 818 HA SER 616 HA SER 616 -3.710 -11.294 -9.597 819 1HB SER 616 1HB SER 616 -1.478 -12.940 -10.117 820 2HB SER 616 2HB SER 616 -0.779 -11.410 -9.624 821 HG SER 616 HG SER 616 -2.311 -11.512 -7.741 822 H ALA 617 H ALA 617 -1.790 -10.363 -12.436 823 HA ALA 617 HA ALA 617 -0.899 -7.881 -11.377 824 1HB ALA 617 3HB ALA 617 -0.249 -9.478 -13.518 825 2HB ALA 617 2HB ALA 617 0.269 -7.787 -13.322 826 3HB ALA 617 1HB ALA 617 -1.159 -8.171 -14.312 827 H ILE 618 H ILE 618 -3.717 -9.027 -13.292 828 HA ILE 618 HA ILE 618 -4.701 -6.505 -13.964 829 HB ILE 618 HB ILE 618 -6.120 -9.138 -13.548 830 1HG1 ILE 618 1HG1 ILE 618 -4.307 -9.226 -15.208 831 2HG1 ILE 618 2HG1 ILE 618 -5.887 -9.439 -15.937 832 1HG2 ILE 618 1HG2 ILE 618 -7.507 -6.944 -13.527 833 2HG2 ILE 618 2HG2 ILE 618 -7.144 -6.895 -15.268 834 3HG2 ILE 618 3HG2 ILE 618 -8.013 -8.287 -14.579 835 1HD1 ILE 618 2HD1 ILE 618 -5.300 -6.611 -15.893 836 2HD1 ILE 618 3HD1 ILE 618 -3.904 -7.476 -16.581 837 3HD1 ILE 618 1HD1 ILE 618 -5.519 -7.676 -17.303 838 H GLN 619 H GLN 619 -5.289 -8.640 -11.106 839 HA GLN 619 HA GLN 619 -7.232 -7.134 -9.934 840 1HB GLN 619 1HB GLN 619 -5.359 -9.234 -9.138 841 2HB GLN 619 2HB GLN 619 -5.637 -8.121 -7.814 842 1HG GLN 619 1HG GLN 619 -7.879 -9.408 -9.441 843 2HG GLN 619 2HG GLN 619 -7.280 -10.059 -7.928 844 1HE2 GLN 619 1HE2 GLN 619 -9.822 -8.657 -9.012 845 2HE2 GLN 619 2HE2 GLN 619 -10.247 -7.524 -7.772 846 H GLY 620 H GLY 620 -3.652 -6.988 -9.280 847 1HA GLY 620 2HA GLY 620 -2.349 -5.321 -8.525 848 2HA GLY 620 1HA GLY 620 -3.712 -4.808 -7.550 849 H ASN 621 H ASN 621 -3.636 -4.994 -11.148 850 HA ASN 621 HA ASN 621 -3.079 -2.267 -11.471 851 1HB ASN 621 1HB ASN 621 -4.052 -4.524 -13.237 852 2HB ASN 621 2HB ASN 621 -4.216 -2.888 -13.844 853 1HD2 ASN 621 1HD2 ASN 621 -2.187 -1.492 -13.399 854 2HD2 ASN 621 2HD2 ASN 621 -0.668 -2.191 -13.849 855 H VAL 622 H VAL 622 -6.003 -4.286 -11.090 856 HA VAL 622 HA VAL 622 -7.891 -2.467 -12.058 857 HB VAL 622 HB VAL 622 -7.985 -4.746 -10.087 858 1HG1 VAL 622 2HG1 VAL 622 -10.173 -2.863 -10.940 859 2HG1 VAL 622 3HG1 VAL 622 -10.546 -4.569 -10.594 860 3HG1 VAL 622 1HG1 VAL 622 -9.822 -3.542 -9.333 861 1HG2 VAL 622 3HG2 VAL 622 -7.743 -4.733 -12.828 862 2HG2 VAL 622 1HG2 VAL 622 -8.394 -6.074 -11.855 863 3HG2 VAL 622 2HG2 VAL 622 -9.501 -4.899 -12.604 864 H THR 623 H THR 623 -6.763 -3.142 -8.669 865 HA THR 623 HA THR 623 -8.256 -1.026 -7.550 866 HB THR 623 HB THR 623 -6.761 -1.528 -5.572 867 HG1 THR 623 1HG THR 623 -4.798 -2.280 -6.267 868 1HG2 THR 623 2HG2 THR 623 -8.592 -3.297 -6.763 869 2HG2 THR 623 3HG2 THR 623 -7.124 -4.286 -6.573 870 3HG2 THR 623 1HG2 THR 623 -7.857 -3.501 -5.154 871 H SER 624 H SER 624 -5.026 -1.221 -9.044 872 HA SER 624 HA SER 624 -3.958 1.073 -8.048 873 1HB SER 624 1HB SER 624 -3.707 -0.151 -10.829 874 2HB SER 624 2HB SER 624 -2.683 1.151 -10.258 875 HG SER 624 HG SER 624 -2.877 -1.071 -8.522 876 H ILE 625 H ILE 625 -6.255 0.597 -10.789 877 HA ILE 625 HA ILE 625 -6.230 3.357 -11.507 878 HB ILE 625 HB ILE 625 -7.607 0.878 -12.368 879 1HG1 ILE 625 1HG1 ILE 625 -7.008 2.523 -14.543 880 2HG1 ILE 625 2HG1 ILE 625 -5.711 2.839 -13.406 881 1HG2 ILE 625 2HG2 ILE 625 -8.843 3.602 -12.534 882 2HG2 ILE 625 3HG2 ILE 625 -9.031 2.470 -13.894 883 3HG2 ILE 625 1HG2 ILE 625 -9.601 2.013 -12.271 884 1HD1 ILE 625 3HD1 ILE 625 -6.581 -0.009 -14.002 885 2HD1 ILE 625 1HD1 ILE 625 -5.428 0.843 -15.057 886 3HD1 ILE 625 2HD1 ILE 625 -5.029 0.563 -13.345 887 H HIS 626 H HIS 626 -8.254 1.193 -9.479 888 HA HIS 626 HA HIS 626 -10.350 2.953 -9.078 889 1HB HIS 626 1HB HIS 626 -10.125 0.469 -8.483 890 2HB HIS 626 2HB HIS 626 -9.321 0.997 -7.018 891 HD1 HIS 626 1HD HIS 626 -11.542 -0.311 -5.995 892 HD2 HIS 626 2HD HIS 626 -12.142 3.440 -7.775 893 HE1 HIS 626 1HE HIS 626 -13.803 0.525 -5.157 894 H SER 627 H SER 627 -7.269 2.493 -7.231 895 HA SER 627 HA SER 627 -7.934 4.569 -5.433 896 1HB SER 627 1HB SER 627 -5.640 2.723 -5.905 897 2HB SER 627 2HB SER 627 -5.218 4.251 -5.158 898 HG SER 627 HG SER 627 -6.582 3.823 -3.414 899 H LEU 628 H LEU 628 -5.952 4.218 -8.414 900 HA LEU 628 HA LEU 628 -4.593 6.608 -8.337 901 1HB LEU 628 1HB LEU 628 -5.528 4.754 -10.473 902 2HB LEU 628 2HB LEU 628 -4.942 6.332 -10.959 903 HG LEU 628 HG LEU 628 -3.312 4.528 -9.169 904 1HD1 LEU 628 1HD1 LEU 628 -3.977 4.106 -11.964 905 2HD1 LEU 628 2HD1 LEU 628 -2.226 4.327 -11.729 906 3HD1 LEU 628 3HD1 LEU 628 -3.093 3.062 -10.825 907 1HD2 LEU 628 3HD2 LEU 628 -2.735 6.954 -9.356 908 2HD2 LEU 628 1HD2 LEU 628 -1.447 5.846 -9.884 909 3HD2 LEU 628 2HD2 LEU 628 -2.438 6.697 -11.093 910 H LEU 629 H LEU 629 -7.856 5.908 -9.766 911 HA LEU 629 HA LEU 629 -8.349 8.529 -10.564 912 1HB LEU 629 1HB LEU 629 -9.764 6.011 -10.366 913 2HB LEU 629 2HB LEU 629 -10.808 7.351 -9.936 914 HG LEU 629 HG LEU 629 -9.343 8.033 -12.319 915 1HD1 LEU 629 1HD1 LEU 629 -10.651 5.314 -12.310 916 2HD1 LEU 629 2HD1 LEU 629 -10.477 6.283 -13.793 917 3HD1 LEU 629 3HD1 LEU 629 -9.032 5.776 -12.887 918 1HD2 LEU 629 2HD2 LEU 629 -11.632 8.800 -11.340 919 2HD2 LEU 629 3HD2 LEU 629 -11.411 8.698 -13.103 920 3HD2 LEU 629 1HD2 LEU 629 -12.278 7.406 -12.239 921 H ASP 630 H ASP 630 -8.696 6.861 -7.427 922 HA ASP 630 HA ASP 630 -10.314 8.747 -6.225 923 1HB ASP 630 1HB ASP 630 -8.785 6.420 -5.474 924 2HB ASP 630 2HB ASP 630 -8.410 7.685 -4.321 925 HD2 ASP 630 HD ASP 630 -10.906 5.234 -4.553 926 H GLU 631 H GLU 631 -6.783 8.514 -6.804 927 HA GLU 631 HA GLU 631 -6.160 10.662 -5.060 928 1HB GLU 631 1HB GLU 631 -4.721 8.732 -6.739 929 2HB GLU 631 2HB GLU 631 -4.012 10.330 -6.854 930 1HG GLU 631 1HG GLU 631 -4.491 8.705 -4.319 931 2HG GLU 631 2HG GLU 631 -2.946 9.180 -4.996 932 HE2 GLU 631 HE GLU 631 -3.677 11.559 -2.362 933 H GLY 632 H GLY 632 -6.708 10.211 -8.585 934 1HA GLY 632 2HA GLY 632 -6.835 11.687 -10.285 935 2HA GLY 632 1HA GLY 632 -5.902 12.831 -9.342 936 H LYS 633 H LYS 633 -9.030 11.285 -8.410 937 HA LYS 633 HA LYS 633 -10.737 13.281 -9.210 938 1HB LYS 633 1HB LYS 633 -11.169 10.924 -8.204 939 2HB LYS 633 2HB LYS 633 -11.137 11.737 -6.652 940 1HG LYS 633 1HG LYS 633 -13.443 11.704 -7.379 941 2HG LYS 633 2HG LYS 633 -12.887 13.359 -7.531 942 1HD LYS 633 1HD LYS 633 -12.222 12.250 -10.016 943 2HD LYS 633 2HD LYS 633 -13.742 11.466 -9.635 944 1HE LYS 633 1HE LYS 633 -13.934 14.287 -8.953 945 2HE LYS 633 2HE LYS 633 -13.341 14.135 -10.595 946 H GLN 634 H GLN 634 -8.580 13.089 -6.366 947 HA GLN 634 HA GLN 634 -9.728 15.266 -5.042 948 1HB GLN 634 1HB GLN 634 -6.997 13.936 -4.877 949 2HB GLN 634 2HB GLN 634 -7.436 15.281 -3.844 950 1HG GLN 634 1HG GLN 634 -9.638 13.714 -3.471 951 2HG GLN 634 2HG GLN 634 -8.466 12.464 -3.838 952 1HE2 GLN 634 1HE2 GLN 634 -9.171 15.226 -1.769 953 2HE2 GLN 634 2HE2 GLN 634 -8.205 14.757 -0.410 954 H SER 635 H SER 635 -7.524 14.959 -7.765 955 HA SER 635 HA SER 635 -6.517 17.615 -7.460 956 1HB SER 635 1HB SER 635 -5.803 15.256 -8.933 957 2HB SER 635 2HB SER 635 -6.057 16.536 -10.102 958 HG SER 635 HG SER 635 -4.553 17.870 -8.916 959 H LEU 636 H LEU 636 -8.998 15.844 -9.343 960 HA LEU 636 HA LEU 636 -9.577 17.562 -11.341 961 1HB LEU 636 1HB LEU 636 -10.957 15.512 -9.831 962 2HB LEU 636 2HB LEU 636 -12.066 16.769 -10.341 963 HG LEU 636 HG LEU 636 -11.843 14.810 -11.900 964 1HD1 LEU 636 1HD1 LEU 636 -11.389 17.647 -12.793 965 2HD1 LEU 636 2HD1 LEU 636 -11.537 16.325 -13.976 966 3HD1 LEU 636 3HD1 LEU 636 -12.872 16.664 -12.848 967 1HD2 LEU 636 1HD2 LEU 636 -9.310 14.681 -11.561 968 2HD2 LEU 636 2HD2 LEU 636 -9.935 14.447 -13.211 969 3HD2 LEU 636 3HD2 LEU 636 -9.206 16.003 -12.748 970 H THR 637 H THR 637 -10.850 17.770 -7.946 971 HA THR 637 HA THR 637 -12.228 20.180 -8.372 972 HB THR 637 HB THR 637 -12.919 19.015 -6.460 973 HG1 THR 637 1HG THR 637 -12.423 20.600 -4.969 974 1HG2 THR 637 2HG2 THR 637 -9.976 18.352 -6.182 975 2HG2 THR 637 3HG2 THR 637 -10.996 18.344 -4.723 976 3HG2 THR 637 1HG2 THR 637 -11.382 17.265 -6.085 977 H LYS 638 H LYS 638 -8.819 19.457 -7.846 978 HA LYS 638 HA LYS 638 -8.197 22.131 -7.030 979 1HB LYS 638 1HB LYS 638 -6.427 19.821 -7.885 980 2HB LYS 638 2HB LYS 638 -5.855 21.336 -7.217 981 1HG LYS 638 1HG LYS 638 -6.848 20.918 -5.085 982 2HG LYS 638 2HG LYS 638 -7.926 19.694 -5.723 983 1HD LYS 638 1HD LYS 638 -6.366 18.039 -5.510 984 2HD LYS 638 2HD LYS 638 -5.092 19.026 -6.197 985 1HE LYS 638 1HE LYS 638 -5.039 18.283 -3.620 986 2HE LYS 638 2HE LYS 638 -4.398 19.832 -4.132 987 H LEU 639 H LEU 639 -7.978 20.156 -10.045 988 HA LEU 639 HA LEU 639 -6.835 22.311 -11.519 989 1HB LEU 639 1HB LEU 639 -7.985 19.627 -12.259 990 2HB LEU 639 2HB LEU 639 -7.418 20.768 -13.462 991 HG LEU 639 HG LEU 639 -5.621 19.315 -13.159 992 1HD1 LEU 639 2HD1 LEU 639 -5.298 21.959 -12.584 993 2HD1 LEU 639 3HD1 LEU 639 -4.547 21.197 -11.161 994 3HD1 LEU 639 1HD1 LEU 639 -3.971 20.791 -12.796 995 1HD2 LEU 639 3HD2 LEU 639 -6.625 18.301 -11.052 996 2HD2 LEU 639 1HD2 LEU 639 -4.849 18.375 -11.142 997 3HD2 LEU 639 2HD2 LEU 639 -5.740 19.555 -10.151 998 H ALA 640 H ALA 640 -9.996 21.528 -10.378 999 HA ALA 640 HA ALA 640 -11.690 22.272 -12.352 1000 1HB ALA 640 3HB ALA 640 -12.021 21.593 -9.824 1001 2HB ALA 640 2HB ALA 640 -13.254 22.573 -10.653 1002 3HB ALA 640 1HB ALA 640 -12.080 23.353 -9.566 1003 H ALA 641 H ALA 641 -9.593 24.367 -10.324 1004 HA ALA 641 HA ALA 641 -10.717 26.801 -11.165 1005 1HB ALA 641 3HB ALA 641 -9.126 27.704 -9.799 1006 2HB ALA 641 1HB ALA 641 -8.947 26.019 -9.255 1007 3HB ALA 641 2HB ALA 641 -7.825 26.688 -10.465 1008 H ALA 642 H ALA 642 -8.432 24.511 -12.609 1009 HA ALA 642 HA ALA 642 -7.169 26.236 -14.392 1010 1HB ALA 642 1HB ALA 642 -6.851 23.672 -13.706 1011 2HB ALA 642 3HB ALA 642 -6.276 24.297 -15.271 1012 3HB ALA 642 2HB ALA 642 -7.819 23.415 -15.177 1013 H TRP 643 H TRP 643 -10.314 24.502 -14.510 1014 HA TRP 643 HA TRP 643 -10.812 25.217 -17.223 1015 1HB TRP 643 1HB TRP 643 -12.474 24.040 -15.006 1016 2HB TRP 643 2HB TRP 643 -13.181 24.494 -16.544 1017 HD1 TRP 643 HD TRP 643 -12.638 22.895 -18.650 1018 HE1 TRP 643 1HE TRP 643 -11.567 20.505 -18.971 1019 HE3 TRP 643 3HE TRP 643 -10.631 22.589 -13.988 1020 HZ2 TRP 643 2HZ TRP 643 -10.035 18.793 -17.278 1021 HZ3 TRP 643 3HZ TRP 643 -9.362 20.525 -13.402 1022 HH2 TRP 643 HH TRP 643 -9.050 18.667 -14.960 1023 H GLY 644 H GLY 644 -10.633 26.953 -14.311 1024 1HA GLY 644 2HA GLY 644 -12.419 29.047 -15.393 1025 2HA GLY 644 1HA GLY 644 -10.935 29.339 -14.508 1026 H GLY 645 H GLY 645 -11.748 26.846 -12.747 1027 1HA GLY 645 2HA GLY 645 -13.736 28.283 -11.091 1028 2HA GLY 645 1HA GLY 645 -12.312 27.512 -10.422 1029 H SER 646 H SER 646 -14.141 26.389 -9.142 1030 HA SER 646 HA SER 646 -14.705 23.923 -10.548 1031 1HB SER 646 1HB SER 646 -15.050 22.948 -8.332 1032 2HB SER 646 2HB SER 646 -13.530 23.820 -8.352 1033 HG SER 646 HG SER 646 -15.434 25.589 -7.606 1034 H GLY 647 H GLY 647 -16.187 26.872 -9.489 1035 1HA GLY 647 2HA GLY 647 -18.383 27.379 -8.967 1036 2HA GLY 647 1HA GLY 647 -18.863 25.723 -9.276 1037 H SER 648 H SER 648 -17.070 25.933 -11.876 1038 HA SER 648 HA SER 648 -18.979 27.524 -13.395 1039 1HB SER 648 1HB SER 648 -16.060 27.091 -13.578 1040 2HB SER 648 2HB SER 648 -16.872 26.918 -15.121 1041 HG SER 648 HG SER 648 -17.918 29.103 -13.903 1042 H GLU 649 H GLU 649 -20.064 26.580 -15.192 1043 HA GLU 649 HA GLU 649 -20.611 23.901 -15.004 1044 1HB GLU 649 1HB GLU 649 -22.071 25.582 -16.108 1045 2HB GLU 649 2HB GLU 649 -20.917 25.743 -17.418 1046 1HG GLU 649 1HG GLU 649 -21.774 23.927 -18.470 1047 2HG GLU 649 2HG GLU 649 -21.511 22.928 -17.054 1048 HE2 GLU 649 HE GLU 649 -25.004 22.723 -17.162 1049 H ALA 650 H ALA 650 -17.934 25.572 -16.535 1050 HA ALA 650 HA ALA 650 -17.271 23.750 -18.524 1051 1HB ALA 650 2HB ALA 650 -15.959 25.922 -16.977 1052 2HB ALA 650 3HB ALA 650 -14.858 24.729 -17.706 1053 3HB ALA 650 1HB ALA 650 -15.999 25.629 -18.732 1054 H TYR 651 H TYR 651 -15.549 24.075 -15.340 1055 HA TYR 651 HA TYR 651 -14.269 21.661 -15.434 1056 1HB TYR 651 1HB TYR 651 -13.687 23.202 -13.693 1057 2HB TYR 651 2HB TYR 651 -15.363 23.578 -13.346 1058 HD1 TYR 651 1HD TYR 651 -16.405 22.639 -11.472 1059 HD2 TYR 651 2HD TYR 651 -12.871 20.801 -13.033 1060 HE1 TYR 651 1HE TYR 651 -16.341 21.055 -9.483 1061 HE2 TYR 651 2HE TYR 651 -12.819 19.224 -11.039 1062 HH TYR 651 HH TYR 651 -13.690 18.723 -9.121 1063 H GLN 652 H GLN 652 -17.662 22.367 -14.617 1064 HA GLN 652 HA GLN 652 -18.230 20.067 -13.229 1065 1HB GLN 652 1HB GLN 652 -19.864 21.948 -14.943 1066 2HB GLN 652 2HB GLN 652 -20.614 20.500 -14.301 1067 1HG GLN 652 1HG GLN 652 -19.133 21.688 -12.147 1068 2HG GLN 652 2HG GLN 652 -20.010 22.986 -12.932 1069 1HE2 GLN 652 1HE2 GLN 652 -21.043 22.943 -10.764 1070 2HE2 GLN 652 2HE2 GLN 652 -22.444 21.951 -10.533 1071 H GLY 653 H GLY 653 -18.630 20.749 -16.781 1072 1HA GLY 653 2HA GLY 653 -18.645 19.376 -18.560 1073 2HA GLY 653 1HA GLY 653 -19.535 18.249 -17.556 1074 H VAL 654 H VAL 654 -16.328 19.284 -16.488 1075 HA VAL 654 HA VAL 654 -14.973 17.103 -17.768 1076 HB VAL 654 HB VAL 654 -14.229 19.274 -15.823 1077 1HG1 VAL 654 2HG1 VAL 654 -13.040 17.140 -15.221 1078 2HG1 VAL 654 3HG1 VAL 654 -12.320 17.151 -16.849 1079 3HG1 VAL 654 1HG1 VAL 654 -11.969 18.475 -15.712 1080 1HG2 VAL 654 3HG2 VAL 654 -14.278 19.042 -18.651 1081 2HG2 VAL 654 1HG2 VAL 654 -13.651 20.386 -17.667 1082 3HG2 VAL 654 2HG2 VAL 654 -12.567 19.064 -18.160 1083 H GLN 655 H GLN 655 -16.217 17.933 -14.488 1084 HA GLN 655 HA GLN 655 -15.119 15.867 -13.109 1085 1HB GLN 655 1HB GLN 655 -17.378 17.711 -12.788 1086 2HB GLN 655 2HB GLN 655 -17.714 16.161 -12.043 1087 1HG GLN 655 1HG GLN 655 -14.964 17.055 -11.489 1088 2HG GLN 655 2HG GLN 655 -16.144 18.236 -10.958 1089 1HE2 GLN 655 1HE2 GLN 655 -14.548 16.885 -9.188 1090 2HE2 GLN 655 2HE2 GLN 655 -15.487 15.804 -8.213 1091 H GLN 656 H GLN 656 -18.343 15.928 -14.793 1092 HA GLN 656 HA GLN 656 -18.907 13.267 -14.231 1093 1HB GLN 656 1HB GLN 656 -20.469 13.632 -16.349 1094 2HB GLN 656 2HB GLN 656 -20.803 14.457 -14.839 1095 1HG GLN 656 1HG GLN 656 -18.890 15.923 -16.566 1096 2HG GLN 656 2HG GLN 656 -20.455 15.689 -17.319 1097 1HE2 GLN 656 1HE2 GLN 656 -21.347 17.634 -17.180 1098 2HE2 GLN 656 2HE2 GLN 656 -21.653 18.517 -15.722 1099 H LYS 657 H LYS 657 -17.116 14.883 -16.870 1100 HA LYS 657 HA LYS 657 -17.032 12.656 -18.589 1101 1HB LYS 657 1HB LYS 657 -15.629 15.284 -18.360 1102 2HB LYS 657 2HB LYS 657 -14.882 14.049 -19.354 1103 1HG LYS 657 1HG LYS 657 -17.690 14.028 -19.965 1104 2HG LYS 657 2HG LYS 657 -17.183 15.705 -19.957 1105 1HD LYS 657 1HD LYS 657 -15.182 14.049 -21.303 1106 2HD LYS 657 2HD LYS 657 -16.761 13.792 -22.018 1107 1HE LYS 657 1HE LYS 657 -16.895 16.466 -21.908 1108 2HE LYS 657 2HE LYS 657 -15.148 16.343 -21.849 1109 H TRP 658 H TRP 658 -15.259 13.595 -15.677 1110 HA TRP 658 HA TRP 658 -13.080 11.809 -16.154 1111 1HB TRP 658 1HB TRP 658 -12.681 13.745 -14.835 1112 2HB TRP 658 2HB TRP 658 -14.014 13.382 -13.756 1113 HD1 TRP 658 HD TRP 658 -13.463 11.810 -11.682 1114 HE1 TRP 658 1HE TRP 658 -11.337 10.596 -10.697 1115 HE3 TRP 658 3HE TRP 658 -10.501 12.566 -15.745 1116 HZ2 TRP 658 2HZ TRP 658 -8.714 10.099 -11.706 1117 HZ3 TRP 658 3HZ TRP 658 -8.171 11.685 -15.663 1118 HH2 TRP 658 HH TRP 658 -7.266 10.488 -13.734 1119 H ASP 659 H ASP 659 -15.956 11.875 -13.921 1120 HA ASP 659 HA ASP 659 -15.530 9.322 -12.950 1121 1HB ASP 659 1HB ASP 659 -17.462 11.422 -12.681 1122 2HB ASP 659 2HB ASP 659 -18.366 9.970 -13.063 1123 HD2 ASP 659 HD ASP 659 -18.228 10.272 -9.569 1124 H ALA 660 H ALA 660 -17.033 10.615 -15.897 1125 HA ALA 660 HA ALA 660 -18.726 8.562 -16.605 1126 1HB ALA 660 3HB ALA 660 -18.949 10.297 -18.063 1127 2HB ALA 660 1HB ALA 660 -17.230 10.747 -17.950 1128 3HB ALA 660 2HB ALA 660 -17.731 9.404 -19.006 1129 H THR 661 H THR 661 -15.757 8.925 -18.563 1130 HA THR 661 HA THR 661 -15.538 6.245 -19.157 1131 HB THR 661 HB THR 661 -13.344 6.897 -20.029 1132 HG1 THR 661 1HG THR 661 -12.509 9.001 -19.179 1133 1HG2 THR 661 1HG2 THR 661 -15.573 8.240 -20.802 1134 2HG2 THR 661 2HG2 THR 661 -14.679 9.598 -20.076 1135 3HG2 THR 661 3HG2 THR 661 -13.960 8.673 -21.416 1136 H ALA 662 H ALA 662 -14.704 7.915 -16.193 1137 HA ALA 662 HA ALA 662 -12.715 6.260 -15.227 1138 1HB ALA 662 3HB ALA 662 -13.065 8.125 -13.916 1139 2HB ALA 662 2HB ALA 662 -13.982 6.931 -12.966 1140 3HB ALA 662 1HB ALA 662 -14.836 8.036 -14.070 1141 H THR 663 H THR 663 -16.028 6.079 -13.821 1142 HA THR 663 HA THR 663 -15.849 3.519 -12.915 1143 HB THR 663 HB THR 663 -17.704 4.814 -12.197 1144 HG1 THR 663 1HG THR 663 -19.470 3.487 -12.997 1145 1HG2 THR 663 3HG2 THR 663 -17.688 5.771 -14.960 1146 2HG2 THR 663 1HG2 THR 663 -19.320 5.219 -14.513 1147 3HG2 THR 663 2HG2 THR 663 -18.509 6.474 -13.546 1148 H GLU 664 H GLU 664 -16.276 4.594 -16.251 1149 HA GLU 664 HA GLU 664 -17.347 2.238 -17.238 1150 1HB GLU 664 1HB GLU 664 -17.380 4.267 -18.564 1151 2HB GLU 664 2HB GLU 664 -15.633 4.398 -18.527 1152 1HG GLU 664 1HG GLU 664 -16.037 3.464 -20.658 1153 2HG GLU 664 2HG GLU 664 -15.618 2.060 -19.696 1154 HE2 GLU 664 HE GLU 664 -18.573 0.790 -21.059 1155 H LEU 665 H LEU 665 -13.916 3.375 -16.941 1156 HA LEU 665 HA LEU 665 -12.922 0.880 -17.946 1157 1HB LEU 665 1HB LEU 665 -11.887 3.146 -18.295 1158 2HB LEU 665 2HB LEU 665 -11.419 3.128 -16.607 1159 HG LEU 665 HG LEU 665 -9.553 2.492 -18.012 1160 1HD1 LEU 665 2HD1 LEU 665 -10.236 1.271 -15.734 1161 2HD1 LEU 665 3HD1 LEU 665 -10.231 -0.144 -16.813 1162 3HD1 LEU 665 1HD1 LEU 665 -8.768 0.856 -16.651 1163 1HD2 LEU 665 2HD2 LEU 665 -10.814 1.624 -19.928 1164 2HD2 LEU 665 3HD2 LEU 665 -9.558 0.481 -19.391 1165 3HD2 LEU 665 1HD2 LEU 665 -11.265 0.186 -18.981 1166 H ASN 666 H ASN 666 -13.630 2.389 -14.803 1167 HA ASN 666 HA ASN 666 -12.092 0.683 -13.259 1168 1HB ASN 666 1HB ASN 666 -13.942 2.805 -12.843 1169 2HB ASN 666 2HB ASN 666 -14.624 1.448 -11.968 1170 1HD2 ASN 666 1HD2 ASN 666 -12.037 3.723 -12.220 1171 2HD2 ASN 666 2HD2 ASN 666 -11.224 3.367 -10.733 1172 H ASN 667 H ASN 667 -15.576 0.621 -14.301 1173 HA ASN 667 HA ASN 667 -16.250 -1.686 -12.943 1174 1HB ASN 667 1HB ASN 667 -17.361 -0.523 -15.552 1175 2HB ASN 667 2HB ASN 667 -18.148 -1.800 -14.645 1176 1HD2 ASN 667 1HD2 ASN 667 -18.895 1.007 -15.323 1177 2HD2 ASN 667 2HD2 ASN 667 -19.325 1.769 -13.828 1178 H ALA 668 H ALA 668 -15.296 -1.095 -16.412 1179 HA ALA 668 HA ALA 668 -15.437 -3.662 -17.348 1180 1HB ALA 668 3HB ALA 668 -14.774 -1.281 -18.394 1181 2HB ALA 668 1HB ALA 668 -13.135 -1.946 -18.201 1182 3HB ALA 668 2HB ALA 668 -14.338 -2.815 -19.184 1183 H LEU 669 H LEU 669 -12.778 -2.039 -15.524 1184 HA LEU 669 HA LEU 669 -10.946 -4.130 -15.738 1185 1HB LEU 669 1HB LEU 669 -11.251 -1.637 -14.281 1186 2HB LEU 669 2HB LEU 669 -10.488 -2.868 -13.294 1187 HG LEU 669 HG LEU 669 -9.501 -2.287 -16.084 1188 1HD1 LEU 669 1HD1 LEU 669 -9.660 -0.201 -14.547 1189 2HD1 LEU 669 2HD1 LEU 669 -8.297 -0.946 -13.678 1190 3HD1 LEU 669 3HD1 LEU 669 -8.138 -0.541 -15.404 1191 1HD2 LEU 669 2HD2 LEU 669 -8.849 -4.292 -14.408 1192 2HD2 LEU 669 3HD2 LEU 669 -7.715 -3.572 -15.576 1193 3HD2 LEU 669 1HD2 LEU 669 -7.684 -3.057 -13.872 1194 H GLN 670 H GLN 670 -13.524 -3.418 -13.309 1195 HA GLN 670 HA GLN 670 -12.891 -5.451 -11.579 1196 1HB GLN 670 1HB GLN 670 -15.351 -3.853 -12.209 1197 2HB GLN 670 2HB GLN 670 -15.579 -5.303 -11.252 1198 1HG GLN 670 1HG GLN 670 -13.269 -3.971 -10.190 1199 2HG GLN 670 2HG GLN 670 -14.494 -2.741 -10.428 1200 1HE2 GLN 670 1HE2 GLN 670 -13.498 -5.511 -8.660 1201 2HE2 GLN 670 2HE2 GLN 670 -14.789 -5.580 -7.507 1202 H ASN 671 H ASN 671 -15.266 -5.439 -14.332 1203 HA ASN 671 HA ASN 671 -15.910 -8.133 -14.003 1204 1HB ASN 671 1HB ASN 671 -16.884 -6.014 -15.513 1205 2HB ASN 671 2HB ASN 671 -16.124 -6.988 -16.756 1206 1HD2 ASN 671 1HD2 ASN 671 -17.505 -8.242 -17.729 1207 2HD2 ASN 671 2HD2 ASN 671 -18.814 -9.126 -17.019 1208 H LEU 672 H LEU 672 -13.279 -6.359 -15.547 1209 HA LEU 672 HA LEU 672 -12.546 -8.427 -17.371 1210 1HB LEU 672 1HB LEU 672 -12.052 -6.173 -17.931 1211 2HB LEU 672 2HB LEU 672 -11.221 -5.896 -16.413 1212 HG LEU 672 HG LEU 672 -9.792 -6.168 -18.503 1213 1HD1 LEU 672 3HD1 LEU 672 -9.004 -6.310 -16.111 1214 2HD1 LEU 672 1HD1 LEU 672 -9.110 -8.080 -16.261 1215 3HD1 LEU 672 2HD1 LEU 672 -7.999 -7.163 -17.307 1216 1HD2 LEU 672 2HD2 LEU 672 -11.191 -8.235 -19.213 1217 2HD2 LEU 672 3HD2 LEU 672 -9.432 -8.234 -19.489 1218 3HD2 LEU 672 1HD2 LEU 672 -10.117 -9.131 -18.112 1219 H ALA 673 H ALA 673 -11.514 -7.332 -14.094 1220 HA ALA 673 HA ALA 673 -9.514 -9.400 -13.967 1221 1HB ALA 673 3HB ALA 673 -9.985 -6.916 -12.734 1222 2HB ALA 673 1HB ALA 673 -10.208 -8.120 -11.442 1223 3HB ALA 673 2HB ALA 673 -8.681 -8.067 -12.357 1224 H ARG 674 H ARG 674 -12.925 -9.019 -13.337 1225 HA ARG 674 HA ARG 674 -13.100 -10.903 -11.279 1226 1HB ARG 674 1HB ARG 674 -15.045 -9.609 -13.206 1227 2HB ARG 674 2HB ARG 674 -15.595 -10.985 -12.270 1228 1HG ARG 674 1HG ARG 674 -14.125 -9.043 -10.608 1229 2HG ARG 674 2HG ARG 674 -15.504 -8.310 -11.403 1230 1HD ARG 674 1HD ARG 674 -16.925 -10.264 -10.555 1231 2HD ARG 674 2HD ARG 674 -15.538 -10.792 -9.621 1232 HE ARG 674 HE ARG 674 -15.775 -8.149 -8.877 1233 2HH1 ARG 674 1HH ARG 674 -18.409 -8.167 -6.613 1234 1HH2 ARG 674 2HH2 ARG 674 -18.092 -10.828 -8.984 1235 2HH2 ARG 674 1HH2 ARG 674 -19.048 -10.217 -7.676 1236 H THR 675 H THR 675 -12.893 -11.066 -14.809 1237 HA THR 675 HA THR 675 -13.528 -13.937 -14.720 1238 HB THR 675 HB THR 675 -13.368 -12.043 -17.120 1239 HG1 THR 675 1HG THR 675 -15.549 -13.030 -15.417 1240 1HG2 THR 675 3HG2 THR 675 -13.343 -14.645 -17.422 1241 2HG2 THR 675 1HG2 THR 675 -15.003 -14.594 -16.782 1242 3HG2 THR 675 2HG2 THR 675 -14.603 -13.735 -18.289 1243 H ILE 676 H ILE 676 -10.937 -11.736 -14.690 1244 HA ILE 676 HA ILE 676 -9.208 -13.555 -16.174 1245 HB ILE 676 HB ILE 676 -9.052 -10.710 -15.283 1246 1HG1 ILE 676 1HG1 ILE 676 -8.638 -12.217 -17.870 1247 2HG1 ILE 676 2HG1 ILE 676 -9.881 -11.044 -17.485 1248 1HG2 ILE 676 1HG2 ILE 676 -6.823 -12.588 -15.204 1249 2HG2 ILE 676 2HG2 ILE 676 -6.536 -11.233 -16.322 1250 3HG2 ILE 676 3HG2 ILE 676 -6.936 -10.911 -14.617 1251 1HD1 ILE 676 1HD1 ILE 676 -7.828 -9.416 -17.057 1252 2HD1 ILE 676 2HD1 ILE 676 -6.955 -10.584 -18.077 1253 3HD1 ILE 676 3HD1 ILE 676 -8.382 -9.735 -18.718 1254 H SER 677 H SER 677 -9.448 -11.920 -12.941 1255 HA SER 677 HA SER 677 -7.331 -13.028 -11.739 1256 1HB SER 677 1HB SER 677 -8.816 -11.399 -10.654 1257 2HB SER 677 2HB SER 677 -10.115 -12.573 -10.581 1258 HG SER 677 HG SER 677 -8.402 -13.903 -9.306 1259 H GLU 678 H GLU 678 -10.350 -14.609 -12.718 1260 HA GLU 678 HA GLU 678 -10.065 -16.852 -11.061 1261 1HB GLU 678 1HB GLU 678 -11.679 -17.865 -12.847 1262 2HB GLU 678 2HB GLU 678 -12.244 -16.522 -11.875 1263 1HG GLU 678 1HG GLU 678 -12.412 -15.141 -13.682 1264 2HG GLU 678 2HG GLU 678 -10.827 -15.589 -14.280 1265 HE2 GLU 678 HE GLU 678 -12.397 -18.621 -15.639 1266 H ALA 679 H ALA 679 -8.565 -15.816 -14.057 1267 HA ALA 679 HA ALA 679 -7.980 -18.054 -15.411 1268 1HB ALA 679 1HB ALA 679 -5.958 -15.904 -14.666 1269 2HB ALA 679 2HB ALA 679 -5.951 -16.925 -16.124 1270 3HB ALA 679 3HB ALA 679 -7.228 -15.706 -15.897 1271 H GLY 680 H GLY 680 -6.884 -17.180 -12.154 1272 1HA GLY 680 2HA GLY 680 -5.871 -18.422 -10.572 1273 2HA GLY 680 1HA GLY 680 -4.655 -18.719 -11.798 1274 H GLN 681 H GLN 681 -7.710 -19.930 -10.357 1275 HA GLN 681 HA GLN 681 -7.074 -22.516 -11.550 1276 1HB GLN 681 1HB GLN 681 -7.925 -21.810 -8.726 1277 2HB GLN 681 2HB GLN 681 -8.229 -23.411 -9.369 1278 1HG GLN 681 1HG GLN 681 -5.867 -23.815 -9.743 1279 2HG GLN 681 2HG GLN 681 -5.464 -22.133 -9.464 1280 1HE2 GLN 681 1HE2 GLN 681 -4.288 -24.290 -8.136 1281 2HE2 GLN 681 2HE2 GLN 681 -4.672 -24.219 -6.448 1282 H ALA 682 H ALA 682 -9.282 -19.935 -11.290 1283 HA ALA 682 HA ALA 682 -11.591 -21.659 -11.793 1284 1HB ALA 682 2HB ALA 682 -11.282 -18.716 -11.092 1285 2HB ALA 682 3HB ALA 682 -12.838 -19.477 -11.500 1286 3HB ALA 682 1HB ALA 682 -11.935 -20.013 -10.064 1287 H MET 683 H MET 683 -9.213 -21.060 -13.660 1288 HA MET 683 HA MET 683 -10.011 -19.287 -15.605 1289 1HB MET 683 1HB MET 683 -7.746 -20.475 -15.299 1290 2HB MET 683 2HB MET 683 -8.469 -21.910 -16.000 1291 1HG MET 683 1HG MET 683 -8.983 -19.555 -17.678 1292 2HG MET 683 2HG MET 683 -7.265 -19.762 -17.402 1293 1HE MET 683 2HE MET 683 -6.290 -22.003 -17.192 1294 2HE MET 683 3HE MET 683 -7.291 -23.465 -17.357 1295 3HE MET 683 1HE MET 683 -6.227 -22.960 -18.691 1296 H ALA 684 H ALA 684 -10.867 -22.724 -15.057 1297 HA ALA 684 HA ALA 684 -12.417 -22.724 -17.531 1298 1HB ALA 684 3HB ALA 684 -11.587 -24.815 -17.588 1299 2HB ALA 684 2HB ALA 684 -12.668 -25.201 -16.228 1300 3HB ALA 684 1HB ALA 684 -10.992 -24.690 -15.915 1301 H SER 685 H SER 685 -12.728 -23.222 -13.958 1302 HA SER 685 HA SER 685 -15.473 -22.344 -14.243 1303 1HB SER 685 1HB SER 685 -14.562 -24.914 -12.896 1304 2HB SER 685 2HB SER 685 -16.087 -24.152 -12.488 1305 HG SER 685 HG SER 685 -16.054 -24.232 -15.156 1306 H THR 686 H THR 686 -14.317 -23.869 -11.272 1307 HA THR 686 HA THR 686 -12.999 -21.695 -10.112 1308 HB THR 686 HB THR 686 -15.450 -20.809 -10.487 1309 HG1 THR 686 1HG THR 686 -13.686 -20.011 -9.006 1310 1HG2 THR 686 3HG2 THR 686 -16.082 -23.130 -9.005 1311 2HG2 THR 686 1HG2 THR 686 -16.126 -21.818 -7.803 1312 3HG2 THR 686 2HG2 THR 686 -17.150 -21.728 -9.256 1313 H GLU 687 H GLU 687 -12.178 -22.202 -8.079 1314 HA GLU 687 HA GLU 687 -13.149 -23.972 -6.318 1315 1HB GLU 687 1HB GLU 687 -13.172 -25.840 -7.762 1316 2HB GLU 687 2HB GLU 687 -11.676 -25.383 -8.551 1317 1HG GLU 687 1HG GLU 687 -10.358 -26.355 -6.929 1318 2HG GLU 687 2HG GLU 687 -11.420 -25.872 -5.622 1319 HE2 GLU 687 HE GLU 687 -13.024 -28.193 -5.077 1320 H GLY 688 H GLY 688 -12.049 -23.128 -4.605 1321 1HA GLY 688 2HA GLY 688 -9.140 -23.233 -4.625 1322 2HA GLY 688 1HA GLY 688 -10.193 -22.911 -3.261 1323 H ASN 689 H ASN 689 -10.596 -21.256 -6.401 1324 HA ASN 689 HA ASN 689 -9.086 -19.002 -5.545 1325 1HB ASN 689 1HB ASN 689 -9.430 -19.828 -7.983 1326 2HB ASN 689 2HB ASN 689 -11.046 -19.155 -7.888 1327 1HD2 ASN 689 1HD2 ASN 689 -7.757 -18.188 -6.900 1328 2HD2 ASN 689 2HD2 ASN 689 -7.786 -16.593 -7.574 1329 H VAL 690 H VAL 690 -12.541 -19.482 -6.638 1330 HA VAL 690 HA VAL 690 -13.420 -17.794 -4.433 1331 HB VAL 690 HB VAL 690 -14.908 -16.573 -6.073 1332 1HG1 VAL 690 2HG1 VAL 690 -12.513 -15.908 -5.036 1333 2HG1 VAL 690 3HG1 VAL 690 -12.111 -15.825 -6.768 1334 3HG1 VAL 690 1HG1 VAL 690 -13.438 -14.836 -6.114 1335 1HG2 VAL 690 2HG2 VAL 690 -13.661 -18.362 -7.912 1336 2HG2 VAL 690 3HG2 VAL 690 -14.882 -17.108 -8.237 1337 3HG2 VAL 690 1HG2 VAL 690 -13.150 -16.709 -8.328 1338 H THR 691 H THR 691 -15.596 -18.214 -3.787 1339 HA THR 691 HA THR 691 -16.991 -20.313 -5.263 1340 HB THR 691 HB THR 691 -15.568 -21.492 -3.599 1341 HG1 THR 691 1HG THR 691 -17.551 -22.285 -2.341 1342 1HG2 THR 691 2HG2 THR 691 -15.452 -19.533 -1.935 1343 2HG2 THR 691 3HG2 THR 691 -17.132 -19.920 -1.491 1344 3HG2 THR 691 1HG2 THR 691 -15.840 -21.111 -1.208 1345 H GLY 692 H GLY 692 -17.040 -18.116 -2.383 1346 1HA GLY 692 2HA GLY 692 -18.683 -16.827 -1.554 1347 2HA GLY 692 1HA GLY 692 -19.824 -18.027 -2.126 1348 H MET 693 H MET 693 -17.557 -15.660 -3.718 1349 HA MET 693 HA MET 693 -19.446 -13.931 -4.602 1350 1HB MET 693 1HB MET 693 -16.736 -14.834 -5.654 1351 2HB MET 693 2HB MET 693 -17.653 -13.662 -6.579 1352 1HG MET 693 1HG MET 693 -16.908 -13.337 -3.631 1353 2HG MET 693 2HG MET 693 -16.042 -12.595 -4.961 1354 1HE MET 693 3HE MET 693 -16.873 -10.729 -2.868 1355 2HE MET 693 1HE MET 693 -16.363 -10.086 -4.448 1356 3HE MET 693 2HE MET 693 -17.835 -9.461 -3.666 1357 H PHE 694 H PHE 694 -18.217 -16.917 -6.237 1358 HA PHE 694 HA PHE 694 -19.851 -16.519 -8.528 1359 1HB PHE 694 1HB PHE 694 -18.079 -18.652 -7.278 1360 2HB PHE 694 2HB PHE 694 -19.153 -19.158 -8.567 1361 HD1 PHE 694 1HD PHE 694 -17.004 -19.789 -9.733 1362 HD2 PHE 694 2HD PHE 694 -18.012 -15.764 -8.845 1363 HE1 PHE 694 1HE PHE 694 -15.336 -18.995 -11.433 1364 HE2 PHE 694 2HE PHE 694 -16.345 -14.970 -10.545 1365 HZ PHE 694 HZ PHE 694 -15.026 -16.596 -11.819 1366 H ALA 695 H ALA 695 -21.607 -17.981 -9.232 1367 HA ALA 695 HA ALA 695 -23.705 -18.651 -8.835 1368 1HB ALA 695 3HB ALA 695 -23.464 -20.763 -7.100 1369 2HB ALA 695 1HB ALA 695 -23.073 -20.833 -8.835 1370 3HB ALA 695 2HB ALA 695 -21.781 -20.562 -7.642 No H/Q in entry = 1370 Start of MODEL 26 1 H ALA 1 H ALA 1 -8.285 41.982 -7.196 2 HA ALA 1 HA ALA 1 -6.699 39.763 -6.843 3 1HB ALA 1 2HB ALA 1 -8.518 38.022 -7.564 4 2HB ALA 1 1HB ALA 1 -9.664 39.184 -6.852 5 3HB ALA 1 3HB ALA 1 -8.380 38.470 -5.847 6 H GLU 2 H GLU 2 -5.643 39.639 -8.762 7 HA GLU 2 HA GLU 2 -7.003 40.802 -11.038 8 1HB GLU 2 1HB GLU 2 -4.095 40.237 -10.383 9 2HB GLU 2 2HB GLU 2 -4.588 40.586 -12.028 10 1HG GLU 2 1HG GLU 2 -5.657 42.727 -11.218 11 2HG GLU 2 2HG GLU 2 -5.067 42.384 -9.604 12 HE2 GLU 2 HE GLU 2 -3.694 43.448 -12.804 13 H MET 3 H MET 3 -4.866 37.949 -10.287 14 HA MET 3 HA MET 3 -5.560 36.659 -12.682 15 1HB MET 3 1HB MET 3 -3.948 36.146 -10.230 16 2HB MET 3 2HB MET 3 -4.639 34.684 -10.904 17 1HG MET 3 1HG MET 3 -3.673 35.298 -13.155 18 2HG MET 3 2HG MET 3 -2.932 36.711 -12.430 19 1HE MET 3 2HE MET 3 -1.246 36.894 -11.033 20 2HE MET 3 3HE MET 3 -0.100 35.664 -10.448 21 3HE MET 3 1HE MET 3 -0.069 36.169 -12.154 22 H LYS 4 H LYS 4 -6.665 34.491 -12.828 23 HA LYS 4 HA LYS 4 -9.163 34.631 -11.452 24 1HB LYS 4 1HB LYS 4 -9.216 34.003 -13.742 25 2HB LYS 4 2HB LYS 4 -7.988 32.772 -13.524 26 1HG LYS 4 1HG LYS 4 -9.543 31.225 -12.944 27 2HG LYS 4 2HG LYS 4 -10.184 32.262 -11.686 28 1HD LYS 4 1HD LYS 4 -10.898 33.049 -14.482 29 2HD LYS 4 2HD LYS 4 -11.587 31.535 -13.929 30 1HE LYS 4 1HE LYS 4 -11.798 33.599 -11.852 31 2HE LYS 4 2HE LYS 4 -12.531 34.143 -13.348 32 H THR 5 H THR 5 -6.646 32.015 -11.711 33 HA THR 5 HA THR 5 -7.369 31.283 -8.949 34 HB THR 5 HB THR 5 -6.816 28.932 -9.692 35 HG1 THR 5 1HG THR 5 -5.958 28.766 -11.740 36 1HG2 THR 5 1HG2 THR 5 -8.924 30.508 -11.231 37 2HG2 THR 5 2HG2 THR 5 -8.678 28.770 -11.530 38 3HG2 THR 5 3HG2 THR 5 -9.169 29.335 -9.915 39 H ASP 6 H ASP 6 -4.710 30.043 -10.998 40 HA ASP 6 HA ASP 6 -2.694 31.626 -10.392 41 1HB ASP 6 1HB ASP 6 -3.548 30.128 -7.961 42 2HB ASP 6 2HB ASP 6 -1.832 30.025 -8.300 43 HD2 ASP 6 HD ASP 6 -3.970 31.761 -6.639 44 H ALA 7 H ALA 7 -0.933 30.700 -11.504 45 HA ALA 7 HA ALA 7 -1.237 28.107 -12.583 46 1HB ALA 7 3HB ALA 7 0.657 30.389 -12.743 47 2HB ALA 7 1HB ALA 7 1.359 28.790 -13.085 48 3HB ALA 7 2HB ALA 7 -0.026 29.375 -14.036 49 H ALA 8 H ALA 8 0.697 29.539 -9.905 50 HA ALA 8 HA ALA 8 2.281 27.301 -9.405 51 1HB ALA 8 1HB ALA 8 2.029 28.494 -6.964 52 2HB ALA 8 3HB ALA 8 1.479 29.809 -8.030 53 3HB ALA 8 2HB ALA 8 3.093 29.094 -8.258 54 H THR 9 H THR 9 -0.930 28.325 -8.074 55 HA THR 9 HA THR 9 -1.178 26.092 -6.363 56 HB THR 9 HB THR 9 -2.464 28.527 -6.785 57 HG1 THR 9 1HG THR 9 -3.719 27.639 -4.998 58 1HG2 THR 9 1HG2 THR 9 -3.852 27.324 -8.616 59 2HG2 THR 9 2HG2 THR 9 -4.491 26.301 -7.307 60 3HG2 THR 9 3HG2 THR 9 -4.783 28.057 -7.288 61 H LEU 10 H LEU 10 -2.073 26.690 -9.780 62 HA LEU 10 HA LEU 10 -3.576 24.296 -9.995 63 1HB LEU 10 1HB LEU 10 -2.396 26.235 -11.973 64 2HB LEU 10 2HB LEU 10 -3.227 24.779 -12.484 65 HG LEU 10 HG LEU 10 -4.405 27.060 -10.875 66 1HD1 LEU 10 2HD1 LEU 10 -4.704 26.169 -13.744 67 2HD1 LEU 10 3HD1 LEU 10 -5.911 27.194 -12.932 68 3HD1 LEU 10 1HD1 LEU 10 -4.235 27.765 -13.110 69 1HD2 LEU 10 3HD2 LEU 10 -5.517 24.351 -11.579 70 2HD2 LEU 10 1HD2 LEU 10 -5.513 25.200 -10.014 71 3HD2 LEU 10 2HD2 LEU 10 -6.582 25.755 -11.325 72 H ALA 11 H ALA 11 -0.174 25.258 -10.722 73 HA ALA 11 HA ALA 11 0.532 22.771 -11.839 74 1HB ALA 11 3HB ALA 11 1.966 25.192 -10.764 75 2HB ALA 11 1HB ALA 11 2.894 23.717 -11.126 76 3HB ALA 11 2HB ALA 11 1.959 24.517 -12.412 77 H GLN 12 H GLN 12 0.218 24.017 -8.533 78 HA GLN 12 HA GLN 12 1.833 22.089 -7.325 79 1HB GLN 12 1HB GLN 12 0.167 24.295 -6.524 80 2HB GLN 12 2HB GLN 12 -0.284 22.910 -5.548 81 1HG GLN 12 1HG GLN 12 1.530 23.373 -4.259 82 2HG GLN 12 2HG GLN 12 2.511 22.758 -5.575 83 1HE2 GLN 12 1HE2 GLN 12 1.256 25.566 -3.960 84 2HE2 GLN 12 2HE2 GLN 12 2.255 26.764 -4.714 85 H GLU 13 H GLU 13 -1.534 22.123 -8.464 86 HA GLU 13 HA GLU 13 -1.969 19.561 -7.177 87 1HB GLU 13 1HB GLU 13 -3.949 21.311 -8.699 88 2HB GLU 13 2HB GLU 13 -4.342 19.891 -7.750 89 1HG GLU 13 1HG GLU 13 -4.333 21.076 -5.808 90 2HG GLU 13 2HG GLU 13 -2.762 21.770 -6.157 91 HE2 GLU 13 HE GLU 13 -3.456 23.658 -5.436 92 H ALA 14 H ALA 14 -1.875 21.192 -10.387 93 HA ALA 14 HA ALA 14 -2.698 19.054 -11.941 94 1HB ALA 14 1HB ALA 14 -2.276 21.523 -12.547 95 2HB ALA 14 2HB ALA 14 -0.567 21.061 -12.737 96 3HB ALA 14 3HB ALA 14 -1.813 20.302 -13.757 97 H GLY 15 H GLY 15 0.682 20.078 -11.066 98 1HA GLY 15 2HA GLY 15 2.549 18.852 -10.773 99 2HA GLY 15 1HA GLY 15 2.092 18.075 -12.276 100 H ASN 16 H ASN 16 0.093 17.926 -9.308 101 HA ASN 16 HA ASN 16 1.168 15.434 -8.517 102 1HB ASN 16 1HB ASN 16 0.231 16.709 -6.735 103 2HB ASN 16 2HB ASN 16 -1.179 17.165 -7.671 104 1HD2 ASN 16 1HD2 ASN 16 -2.872 16.393 -6.655 105 2HD2 ASN 16 2HD2 ASN 16 -3.111 14.765 -6.113 106 H PHE 17 H PHE 17 -1.501 16.657 -10.537 107 HA PHE 17 HA PHE 17 -2.963 14.221 -10.589 108 1HB PHE 17 1HB PHE 17 -3.925 16.495 -11.031 109 2HB PHE 17 2HB PHE 17 -2.816 16.727 -12.368 110 HD1 PHE 17 1HD PHE 17 -3.381 16.009 -14.534 111 HD2 PHE 17 2HD PHE 17 -5.682 14.666 -11.231 112 HE1 PHE 17 1HE PHE 17 -5.080 15.042 -16.110 113 HE2 PHE 17 2HE PHE 17 -7.380 13.700 -12.806 114 HZ PHE 17 HZ PHE 17 -7.059 13.900 -15.227 115 H GLU 18 H GLU 18 -0.881 15.945 -13.027 116 HA GLU 18 HA GLU 18 -0.983 14.280 -15.063 117 1HB GLU 18 1HB GLU 18 1.151 15.982 -13.895 118 2HB GLU 18 2HB GLU 18 1.746 14.744 -14.983 119 1HG GLU 18 1HG GLU 18 0.854 15.759 -16.829 120 2HG GLU 18 2HG GLU 18 -0.664 16.105 -16.025 121 HE2 GLU 18 HE GLU 18 0.698 18.423 -17.450 122 H ARG 19 H ARG 19 0.652 13.640 -11.949 123 HA ARG 19 HA ARG 19 2.036 11.389 -12.830 124 1HB ARG 19 1HB ARG 19 2.060 12.890 -10.547 125 2HB ARG 19 2HB ARG 19 1.119 11.530 -9.970 126 1HG ARG 19 1HG ARG 19 2.889 10.036 -10.149 127 2HG ARG 19 2HG ARG 19 3.586 10.852 -11.535 128 1HD ARG 19 1HD ARG 19 5.061 11.901 -10.166 129 2HD ARG 19 2HD ARG 19 3.733 12.709 -9.359 130 HE ARG 19 HE ARG 19 3.697 10.209 -8.197 131 2HH1 ARG 19 1HH ARG 19 6.302 10.338 -5.903 132 1HH2 ARG 19 2HH2 ARG 19 6.266 12.601 -8.676 133 2HH2 ARG 19 1HH2 ARG 19 7.148 12.120 -7.265 134 H ILE 20 H ILE 20 -1.146 11.877 -11.165 135 HA ILE 20 HA ILE 20 -1.755 9.179 -10.834 136 HB ILE 20 HB ILE 20 -3.592 11.552 -11.180 137 1HG1 ILE 20 1HG1 ILE 20 -2.766 10.368 -8.542 138 2HG1 ILE 20 2HG1 ILE 20 -1.723 11.527 -9.342 139 1HG2 ILE 20 1HG2 ILE 20 -4.613 9.245 -11.451 140 2HG2 ILE 20 2HG2 ILE 20 -4.191 8.961 -9.746 141 3HG2 ILE 20 3HG2 ILE 20 -5.309 10.277 -10.178 142 1HD1 ILE 20 3HD1 ILE 20 -4.215 12.738 -9.582 143 2HD1 ILE 20 1HD1 ILE 20 -4.314 11.954 -7.988 144 3HD1 ILE 20 2HD1 ILE 20 -3.007 13.113 -8.330 145 H SER 21 H SER 21 -2.357 11.473 -13.552 146 HA SER 21 HA SER 21 -3.919 9.743 -15.032 147 1HB SER 21 1HB SER 21 -2.379 11.356 -16.828 148 2HB SER 21 2HB SER 21 -4.033 11.603 -16.303 149 HG SER 21 HG SER 21 -2.913 13.452 -15.692 150 H GLY 22 H GLY 22 -0.348 10.407 -15.123 151 1HA GLY 22 2HA GLY 22 1.377 9.178 -15.870 152 2HA GLY 22 1HA GLY 22 0.335 8.685 -17.190 153 H ASP 23 H ASP 23 0.118 8.071 -13.615 154 HA ASP 23 HA ASP 23 0.997 5.445 -13.809 155 1HB ASP 23 1HB ASP 23 -0.565 7.051 -11.774 156 2HB ASP 23 2HB ASP 23 -0.420 5.319 -11.545 157 HD2 ASP 23 HD ASP 23 0.719 6.341 -9.591 158 H LEU 24 H LEU 24 -2.275 7.007 -13.718 159 HA LEU 24 HA LEU 24 -3.808 4.706 -13.610 160 1HB LEU 24 1HB LEU 24 -4.500 7.109 -13.296 161 2HB LEU 24 2HB LEU 24 -4.511 7.267 -15.041 162 HG LEU 24 HG LEU 24 -6.165 5.281 -15.028 163 1HD1 LEU 24 3HD1 LEU 24 -5.606 4.940 -12.484 164 2HD1 LEU 24 1HD1 LEU 24 -6.870 6.173 -12.257 165 3HD1 LEU 24 2HD1 LEU 24 -7.249 4.654 -13.104 166 1HD2 LEU 24 3HD2 LEU 24 -6.639 8.136 -14.354 167 2HD2 LEU 24 1HD2 LEU 24 -7.196 7.167 -15.740 168 3HD2 LEU 24 2HD2 LEU 24 -8.015 7.022 -14.166 169 H LYS 25 H LYS 25 -2.366 6.451 -16.417 170 HA LYS 25 HA LYS 25 -3.578 4.761 -18.334 171 1HB LYS 25 1HB LYS 25 -2.990 6.720 -19.318 172 2HB LYS 25 2HB LYS 25 -1.590 6.959 -18.292 173 1HG LYS 25 1HG LYS 25 -0.184 5.698 -19.658 174 2HG LYS 25 2HG LYS 25 -1.474 4.644 -20.204 175 1HD LYS 25 1HD LYS 25 -0.718 6.118 -22.043 176 2HD LYS 25 2HD LYS 25 -2.389 6.451 -21.635 177 1HE LYS 25 1HE LYS 25 -1.797 8.631 -21.389 178 2HE LYS 25 2HE LYS 25 -0.951 8.163 -19.928 179 H THR 26 H THR 26 -0.451 4.767 -16.558 180 HA THR 26 HA THR 26 0.764 2.710 -18.008 181 HB THR 26 HB THR 26 1.037 3.983 -15.275 182 HG1 THR 26 1HG THR 26 1.958 4.844 -17.303 183 1HG2 THR 26 1HG2 THR 26 1.940 1.261 -15.980 184 2HG2 THR 26 2HG2 THR 26 3.304 2.355 -15.648 185 3HG2 THR 26 3HG2 THR 26 2.042 2.108 -14.418 186 H GLN 27 H GLN 27 -1.398 2.607 -15.120 187 HA GLN 27 HA GLN 27 -1.159 -0.132 -14.770 188 1HB GLN 27 1HB GLN 27 -3.444 1.757 -14.051 189 2HB GLN 27 2HB GLN 27 -3.297 0.117 -13.452 190 1HG GLN 27 1HG GLN 27 -1.098 2.198 -13.084 191 2HG GLN 27 2HG GLN 27 -2.387 1.975 -11.918 192 1HE2 GLN 27 1HE2 GLN 27 0.694 1.205 -12.608 193 2HE2 GLN 27 2HE2 GLN 27 0.879 -0.302 -11.775 194 H ILE 28 H ILE 28 -3.571 1.867 -16.591 195 HA ILE 28 HA ILE 28 -5.251 -0.173 -17.361 196 HB ILE 28 HB ILE 28 -4.650 2.567 -18.172 197 1HG1 ILE 28 1HG1 ILE 28 -7.374 1.719 -18.557 198 2HG1 ILE 28 2HG1 ILE 28 -6.775 1.057 -17.050 199 1HG2 ILE 28 2HG2 ILE 28 -5.746 0.630 -20.226 200 2HG2 ILE 28 3HG2 ILE 28 -5.885 2.401 -20.330 201 3HG2 ILE 28 1HG2 ILE 28 -4.280 1.631 -20.351 202 1HD1 ILE 28 1HD1 ILE 28 -6.118 3.932 -17.649 203 2HD1 ILE 28 2HD1 ILE 28 -7.790 3.536 -17.185 204 3HD1 ILE 28 3HD1 ILE 28 -6.446 3.146 -16.085 205 H ASP 29 H ASP 29 -2.359 1.149 -19.117 206 HA ASP 29 HA ASP 29 -2.486 -0.560 -21.234 207 1HB ASP 29 1HB ASP 29 -0.696 1.369 -20.219 208 2HB ASP 29 2HB ASP 29 0.273 -0.088 -20.310 209 HD2 ASP 29 HD ASP 29 1.318 0.369 -22.943 210 H GLN 30 H GLN 30 -1.195 -0.975 -17.912 211 HA GLN 30 HA GLN 30 0.277 -3.276 -18.375 212 1HB GLN 30 1HB GLN 30 -0.677 -1.726 -16.079 213 2HB GLN 30 2HB GLN 30 -0.701 -3.443 -15.731 214 1HG GLN 30 1HG GLN 30 1.539 -3.369 -15.398 215 2HG GLN 30 2HG GLN 30 1.751 -3.004 -17.099 216 1HE2 GLN 30 1HE2 GLN 30 0.390 -1.228 -14.325 217 2HE2 GLN 30 2HE2 GLN 30 1.365 0.196 -14.476 218 H VAL 31 H VAL 31 -3.189 -2.731 -17.579 219 HA VAL 31 HA VAL 31 -3.753 -5.492 -17.223 220 HB VAL 31 HB VAL 31 -5.340 -2.963 -17.522 221 1HG1 VAL 31 2HG1 VAL 31 -6.568 -4.720 -18.767 222 2HG1 VAL 31 3HG1 VAL 31 -6.546 -5.742 -17.310 223 3HG1 VAL 31 1HG1 VAL 31 -7.425 -4.195 -17.298 224 1HG2 VAL 31 2HG2 VAL 31 -4.156 -4.125 -15.363 225 2HG2 VAL 31 3HG2 VAL 31 -5.587 -3.070 -15.276 226 3HG2 VAL 31 1HG2 VAL 31 -5.785 -4.839 -15.275 227 H GLU 32 H GLU 32 -4.381 -3.105 -19.890 228 HA GLU 32 HA GLU 32 -5.597 -4.786 -21.616 229 1HB GLU 32 1HB GLU 32 -3.995 -2.295 -21.835 230 2HB GLU 32 2HB GLU 32 -4.070 -3.228 -23.316 231 1HG GLU 32 1HG GLU 32 -6.691 -3.365 -22.629 232 2HG GLU 32 2HG GLU 32 -6.290 -1.870 -21.808 233 HE2 GLU 32 HE GLU 32 -6.887 -0.354 -24.867 234 H SER 33 H SER 33 -2.072 -4.392 -20.992 235 HA SER 33 HA SER 33 -1.334 -6.114 -23.094 236 1HB SER 33 1HB SER 33 -0.004 -4.283 -21.580 237 2HB SER 33 2HB SER 33 0.492 -5.743 -20.748 238 HG SER 33 HG SER 33 0.971 -6.542 -23.072 239 H THR 34 H THR 34 -1.408 -6.448 -19.469 240 HA THR 34 HA THR 34 -0.645 -9.104 -19.343 241 HB THR 34 HB THR 34 -2.168 -7.140 -17.631 242 HG1 THR 34 1HG THR 34 -0.288 -7.862 -16.293 243 1HG2 THR 34 1HG2 THR 34 -1.776 -10.097 -16.931 244 2HG2 THR 34 2HG2 THR 34 -2.391 -8.832 -15.840 245 3HG2 THR 34 3HG2 THR 34 -3.355 -9.340 -17.248 246 H ALA 35 H ALA 35 -3.918 -7.683 -19.843 247 HA ALA 35 HA ALA 35 -5.382 -9.998 -19.620 248 1HB ALA 35 3HB ALA 35 -7.092 -8.788 -20.704 249 2HB ALA 35 2HB ALA 35 -5.939 -7.880 -21.711 250 3HB ALA 35 1HB ALA 35 -6.080 -7.519 -19.974 251 H GLY 36 H GLY 36 -3.149 -8.927 -22.153 252 1HA GLY 36 2HA GLY 36 -2.322 -10.001 -23.946 253 2HA GLY 36 1HA GLY 36 -3.987 -10.390 -24.331 254 H SER 37 H SER 37 -2.114 -11.448 -21.429 255 HA SER 37 HA SER 37 -1.644 -14.012 -22.530 256 1HB SER 37 1HB SER 37 -1.473 -13.762 -19.587 257 2HB SER 37 2HB SER 37 -0.257 -14.284 -20.736 258 HG SER 37 HG SER 37 -0.755 -11.721 -19.677 259 H LEU 38 H LEU 38 -4.342 -12.444 -21.087 260 HA LEU 38 HA LEU 38 -5.419 -14.891 -19.954 261 1HB LEU 38 1HB LEU 38 -6.152 -11.991 -19.892 262 2HB LEU 38 2HB LEU 38 -7.378 -13.194 -19.545 263 HG LEU 38 HG LEU 38 -6.692 -12.959 -17.425 264 1HD1 LEU 38 2HD1 LEU 38 -5.925 -15.227 -18.012 265 2HD1 LEU 38 3HD1 LEU 38 -4.306 -14.577 -18.362 266 3HD1 LEU 38 1HD1 LEU 38 -4.959 -14.496 -16.708 267 1HD2 LEU 38 3HD2 LEU 38 -4.007 -11.978 -18.433 268 2HD2 LEU 38 1HD2 LEU 38 -5.377 -10.977 -17.895 269 3HD2 LEU 38 2HD2 LEU 38 -4.522 -12.015 -16.729 270 H GLN 39 H GLN 39 -6.490 -12.362 -22.342 271 HA GLN 39 HA GLN 39 -8.601 -13.739 -23.329 272 1HB GLN 39 1HB GLN 39 -8.033 -12.418 -25.520 273 2HB GLN 39 2HB GLN 39 -8.415 -11.521 -24.064 274 1HG GLN 39 1HG GLN 39 -5.606 -12.042 -23.955 275 2HG GLN 39 2HG GLN 39 -5.941 -11.540 -25.601 276 1HE2 GLN 39 1HE2 GLN 39 -7.552 -10.672 -22.558 277 2HE2 GLN 39 2HE2 GLN 39 -7.257 -8.966 -22.626 278 H GLY 40 H GLY 40 -5.154 -14.317 -23.820 279 1HA GLY 40 2HA GLY 40 -4.055 -15.644 -25.337 280 2HA GLY 40 1HA GLY 40 -5.568 -16.024 -26.134 281 H GLN 41 H GLN 41 -5.950 -16.301 -22.742 282 HA GLN 41 HA GLN 41 -5.599 -19.181 -22.993 283 1HB GLN 41 1HB GLN 41 -4.453 -17.314 -20.954 284 2HB GLN 41 2HB GLN 41 -5.094 -18.824 -20.338 285 1HG GLN 41 1HG GLN 41 -3.228 -19.903 -21.032 286 2HG GLN 41 2HG GLN 41 -3.600 -19.483 -22.692 287 1HE2 GLN 41 1HE2 GLN 41 -3.206 -17.011 -23.119 288 2HE2 GLN 41 2HE2 GLN 41 -1.641 -16.424 -22.664 289 H TRP 42 H TRP 42 -7.747 -19.793 -23.144 290 HA TRP 42 HA TRP 42 -9.340 -19.507 -20.796 291 1HB TRP 42 1HB TRP 42 -10.180 -18.031 -23.295 292 2HB TRP 42 2HB TRP 42 -11.259 -18.422 -21.971 293 HD1 TRP 42 HD TRP 42 -9.288 -15.592 -23.105 294 HE1 TRP 42 1HE TRP 42 -8.723 -13.823 -21.230 295 HE3 TRP 42 3HE TRP 42 -10.441 -18.608 -19.176 296 HZ2 TRP 42 2HZ TRP 42 -8.818 -13.882 -18.378 297 HZ3 TRP 42 3HZ TRP 42 -10.177 -17.674 -16.879 298 HH2 TRP 42 HH TRP 42 -9.397 -15.399 -16.448 299 H ARG 43 H ARG 43 -11.296 -20.902 -20.988 300 HA ARG 43 HA ARG 43 -10.739 -23.006 -22.875 301 1HB ARG 43 1HB ARG 43 -12.538 -22.816 -20.415 302 2HB ARG 43 2HB ARG 43 -12.559 -24.214 -21.471 303 1HG ARG 43 1HG ARG 43 -9.919 -23.212 -20.365 304 2HG ARG 43 2HG ARG 43 -10.968 -24.187 -19.354 305 1HD ARG 43 1HD ARG 43 -10.851 -25.481 -21.918 306 2HD ARG 43 2HD ARG 43 -9.206 -25.052 -21.491 307 HE ARG 43 HE ARG 43 -10.125 -26.128 -19.141 308 2HH1 ARG 43 1HH ARG 43 -10.116 -29.556 -19.700 309 1HH2 ARG 43 2HH2 ARG 43 -10.232 -27.306 -22.481 310 2HH2 ARG 43 1HH2 ARG 43 -10.202 -28.976 -22.024 311 H GLY 44 H GLY 44 -13.429 -20.845 -21.769 312 1HA GLY 44 2HA GLY 44 -15.473 -21.755 -23.383 313 2HA GLY 44 1HA GLY 44 -14.534 -20.670 -24.387 314 H ALA 45 H ALA 45 -16.479 -20.952 -21.399 315 HA ALA 45 HA ALA 45 -17.698 -18.516 -21.656 316 1HB ALA 45 2HB ALA 45 -18.759 -19.166 -19.758 317 2HB ALA 45 1HB ALA 45 -17.233 -19.411 -18.874 318 3HB ALA 45 3HB ALA 45 -17.844 -20.679 -19.963 319 H ALA 46 H ALA 46 -14.908 -19.334 -19.467 320 HA ALA 46 HA ALA 46 -14.475 -16.758 -18.568 321 1HB ALA 46 3HB ALA 46 -12.274 -17.603 -17.914 322 2HB ALA 46 1HB ALA 46 -13.509 -18.852 -17.623 323 3HB ALA 46 2HB ALA 46 -12.438 -18.972 -19.039 324 H GLY 47 H GLY 47 -13.862 -18.235 -21.694 325 1HA GLY 47 2HA GLY 47 -12.771 -17.518 -23.538 326 2HA GLY 47 1HA GLY 47 -11.800 -16.454 -22.540 327 H THR 48 H THR 48 -15.210 -16.798 -23.756 328 HA THR 48 HA THR 48 -15.201 -14.249 -24.948 329 HB THR 48 HB THR 48 -17.695 -14.774 -25.127 330 HG1 THR 48 1HG THR 48 -18.273 -16.821 -24.112 331 1HG2 THR 48 3HG2 THR 48 -15.794 -17.106 -25.711 332 2HG2 THR 48 1HG2 THR 48 -17.438 -16.939 -26.370 333 3HG2 THR 48 2HG2 THR 48 -16.173 -15.774 -26.829 334 H ALA 49 H ALA 49 -15.858 -15.351 -21.659 335 HA ALA 49 HA ALA 49 -17.370 -13.101 -20.879 336 1HB ALA 49 3HB ALA 49 -15.711 -15.156 -19.373 337 2HB ALA 49 1HB ALA 49 -16.695 -13.910 -18.568 338 3HB ALA 49 2HB ALA 49 -17.476 -15.133 -19.599 339 H ALA 50 H ALA 50 -13.857 -13.964 -20.601 340 HA ALA 50 HA ALA 50 -13.234 -11.395 -19.503 341 1HB ALA 50 1HB ALA 50 -11.139 -12.299 -19.153 342 2HB ALA 50 2HB ALA 50 -12.090 -13.799 -19.270 343 3HB ALA 50 3HB ALA 50 -11.162 -13.222 -20.675 344 H GLN 51 H GLN 51 -12.469 -13.118 -22.616 345 HA GLN 51 HA GLN 51 -11.153 -11.216 -23.904 346 1HB GLN 51 1HB GLN 51 -11.532 -13.278 -25.025 347 2HB GLN 51 2HB GLN 51 -13.274 -13.146 -24.886 348 1HG GLN 51 1HG GLN 51 -11.938 -10.924 -26.379 349 2HG GLN 51 2HG GLN 51 -11.866 -12.496 -27.151 350 1HE2 GLN 51 1HE2 GLN 51 -13.772 -9.786 -26.357 351 2HE2 GLN 51 2HE2 GLN 51 -15.287 -10.297 -27.024 352 H ALA 52 H ALA 52 -14.765 -11.403 -23.634 353 HA ALA 52 HA ALA 52 -15.227 -9.067 -25.134 354 1HB ALA 52 1HB ALA 52 -16.938 -10.767 -24.818 355 2HB ALA 52 3HB ALA 52 -17.503 -9.243 -24.094 356 3HB ALA 52 2HB ALA 52 -16.885 -10.547 -23.053 357 H ALA 53 H ALA 53 -14.980 -9.734 -21.580 358 HA ALA 53 HA ALA 53 -15.543 -7.161 -20.722 359 1HB ALA 53 1HB ALA 53 -13.548 -9.005 -19.383 360 2HB ALA 53 3HB ALA 53 -15.284 -9.394 -19.430 361 3HB ALA 53 2HB ALA 53 -14.727 -7.902 -18.633 362 H VAL 54 H VAL 54 -12.653 -8.565 -22.216 363 HA VAL 54 HA VAL 54 -10.914 -6.465 -21.389 364 HB VAL 54 HB VAL 54 -10.650 -8.475 -23.634 365 1HG1 VAL 54 2HG1 VAL 54 -9.101 -6.332 -23.362 366 2HG1 VAL 54 3HG1 VAL 54 -8.318 -7.352 -22.130 367 3HG1 VAL 54 1HG1 VAL 54 -8.431 -7.918 -23.814 368 1HG2 VAL 54 2HG2 VAL 54 -10.941 -9.053 -20.948 369 2HG2 VAL 54 3HG2 VAL 54 -10.146 -10.090 -22.157 370 3HG2 VAL 54 1HG2 VAL 54 -9.173 -8.992 -21.150 371 H VAL 55 H VAL 55 -12.640 -7.321 -24.465 372 HA VAL 55 HA VAL 55 -11.760 -5.202 -25.974 373 HB VAL 55 HB VAL 55 -14.297 -6.817 -25.926 374 1HG1 VAL 55 1HG1 VAL 55 -13.916 -4.268 -27.238 375 2HG1 VAL 55 2HG1 VAL 55 -14.116 -5.562 -28.443 376 3HG1 VAL 55 3HG1 VAL 55 -15.355 -5.314 -27.190 377 1HG2 VAL 55 3HG2 VAL 55 -11.742 -7.377 -26.813 378 2HG2 VAL 55 1HG2 VAL 55 -13.229 -8.205 -27.332 379 3HG2 VAL 55 2HG2 VAL 55 -12.572 -6.865 -28.302 380 H ARG 56 H ARG 56 -14.747 -5.394 -23.911 381 HA ARG 56 HA ARG 56 -15.574 -2.840 -24.378 382 1HB ARG 56 1HB ARG 56 -16.965 -4.511 -23.215 383 2HB ARG 56 2HB ARG 56 -15.847 -4.565 -21.866 384 1HG ARG 56 1HG ARG 56 -16.658 -2.626 -20.940 385 2HG ARG 56 2HG ARG 56 -16.816 -1.828 -22.493 386 1HD ARG 56 1HD ARG 56 -18.992 -2.580 -22.825 387 2HD ARG 56 2HD ARG 56 -18.717 -4.094 -21.985 388 HE ARG 56 HE ARG 56 -18.513 -2.041 -20.041 389 2HH1 ARG 56 1HH ARG 56 -21.839 -1.863 -19.056 390 1HH2 ARG 56 2HH2 ARG 56 -20.995 -3.388 -22.182 391 2HH2 ARG 56 1HH2 ARG 56 -22.305 -2.975 -21.127 392 H PHE 57 H PHE 57 -13.471 -4.127 -21.706 393 HA PHE 57 HA PHE 57 -13.103 -1.747 -20.362 394 1HB PHE 57 1HB PHE 57 -12.277 -3.682 -19.275 395 2HB PHE 57 2HB PHE 57 -11.706 -4.392 -20.772 396 HD1 PHE 57 1HD PHE 57 -10.930 -1.689 -18.336 397 HD2 PHE 57 2HD PHE 57 -9.436 -4.329 -21.304 398 HE1 PHE 57 1HE PHE 57 -8.584 -1.001 -17.767 399 HE2 PHE 57 2HE PHE 57 -7.090 -3.641 -20.735 400 HZ PHE 57 HZ PHE 57 -6.692 -1.986 -18.973 401 H GLN 58 H GLN 58 -11.187 -3.203 -23.072 402 HA GLN 58 HA GLN 58 -9.179 -1.360 -23.107 403 1HB GLN 58 1HB GLN 58 -10.480 -2.895 -25.395 404 2HB GLN 58 2HB GLN 58 -8.994 -1.984 -25.577 405 1HG GLN 58 1HG GLN 58 -8.559 -3.538 -23.262 406 2HG GLN 58 2HG GLN 58 -9.424 -4.618 -24.338 407 1HE2 GLN 58 1HE2 GLN 58 -8.543 -3.417 -26.784 408 2HE2 GLN 58 2HE2 GLN 58 -6.878 -3.828 -27.027 409 H GLU 59 H GLU 59 -12.215 -1.342 -25.120 410 HA GLU 59 HA GLU 59 -11.790 1.033 -26.356 411 1HB GLU 59 1HB GLU 59 -14.299 -0.427 -25.502 412 2HB GLU 59 2HB GLU 59 -14.431 1.135 -26.284 413 1HG GLU 59 1HG GLU 59 -12.660 -0.980 -27.530 414 2HG GLU 59 2HG GLU 59 -14.397 -1.104 -27.729 415 HE2 GLU 59 HE GLU 59 -12.227 0.274 -29.962 416 H ALA 60 H ALA 60 -12.962 0.388 -23.040 417 HA ALA 60 HA ALA 60 -13.773 3.072 -22.556 418 1HB ALA 60 3HB ALA 60 -13.161 0.708 -20.739 419 2HB ALA 60 1HB ALA 60 -13.856 2.249 -20.183 420 3HB ALA 60 2HB ALA 60 -14.760 1.226 -21.325 421 H ALA 61 H ALA 61 -10.762 1.180 -22.278 422 HA ALA 61 HA ALA 61 -9.365 2.844 -20.560 423 1HB ALA 61 3HB ALA 61 -8.801 0.513 -21.551 424 2HB ALA 61 1HB ALA 61 -8.124 1.418 -22.926 425 3HB ALA 61 2HB ALA 61 -7.461 1.655 -21.291 426 H ASN 62 H ASN 62 -9.398 2.832 -24.199 427 HA ASN 62 HA ASN 62 -7.794 4.943 -24.608 428 1HB ASN 62 1HB ASN 62 -10.406 4.479 -26.137 429 2HB ASN 62 2HB ASN 62 -8.954 5.235 -26.763 430 1HD2 ASN 62 1HD2 ASN 62 -10.420 2.254 -25.655 431 2HD2 ASN 62 2HD2 ASN 62 -9.316 1.146 -26.400 432 H LYS 63 H LYS 63 -11.406 4.957 -24.124 433 HA LYS 63 HA LYS 63 -11.850 7.651 -24.352 434 1HB LYS 63 1HB LYS 63 -13.221 5.584 -22.609 435 2HB LYS 63 2HB LYS 63 -13.839 7.201 -22.878 436 1HG LYS 63 1HG LYS 63 -13.098 5.873 -25.405 437 2HG LYS 63 2HG LYS 63 -14.291 4.954 -24.509 438 1HD LYS 63 1HD LYS 63 -14.502 7.866 -25.392 439 2HD LYS 63 2HD LYS 63 -15.467 6.519 -25.964 440 1HE LYS 63 1HE LYS 63 -16.049 6.287 -23.340 441 2HE LYS 63 2HE LYS 63 -15.622 7.986 -23.333 442 H GLN 64 H GLN 64 -10.471 5.777 -21.641 443 HA GLN 64 HA GLN 64 -10.615 7.989 -19.870 444 1HB GLN 64 1HB GLN 64 -9.752 5.167 -19.779 445 2HB GLN 64 2HB GLN 64 -8.729 6.215 -18.817 446 1HG GLN 64 1HG GLN 64 -11.420 7.052 -18.318 447 2HG GLN 64 2HG GLN 64 -11.435 5.301 -18.262 448 1HE2 GLN 64 1HE2 GLN 64 -10.017 8.226 -16.957 449 2HE2 GLN 64 2HE2 GLN 64 -9.413 7.566 -15.474 450 H LYS 65 H LYS 65 -8.285 6.653 -22.200 451 HA LYS 65 HA LYS 65 -6.061 8.115 -21.206 452 1HB LYS 65 1HB LYS 65 -6.666 6.342 -23.511 453 2HB LYS 65 2HB LYS 65 -5.379 7.505 -23.756 454 1HG LYS 65 1HG LYS 65 -4.199 5.710 -22.815 455 2HG LYS 65 2HG LYS 65 -4.515 6.691 -21.398 456 1HD LYS 65 1HD LYS 65 -6.666 4.733 -22.080 457 2HD LYS 65 2HD LYS 65 -5.140 4.018 -21.598 458 1HE LYS 65 1HE LYS 65 -5.188 5.037 -19.448 459 2HE LYS 65 2HE LYS 65 -6.326 6.272 -19.949 460 H GLN 66 H GLN 66 -8.639 8.661 -23.637 461 HA GLN 66 HA GLN 66 -7.430 10.964 -24.691 462 1HB GLN 66 1HB GLN 66 -9.616 9.340 -25.332 463 2HB GLN 66 2HB GLN 66 -10.372 10.856 -24.885 464 1HG GLN 66 1HG GLN 66 -8.117 10.549 -26.925 465 2HG GLN 66 2HG GLN 66 -9.810 10.768 -27.320 466 1HE2 GLN 66 1HE2 GLN 66 -7.524 12.415 -27.991 467 2HE2 GLN 66 2HE2 GLN 66 -7.816 14.005 -27.368 468 H GLU 67 H GLU 67 -9.842 10.329 -22.095 469 HA GLU 67 HA GLU 67 -10.312 13.094 -21.685 470 1HB GLU 67 1HB GLU 67 -11.903 12.413 -20.121 471 2HB GLU 67 2HB GLU 67 -11.834 11.004 -21.160 472 1HG GLU 67 1HG GLU 67 -11.590 9.960 -19.099 473 2HG GLU 67 2HG GLU 67 -9.901 10.242 -19.473 474 HE2 GLU 67 HE GLU 67 -9.065 12.284 -17.393 475 H LEU 68 H LEU 68 -7.970 10.708 -20.598 476 HA LEU 68 HA LEU 68 -7.257 12.037 -18.193 477 1HB LEU 68 1HB LEU 68 -6.230 9.779 -19.834 478 2HB LEU 68 2HB LEU 68 -5.106 10.549 -18.732 479 HG LEU 68 HG LEU 68 -7.792 9.426 -17.896 480 1HD1 LEU 68 3HD1 LEU 68 -5.391 8.035 -18.592 481 2HD1 LEU 68 1HD1 LEU 68 -5.656 7.889 -16.838 482 3HD1 LEU 68 2HD1 LEU 68 -6.930 7.387 -17.975 483 1HD2 LEU 68 3HD2 LEU 68 -6.557 11.289 -16.546 484 2HD2 LEU 68 1HD2 LEU 68 -7.231 9.873 -15.704 485 3HD2 LEU 68 2HD2 LEU 68 -5.487 9.956 -16.050 486 H ASP 69 H ASP 69 -6.157 12.127 -21.613 487 HA ASP 69 HA ASP 69 -3.976 13.811 -21.007 488 1HB ASP 69 1HB ASP 69 -4.673 12.252 -23.145 489 2HB ASP 69 2HB ASP 69 -5.180 13.815 -23.754 490 HD2 ASP 69 HD ASP 69 -2.502 11.939 -22.859 491 H GLU 70 H GLU 70 -7.240 14.203 -22.573 492 HA GLU 70 HA GLU 70 -7.144 16.818 -23.193 493 1HB GLU 70 1HB GLU 70 -9.470 16.709 -23.401 494 2HB GLU 70 2HB GLU 70 -9.036 15.013 -23.460 495 1HG GLU 70 1HG GLU 70 -9.526 14.783 -21.029 496 2HG GLU 70 2HG GLU 70 -9.908 16.490 -20.930 497 HE2 GLU 70 HE GLU 70 -11.871 15.413 -20.197 498 H ILE 71 H ILE 71 -7.967 15.355 -19.988 499 HA ILE 71 HA ILE 71 -8.463 17.868 -18.769 500 HB ILE 71 HB ILE 71 -8.140 15.041 -17.842 501 1HG1 ILE 71 1HG1 ILE 71 -10.424 16.932 -17.303 502 2HG1 ILE 71 2HG1 ILE 71 -10.275 16.130 -18.854 503 1HG2 ILE 71 1HG2 ILE 71 -7.979 17.515 -16.150 504 2HG2 ILE 71 2HG2 ILE 71 -8.769 16.050 -15.520 505 3HG2 ILE 71 3HG2 ILE 71 -7.066 15.992 -16.035 506 1HD1 ILE 71 1HD1 ILE 71 -10.164 13.912 -17.673 507 2HD1 ILE 71 2HD1 ILE 71 -10.415 14.760 -16.129 508 3HD1 ILE 71 3HD1 ILE 71 -11.689 14.781 -17.372 509 H SER 72 H SER 72 -5.619 15.739 -19.203 510 HA SER 72 HA SER 72 -4.013 17.046 -17.347 511 1HB SER 72 1HB SER 72 -2.838 15.191 -17.893 512 2HB SER 72 2HB SER 72 -3.742 14.979 -19.380 513 HG SER 72 HG SER 72 -1.205 15.660 -19.200 514 H THR 73 H THR 73 -4.963 17.751 -20.693 515 HA THR 73 HA THR 73 -2.910 19.801 -20.949 516 HB THR 73 HB THR 73 -4.768 18.256 -22.719 517 HG1 THR 73 1HG THR 73 -2.713 18.678 -24.014 518 1HG2 THR 73 1HG2 THR 73 -4.121 21.195 -23.097 519 2HG2 THR 73 2HG2 THR 73 -4.092 20.116 -24.512 520 3HG2 THR 73 3HG2 THR 73 -5.589 20.304 -23.567 521 H ASN 74 H ASN 74 -6.343 19.426 -20.181 522 HA ASN 74 HA ASN 74 -7.302 21.857 -20.808 523 1HB ASN 74 1HB ASN 74 -7.893 19.773 -18.793 524 2HB ASN 74 2HB ASN 74 -8.365 21.367 -18.237 525 1HD2 ASN 74 1HD2 ASN 74 -9.004 18.762 -20.357 526 2HD2 ASN 74 2HD2 ASN 74 -10.414 19.384 -21.148 527 H ILE 75 H ILE 75 -4.990 20.915 -18.277 528 HA ILE 75 HA ILE 75 -5.250 23.314 -16.757 529 HB ILE 75 HB ILE 75 -2.914 21.424 -16.713 530 1HG1 ILE 75 1HG1 ILE 75 -4.928 20.035 -16.749 531 2HG1 ILE 75 2HG1 ILE 75 -4.133 19.975 -15.189 532 1HG2 ILE 75 1HG2 ILE 75 -4.079 23.488 -14.919 533 2HG2 ILE 75 2HG2 ILE 75 -3.423 22.022 -14.152 534 3HG2 ILE 75 3HG2 ILE 75 -2.384 23.022 -15.196 535 1HD1 ILE 75 2HD1 ILE 75 -6.518 21.764 -15.851 536 2HD1 ILE 75 3HD1 ILE 75 -6.608 20.218 -14.972 537 3HD1 ILE 75 1HD1 ILE 75 -5.742 21.599 -14.257 538 H ARG 76 H ARG 76 -2.889 22.025 -19.184 539 HA ARG 76 HA ARG 76 -1.125 24.060 -19.124 540 1HB ARG 76 1HB ARG 76 -2.034 22.080 -21.168 541 2HB ARG 76 2HB ARG 76 -1.202 23.472 -21.830 542 1HG ARG 76 1HG ARG 76 0.761 22.487 -21.267 543 2HG ARG 76 2HG ARG 76 0.350 22.745 -19.583 544 1HD ARG 76 1HD ARG 76 -0.069 20.527 -19.240 545 2HD ARG 76 2HD ARG 76 -1.070 20.412 -20.673 546 HE ARG 76 HE ARG 76 1.491 20.581 -21.713 547 2HH1 ARG 76 1HH ARG 76 2.685 17.339 -21.361 548 1HH2 ARG 76 2HH2 ARG 76 -0.037 18.458 -19.324 549 2HH2 ARG 76 1HH2 ARG 76 0.994 17.112 -19.678 550 H GLN 77 H GLN 77 -4.316 23.881 -20.774 551 HA GLN 77 HA GLN 77 -3.924 26.344 -22.124 552 1HB GLN 77 1HB GLN 77 -6.469 24.732 -21.643 553 2HB GLN 77 2HB GLN 77 -6.320 26.069 -22.765 554 1HG GLN 77 1HG GLN 77 -4.163 24.232 -23.308 555 2HG GLN 77 2HG GLN 77 -5.639 23.295 -23.185 556 1HE2 GLN 77 1HE2 GLN 77 -3.773 24.393 -25.394 557 2HE2 GLN 77 2HE2 GLN 77 -4.853 24.999 -26.606 558 H ALA 78 H ALA 78 -4.890 25.360 -18.928 559 HA ALA 78 HA ALA 78 -6.616 27.503 -18.322 560 1HB ALA 78 3HB ALA 78 -4.838 25.943 -16.413 561 2HB ALA 78 1HB ALA 78 -6.395 26.731 -16.061 562 3HB ALA 78 2HB ALA 78 -6.343 25.287 -17.100 563 H GLY 79 H GLY 79 -3.133 27.184 -18.682 564 1HA GLY 79 2HA GLY 79 -2.833 29.947 -17.668 565 2HA GLY 79 1HA GLY 79 -1.961 29.276 -19.032 566 H VAL 80 H VAL 80 -1.942 26.591 -17.315 567 HA VAL 80 HA VAL 80 0.338 27.414 -15.651 568 HB VAL 80 HB VAL 80 -1.152 26.731 -14.073 569 1HG1 VAL 80 3HG1 VAL 80 -2.266 24.768 -16.100 570 2HG1 VAL 80 1HG1 VAL 80 -2.786 24.842 -14.399 571 3HG1 VAL 80 2HG1 VAL 80 -3.038 26.242 -15.468 572 1HG2 VAL 80 3HG2 VAL 80 0.927 25.123 -14.358 573 2HG2 VAL 80 1HG2 VAL 80 -0.342 24.778 -13.158 574 3HG2 VAL 80 2HG2 VAL 80 -0.334 23.918 -14.717 575 H GLN 81 H GLN 81 1.901 27.119 -17.293 576 HA GLN 81 HA GLN 81 2.311 24.313 -17.907 577 1HB GLN 81 1HB GLN 81 2.502 24.615 -20.206 578 2HB GLN 81 2HB GLN 81 1.231 25.764 -19.839 579 1HG GLN 81 1HG GLN 81 2.955 27.590 -19.677 580 2HG GLN 81 2HG GLN 81 4.202 26.433 -20.095 581 1HE2 GLN 81 1HE2 GLN 81 2.664 28.876 -21.330 582 2HE2 GLN 81 2HE2 GLN 81 2.437 28.419 -22.986 583 H TYR 82 H TYR 82 3.395 26.869 -16.264 584 HA TYR 82 HA TYR 82 6.191 26.144 -16.729 585 1HB TYR 82 1HB TYR 82 6.733 28.576 -16.682 586 2HB TYR 82 2HB TYR 82 5.541 28.302 -17.937 587 HD1 TYR 82 1HD TYR 82 3.037 28.670 -17.272 588 HD2 TYR 82 2HD TYR 82 6.350 30.200 -15.038 589 HE1 TYR 82 1HE TYR 82 1.522 30.408 -16.201 590 HE2 TYR 82 2HE TYR 82 4.823 31.933 -13.975 591 HH TYR 82 HH TYR 82 1.400 32.132 -14.905 592 H SER 83 H SER 83 5.912 24.851 -14.773 593 HA SER 83 HA SER 83 5.908 26.575 -12.424 594 1HB SER 83 1HB SER 83 4.758 24.775 -11.159 595 2HB SER 83 2HB SER 83 3.775 25.361 -12.486 596 HG SER 83 HG SER 83 3.770 23.399 -13.330 597 H ARG 84 H ARG 84 6.700 23.253 -13.687 598 HA ARG 84 HA ARG 84 8.816 23.076 -11.764 599 1HB ARG 84 1HB ARG 84 7.697 21.180 -13.874 600 2HB ARG 84 2HB ARG 84 9.160 20.792 -12.991 601 1HG ARG 84 1HG ARG 84 8.025 20.695 -10.896 602 2HG ARG 84 2HG ARG 84 6.652 21.609 -11.488 603 1HD ARG 84 1HD ARG 84 5.707 19.765 -12.580 604 2HD ARG 84 2HD ARG 84 7.255 18.993 -12.858 605 HE ARG 84 HE ARG 84 6.598 19.168 -10.018 606 2HH1 ARG 84 1HH ARG 84 5.773 15.810 -9.699 607 1HH2 ARG 84 2HH2 ARG 84 6.099 17.255 -12.958 608 2HH2 ARG 84 1HH2 ARG 84 5.747 15.794 -12.096 609 H ALA 85 H ALA 85 8.729 25.013 -14.202 610 HA ALA 85 HA ALA 85 10.764 24.063 -15.960 611 1HB ALA 85 3HB ALA 85 8.860 25.721 -16.447 612 2HB ALA 85 2HB ALA 85 10.476 26.157 -17.052 613 3HB ALA 85 1HB ALA 85 9.839 26.928 -15.579 614 H ASP 86 H ASP 86 11.971 23.501 -13.699 615 HA ASP 86 HA ASP 86 13.804 25.736 -13.337 616 1HB ASP 86 1HB ASP 86 12.235 24.235 -11.352 617 2HB ASP 86 2HB ASP 86 13.950 24.148 -11.002 618 HD2 ASP 86 HD ASP 86 11.560 25.606 -9.948 619 H GLU 87 H GLU 87 13.170 22.174 -13.085 620 HA GLU 87 HA GLU 87 15.952 21.583 -12.994 621 1HB GLU 87 1HB GLU 87 13.489 20.211 -12.460 622 2HB GLU 87 2HB GLU 87 14.348 19.274 -13.666 623 1HG GLU 87 1HG GLU 87 16.264 20.161 -11.689 624 2HG GLU 87 2HG GLU 87 14.893 19.471 -10.844 625 HE2 GLU 87 HE GLU 87 17.649 18.566 -11.625 626 H GLU 88 H GLU 88 14.147 22.818 -15.419 627 HA GLU 88 HA GLU 88 14.356 21.117 -17.534 628 1HB GLU 88 1HB GLU 88 14.197 24.082 -17.181 629 2HB GLU 88 2HB GLU 88 14.728 23.528 -18.756 630 1HG GLU 88 1HG GLU 88 12.478 21.904 -17.896 631 2HG GLU 88 2HG GLU 88 12.055 23.596 -17.728 632 HE2 GLU 88 HE GLU 88 11.125 23.980 -20.560 633 H GLN 89 H GLN 89 16.870 22.893 -15.826 634 HA GLN 89 HA GLN 89 18.726 22.504 -17.996 635 1HB GLN 89 1HB GLN 89 18.458 24.449 -16.007 636 2HB GLN 89 2HB GLN 89 19.818 23.500 -15.441 637 1HG GLN 89 1HG GLN 89 20.878 23.731 -17.729 638 2HG GLN 89 2HG GLN 89 19.550 24.768 -18.208 639 1HE2 GLN 89 1HE2 GLN 89 19.733 26.857 -17.902 640 2HE2 GLN 89 2HE2 GLN 89 20.859 27.666 -16.865 641 H GLN 90 H GLN 90 17.394 20.353 -16.100 642 HA GLN 90 HA GLN 90 19.283 19.293 -14.452 643 1HB GLN 90 1HB GLN 90 17.015 18.462 -14.437 644 2HB GLN 90 2HB GLN 90 17.107 17.967 -16.116 645 1HG GLN 90 1HG GLN 90 19.255 16.741 -14.528 646 2HG GLN 90 2HG GLN 90 17.680 16.375 -13.851 647 1HE2 GLN 90 1HE2 GLN 90 16.092 15.364 -15.138 648 2HE2 GLN 90 2HE2 GLN 90 16.507 14.397 -16.514 649 H GLN 91 H GLN 91 19.084 19.256 -17.988 650 HA GLN 91 HA GLN 91 20.694 17.071 -18.473 651 1HB GLN 91 1HB GLN 91 19.400 18.109 -20.249 652 2HB GLN 91 2HB GLN 91 20.239 19.635 -20.052 653 1HG GLN 91 1HG GLN 91 22.243 18.819 -21.017 654 2HG GLN 91 2HG GLN 91 21.841 17.145 -20.689 655 1HE2 GLN 91 1HE2 GLN 91 22.168 19.338 -23.053 656 2HE2 GLN 91 2HE2 GLN 91 21.089 18.726 -24.263 657 H ALA 92 H ALA 92 21.438 20.072 -16.966 658 HA ALA 92 HA ALA 92 24.282 19.777 -17.634 659 1HB ALA 92 3HB ALA 92 24.511 22.096 -17.092 660 2HB ALA 92 2HB ALA 92 22.902 22.151 -16.333 661 3HB ALA 92 1HB ALA 92 23.048 21.965 -18.097 662 H LEU 93 H LEU 93 22.890 17.948 -15.832 663 HA LEU 93 HA LEU 93 23.522 18.846 -13.172 664 1HB LEU 93 1HB LEU 93 21.534 17.516 -13.612 665 2HB LEU 93 2HB LEU 93 22.514 16.210 -14.249 666 HG LEU 93 HG LEU 93 23.315 16.962 -11.539 667 1HD1 LEU 93 3HD1 LEU 93 20.433 16.274 -12.075 668 2HD1 LEU 93 1HD1 LEU 93 21.227 15.812 -10.550 669 3HD1 LEU 93 2HD1 LEU 93 21.118 17.527 -11.013 670 1HD2 LEU 93 1HD2 LEU 93 22.485 14.399 -12.915 671 2HD2 LEU 93 2HD2 LEU 93 24.126 14.941 -12.489 672 3HD2 LEU 93 3HD2 LEU 93 22.978 14.486 -11.207 673 H SER 94 H SER 94 24.833 16.600 -15.659 674 HA SER 94 HA SER 94 26.745 15.432 -14.071 675 1HB SER 94 1HB SER 94 26.286 15.814 -16.988 676 2HB SER 94 2HB SER 94 27.951 15.495 -16.548 677 HG SER 94 HG SER 94 26.881 13.503 -16.917 678 H SER 95 H SER 95 26.977 18.333 -16.252 679 HA SER 95 HA SER 95 29.549 18.948 -16.004 680 1HB SER 95 1HB SER 95 27.615 20.212 -17.187 681 2HB SER 95 2HB SER 95 27.407 21.080 -15.679 682 HG SER 95 HG SER 95 28.939 21.938 -17.482 683 H GLN 96 H GLN 96 26.940 19.956 -13.676 684 HA GLN 96 HA GLN 96 28.793 21.115 -11.908 685 1HB GLN 96 1HB GLN 96 26.054 21.219 -12.243 686 2HB GLN 96 2HB GLN 96 26.179 20.239 -10.796 687 1HG GLN 96 1HG GLN 96 28.049 22.277 -10.336 688 2HG GLN 96 2HG GLN 96 26.754 23.114 -11.169 689 1HE2 GLN 96 1HE2 GLN 96 27.873 21.938 -8.250 690 2HE2 GLN 96 2HE2 GLN 96 26.432 22.044 -7.294 691 H MET 97 H MET 97 26.739 18.116 -11.670 692 HA MET 97 HA MET 97 27.802 17.191 -9.340 693 1HB MET 97 1HB MET 97 25.847 16.342 -10.944 694 2HB MET 97 2HB MET 97 27.091 15.324 -11.643 695 1HG MET 97 1HG MET 97 27.159 15.207 -8.706 696 2HG MET 97 2HG MET 97 25.574 14.779 -9.317 697 1HE MET 97 2HE MET 97 25.499 13.558 -11.666 698 2HE MET 97 3HE MET 97 26.274 11.964 -11.828 699 3HE MET 97 1HE MET 97 25.122 12.263 -10.504 700 H GLY 98 H GLY 98 29.110 14.987 -9.187 701 1HA GLY 98 2HA GLY 98 31.718 15.344 -9.624 702 2HA GLY 98 1HA GLY 98 31.204 14.744 -11.188 703 H PHE 99 H PHE 99 29.968 12.632 -11.245 704 HA PHE 99 HA PHE 99 29.872 10.981 -8.986 705 1HB PHE 99 1HB PHE 99 28.900 11.020 -11.575 706 2HB PHE 99 2HB PHE 99 30.201 9.863 -11.777 707 HD1 PHE 99 1HD PHE 99 30.187 7.755 -10.431 708 HD2 PHE 99 2HD PHE 99 26.885 10.419 -10.466 709 HE1 PHE 99 1HE PHE 99 28.710 5.936 -9.531 710 HE2 PHE 99 2HE PHE 99 25.408 8.601 -9.566 711 HZ PHE 99 HZ PHE 99 26.338 6.381 -9.110 712 H MET 601 H MET 601 6.747 -20.942 -20.271 713 HA MET 601 HA MET 601 8.870 -20.526 -21.098 714 1HB MET 601 1HB MET 601 10.861 -21.685 -19.930 715 2HB MET 601 2HB MET 601 10.106 -20.398 -19.010 716 1HG MET 601 1HG MET 601 8.606 -22.349 -18.012 717 2HG MET 601 2HG MET 601 9.886 -23.394 -18.595 718 1HE MET 601 3HE MET 601 10.564 -24.296 -16.418 719 2HE MET 601 1HE MET 601 12.057 -23.836 -17.271 720 3HE MET 601 2HE MET 601 11.889 -23.507 -15.530 721 H THR 602 H THR 602 7.537 -23.549 -19.775 722 HA THR 602 HA THR 602 8.909 -25.325 -21.476 723 HB THR 602 HB THR 602 6.270 -25.434 -19.933 724 HG1 THR 602 1HG THR 602 8.447 -25.264 -18.867 725 1HG2 THR 602 3HG2 THR 602 6.911 -27.189 -21.988 726 2HG2 THR 602 1HG2 THR 602 7.717 -27.951 -20.596 727 3HG2 THR 602 2HG2 THR 602 5.965 -27.636 -20.548 728 H GLU 603 H GLU 603 6.021 -23.285 -21.909 729 HA GLU 603 HA GLU 603 6.129 -24.030 -24.702 730 1HB GLU 603 1HB GLU 603 3.582 -24.084 -23.024 731 2HB GLU 603 2HB GLU 603 3.610 -24.180 -24.773 732 1HG GLU 603 1HG GLU 603 5.201 -26.125 -23.054 733 2HG GLU 603 2HG GLU 603 3.516 -26.415 -23.439 734 HE2 GLU 603 HE GLU 603 4.326 -27.687 -26.508 735 H GLN 604 H GLN 604 6.534 -22.114 -25.717 736 HA GLN 604 HA GLN 604 5.977 -19.672 -24.474 737 1HB GLN 604 1HB GLN 604 6.738 -18.687 -26.642 738 2HB GLN 604 2HB GLN 604 7.843 -19.900 -26.027 739 1HG GLN 604 1HG GLN 604 7.002 -21.577 -27.578 740 2HG GLN 604 2HG GLN 604 5.658 -20.556 -28.051 741 1HE2 GLN 604 1HE2 GLN 604 6.156 -20.507 -30.191 742 2HE2 GLN 604 2HE2 GLN 604 7.522 -19.677 -30.860 743 H GLN 605 H GLN 605 3.937 -21.888 -26.030 744 HA GLN 605 HA GLN 605 2.325 -20.126 -27.485 745 1HB GLN 605 1HB GLN 605 1.842 -22.895 -26.319 746 2HB GLN 605 2HB GLN 605 0.631 -22.059 -27.272 747 1HG GLN 605 1HG GLN 605 3.094 -21.848 -28.723 748 2HG GLN 605 2HG GLN 605 2.976 -23.512 -28.185 749 1HE2 GLN 605 1HE2 GLN 605 2.902 -23.340 -30.732 750 2HE2 GLN 605 2HE2 GLN 605 1.320 -23.476 -31.425 751 H TRP 606 H TRP 606 2.466 -21.135 -24.071 752 HA TRP 606 HA TRP 606 0.768 -18.959 -23.341 753 1HB TRP 606 1HB TRP 606 -1.095 -20.043 -22.531 754 2HB TRP 606 2HB TRP 606 -0.817 -20.832 -24.071 755 HD1 TRP 606 HD TRP 606 0.362 -23.384 -23.891 756 HE1 TRP 606 1HE TRP 606 0.148 -25.299 -22.088 757 HE3 TRP 606 3HE TRP 606 -1.397 -20.402 -20.167 758 HZ2 TRP 606 2HZ TRP 606 -0.713 -25.351 -19.368 759 HZ3 TRP 606 3HZ TRP 606 -1.900 -21.464 -17.968 760 HH2 TRP 606 HH TRP 606 -1.584 -23.849 -17.538 761 H ASN 607 H ASN 607 2.292 -18.204 -21.894 762 HA ASN 607 HA ASN 607 3.848 -20.021 -20.388 763 1HB ASN 607 1HB ASN 607 4.853 -17.895 -20.991 764 2HB ASN 607 2HB ASN 607 3.492 -16.988 -20.361 765 1HD2 ASN 607 1HD2 ASN 607 5.209 -15.837 -19.236 766 2HD2 ASN 607 2HD2 ASN 607 5.776 -16.415 -17.705 767 H PHE 608 H PHE 608 2.341 -21.231 -19.055 768 HA PHE 608 HA PHE 608 0.197 -20.247 -17.694 769 1HB PHE 608 1HB PHE 608 0.259 -22.479 -17.087 770 2HB PHE 608 2HB PHE 608 1.831 -22.592 -17.853 771 HD1 PHE 608 1HD PHE 608 0.142 -21.888 -14.636 772 HD2 PHE 608 2HD PHE 608 3.792 -22.870 -16.565 773 HE1 PHE 608 1HE PHE 608 1.194 -22.357 -12.406 774 HE2 PHE 608 2HE PHE 608 4.844 -23.338 -14.335 775 HZ PHE 608 HZ PHE 608 3.533 -23.076 -12.282 776 H ALA 609 H ALA 609 3.664 -20.295 -16.681 777 HA ALA 609 HA ALA 609 3.209 -19.376 -14.074 778 1HB ALA 609 3HB ALA 609 5.656 -18.976 -15.839 779 2HB ALA 609 2HB ALA 609 5.286 -20.479 -14.959 780 3HB ALA 609 1HB ALA 609 5.603 -18.975 -14.060 781 H GLY 610 H GLY 610 2.753 -17.865 -17.120 782 1HA GLY 610 2HA GLY 610 2.968 -15.614 -17.729 783 2HA GLY 610 1HA GLY 610 3.242 -15.172 -16.055 784 H ILE 611 H ILE 611 0.685 -16.868 -18.020 785 HA ILE 611 HA ILE 611 -1.273 -14.968 -17.548 786 HB ILE 611 HB ILE 611 -1.534 -16.437 -19.348 787 1HG1 ILE 611 1HG1 ILE 611 -3.552 -16.088 -17.460 788 2HG1 ILE 611 2HG1 ILE 611 -3.747 -16.540 -19.142 789 1HG2 ILE 611 2HG2 ILE 611 -1.090 -18.635 -17.339 790 2HG2 ILE 611 3HG2 ILE 611 -1.901 -18.951 -18.891 791 3HG2 ILE 611 1HG2 ILE 611 -0.241 -18.311 -18.869 792 1HD1 ILE 611 3HD1 ILE 611 -3.141 -18.638 -17.030 793 2HD1 ILE 611 1HD1 ILE 611 -4.805 -18.093 -17.347 794 3HD1 ILE 611 2HD1 ILE 611 -3.860 -18.865 -18.642 795 H GLU 612 H GLU 612 0.106 -17.388 -15.452 796 HA GLU 612 HA GLU 612 -2.109 -17.809 -13.822 797 1HB GLU 612 1HB GLU 612 -0.329 -19.359 -13.614 798 2HB GLU 612 2HB GLU 612 0.883 -18.102 -13.459 799 1HG GLU 612 1HG GLU 612 -0.107 -17.455 -11.234 800 2HG GLU 612 2HG GLU 612 -1.264 -18.762 -11.387 801 HE2 GLU 612 HE GLU 612 -0.193 -21.002 -10.717 802 H ALA 613 H ALA 613 0.712 -15.540 -13.525 803 HA ALA 613 HA ALA 613 -0.551 -14.243 -11.272 804 1HB ALA 613 3HB ALA 613 1.520 -12.966 -11.180 805 2HB ALA 613 2HB ALA 613 2.004 -13.566 -12.784 806 3HB ALA 613 1HB ALA 613 1.911 -14.687 -11.405 807 H ALA 614 H ALA 614 -0.598 -14.076 -14.724 808 HA ALA 614 HA ALA 614 -0.731 -11.436 -15.320 809 1HB ALA 614 2HB ALA 614 -2.327 -13.815 -16.326 810 2HB ALA 614 3HB ALA 614 -2.432 -12.204 -17.076 811 3HB ALA 614 1HB ALA 614 -0.879 -13.073 -17.048 812 H ALA 615 H ALA 615 -3.431 -13.517 -14.072 813 HA ALA 615 HA ALA 615 -5.339 -11.492 -14.011 814 1HB ALA 615 1HB ALA 615 -6.653 -13.137 -13.148 815 2HB ALA 615 2HB ALA 615 -5.275 -14.189 -13.555 816 3HB ALA 615 3HB ALA 615 -5.464 -13.571 -11.897 817 H SER 616 H SER 616 -3.000 -12.662 -11.505 818 HA SER 616 HA SER 616 -3.857 -11.117 -9.445 819 1HB SER 616 1HB SER 616 -1.711 -12.816 -9.942 820 2HB SER 616 2HB SER 616 -0.908 -11.284 -9.661 821 HG SER 616 HG SER 616 -2.765 -11.430 -7.755 822 H ALA 617 H ALA 617 -1.998 -10.228 -12.344 823 HA ALA 617 HA ALA 617 -1.117 -7.716 -11.337 824 1HB ALA 617 1HB ALA 617 -0.616 -9.383 -13.557 825 2HB ALA 617 3HB ALA 617 0.141 -7.812 -13.199 826 3HB ALA 617 2HB ALA 617 -1.305 -7.888 -14.235 827 H ILE 618 H ILE 618 -3.903 -8.918 -13.277 828 HA ILE 618 HA ILE 618 -4.916 -6.423 -13.980 829 HB ILE 618 HB ILE 618 -6.341 -9.046 -13.514 830 1HG1 ILE 618 1HG1 ILE 618 -4.458 -9.171 -15.122 831 2HG1 ILE 618 2HG1 ILE 618 -6.020 -9.479 -15.854 832 1HG2 ILE 618 2HG2 ILE 618 -7.678 -6.798 -13.643 833 2HG2 ILE 618 3HG2 ILE 618 -7.310 -6.908 -15.381 834 3HG2 ILE 618 1HG2 ILE 618 -8.208 -8.218 -14.577 835 1HD1 ILE 618 2HD1 ILE 618 -5.398 -6.619 -15.928 836 2HD1 ILE 618 3HD1 ILE 618 -4.113 -7.581 -16.697 837 3HD1 ILE 618 1HD1 ILE 618 -5.793 -7.722 -17.269 838 H GLN 619 H GLN 619 -5.545 -8.534 -11.107 839 HA GLN 619 HA GLN 619 -7.494 -7.017 -9.969 840 1HB GLN 619 1HB GLN 619 -5.629 -9.104 -9.133 841 2HB GLN 619 2HB GLN 619 -5.903 -7.972 -7.825 842 1HG GLN 619 1HG GLN 619 -8.162 -9.246 -9.435 843 2HG GLN 619 2HG GLN 619 -7.552 -9.920 -7.938 844 1HE2 GLN 619 1HE2 GLN 619 -10.033 -8.335 -9.083 845 2HE2 GLN 619 2HE2 GLN 619 -10.454 -7.265 -7.787 846 H GLY 620 H GLY 620 -3.980 -6.927 -9.005 847 1HA GLY 620 2HA GLY 620 -2.675 -5.222 -8.332 848 2HA GLY 620 1HA GLY 620 -4.067 -4.701 -7.403 849 H ASN 621 H ASN 621 -4.041 -4.925 -10.981 850 HA ASN 621 HA ASN 621 -3.414 -2.199 -11.327 851 1HB ASN 621 1HB ASN 621 -4.415 -4.447 -13.104 852 2HB ASN 621 2HB ASN 621 -4.465 -2.806 -13.717 853 1HD2 ASN 621 1HD2 ASN 621 -2.362 -1.532 -13.124 854 2HD2 ASN 621 2HD2 ASN 621 -0.875 -2.314 -13.545 855 H VAL 622 H VAL 622 -6.350 -4.211 -10.983 856 HA VAL 622 HA VAL 622 -8.213 -2.386 -11.992 857 HB VAL 622 HB VAL 622 -8.364 -4.660 -10.017 858 1HG1 VAL 622 2HG1 VAL 622 -10.531 -2.799 -10.976 859 2HG1 VAL 622 3HG1 VAL 622 -10.901 -4.496 -10.584 860 3HG1 VAL 622 1HG1 VAL 622 -10.218 -3.424 -9.338 861 1HG2 VAL 622 2HG2 VAL 622 -8.037 -4.659 -12.753 862 2HG2 VAL 622 3HG2 VAL 622 -8.702 -6.000 -11.789 863 3HG2 VAL 622 1HG2 VAL 622 -9.799 -4.839 -12.576 864 H THR 623 H THR 623 -7.178 -3.082 -8.576 865 HA THR 623 HA THR 623 -8.676 -0.949 -7.494 866 HB THR 623 HB THR 623 -7.150 -1.460 -5.493 867 HG1 THR 623 1HG THR 623 -5.656 -3.240 -5.959 868 1HG2 THR 623 2HG2 THR 623 -8.427 -3.804 -6.994 869 2HG2 THR 623 3HG2 THR 623 -7.795 -3.924 -5.335 870 3HG2 THR 623 1HG2 THR 623 -9.166 -2.846 -5.688 871 H SER 624 H SER 624 -5.466 -1.160 -8.987 872 HA SER 624 HA SER 624 -4.366 1.105 -7.921 873 1HB SER 624 1HB SER 624 -4.072 -0.220 -10.641 874 2HB SER 624 2HB SER 624 -3.122 1.187 -10.204 875 HG SER 624 HG SER 624 -2.255 0.009 -8.396 876 H ILE 625 H ILE 625 -6.578 0.676 -10.745 877 HA ILE 625 HA ILE 625 -6.503 3.410 -11.485 878 HB ILE 625 HB ILE 625 -7.927 0.954 -12.285 879 1HG1 ILE 625 1HG1 ILE 625 -7.444 2.634 -14.473 880 2HG1 ILE 625 2HG1 ILE 625 -6.097 2.930 -13.392 881 1HG2 ILE 625 2HG2 ILE 625 -9.215 3.657 -12.399 882 2HG2 ILE 625 3HG2 ILE 625 -9.444 2.517 -13.746 883 3HG2 ILE 625 1HG2 ILE 625 -9.934 2.058 -12.098 884 1HD1 ILE 625 1HD1 ILE 625 -6.777 0.064 -13.570 885 2HD1 ILE 625 2HD1 ILE 625 -6.330 0.771 -15.141 886 3HD1 ILE 625 3HD1 ILE 625 -5.203 0.870 -13.767 887 H HIS 626 H HIS 626 -8.542 1.393 -9.334 888 HA HIS 626 HA HIS 626 -10.574 3.241 -8.959 889 1HB HIS 626 1HB HIS 626 -10.526 0.801 -8.311 890 2HB HIS 626 2HB HIS 626 -9.541 1.244 -6.931 891 HD1 HIS 626 1HD HIS 626 -11.582 0.271 -5.476 892 HD2 HIS 626 2HD HIS 626 -12.377 3.781 -7.631 893 HE1 HIS 626 1HE HIS 626 -13.718 1.252 -4.483 894 H SER 627 H SER 627 -7.488 2.704 -7.137 895 HA SER 627 HA SER 627 -8.032 4.853 -5.392 896 1HB SER 627 1HB SER 627 -5.850 2.888 -5.845 897 2HB SER 627 2HB SER 627 -5.301 4.429 -5.218 898 HG SER 627 HG SER 627 -5.871 2.903 -3.522 899 H LEU 628 H LEU 628 -6.265 4.386 -8.469 900 HA LEU 628 HA LEU 628 -4.794 6.742 -8.458 901 1HB LEU 628 1HB LEU 628 -5.712 4.758 -10.449 902 2HB LEU 628 2HB LEU 628 -5.290 6.335 -11.086 903 HG LEU 628 HG LEU 628 -3.368 4.988 -9.224 904 1HD1 LEU 628 3HD1 LEU 628 -4.319 3.754 -11.624 905 2HD1 LEU 628 1HD1 LEU 628 -2.634 4.272 -11.869 906 3HD1 LEU 628 2HD1 LEU 628 -3.047 3.208 -10.504 907 1HD2 LEU 628 1HD2 LEU 628 -3.087 7.340 -10.116 908 2HD2 LEU 628 2HD2 LEU 628 -1.722 6.230 -10.386 909 3HD2 LEU 628 3HD2 LEU 628 -2.838 6.609 -11.720 910 H LEU 629 H LEU 629 -8.135 6.035 -9.660 911 HA LEU 629 HA LEU 629 -8.575 8.663 -10.572 912 1HB LEU 629 1HB LEU 629 -10.045 6.160 -10.305 913 2HB LEU 629 2HB LEU 629 -11.053 7.559 -9.993 914 HG LEU 629 HG LEU 629 -9.495 8.069 -12.350 915 1HD1 LEU 629 3HD1 LEU 629 -10.926 5.402 -12.323 916 2HD1 LEU 629 1HD1 LEU 629 -10.462 6.275 -13.803 917 3HD1 LEU 629 2HD1 LEU 629 -9.209 5.718 -12.668 918 1HD2 LEU 629 1HD2 LEU 629 -11.793 8.937 -11.534 919 2HD2 LEU 629 2HD2 LEU 629 -11.540 8.668 -13.275 920 3HD2 LEU 629 3HD2 LEU 629 -12.444 7.475 -12.313 921 H ASP 630 H ASP 630 -8.961 7.005 -7.430 922 HA ASP 630 HA ASP 630 -10.559 8.925 -6.248 923 1HB ASP 630 1HB ASP 630 -9.046 6.579 -5.470 924 2HB ASP 630 2HB ASP 630 -8.733 7.845 -4.299 925 HD2 ASP 630 HD ASP 630 -11.675 5.551 -4.076 926 H GLU 631 H GLU 631 -7.050 8.657 -6.864 927 HA GLU 631 HA GLU 631 -6.374 10.760 -5.080 928 1HB GLU 631 1HB GLU 631 -4.914 9.049 -7.083 929 2HB GLU 631 2HB GLU 631 -4.153 10.544 -6.576 930 1HG GLU 631 1HG GLU 631 -5.024 8.223 -4.803 931 2HG GLU 631 2HG GLU 631 -3.390 8.791 -5.080 932 HE2 GLU 631 HE GLU 631 -3.476 11.298 -2.859 933 H GLY 632 H GLY 632 -6.946 10.373 -8.610 934 1HA GLY 632 2HA GLY 632 -7.037 11.881 -10.288 935 2HA GLY 632 1HA GLY 632 -6.129 13.013 -9.307 936 H LYS 633 H LYS 633 -9.259 11.420 -8.465 937 HA LYS 633 HA LYS 633 -10.976 13.408 -9.249 938 1HB LYS 633 1HB LYS 633 -11.378 11.030 -8.257 939 2HB LYS 633 2HB LYS 633 -11.401 11.848 -6.708 940 1HG LYS 633 1HG LYS 633 -13.688 11.742 -7.530 941 2HG LYS 633 2HG LYS 633 -13.170 13.415 -7.595 942 1HD LYS 633 1HD LYS 633 -12.385 12.385 -10.095 943 2HD LYS 633 2HD LYS 633 -13.927 11.606 -9.796 944 1HE LYS 633 1HE LYS 633 -14.362 14.278 -9.004 945 2HE LYS 633 2HE LYS 633 -13.356 14.425 -10.431 946 H GLN 634 H GLN 634 -8.853 13.206 -6.378 947 HA GLN 634 HA GLN 634 -10.043 15.387 -5.077 948 1HB GLN 634 1HB GLN 634 -7.322 14.048 -4.802 949 2HB GLN 634 2HB GLN 634 -7.834 15.361 -3.762 950 1HG GLN 634 1HG GLN 634 -9.994 13.462 -3.852 951 2HG GLN 634 2HG GLN 634 -8.519 12.554 -3.588 952 1HE2 GLN 634 1HE2 GLN 634 -9.887 12.250 -1.557 953 2HE2 GLN 634 2HE2 GLN 634 -9.555 13.305 -0.223 954 H SER 635 H SER 635 -7.726 15.046 -7.703 955 HA SER 635 HA SER 635 -6.713 17.698 -7.354 956 1HB SER 635 1HB SER 635 -6.001 15.317 -8.868 957 2HB SER 635 2HB SER 635 -6.041 16.703 -9.940 958 HG SER 635 HG SER 635 -4.746 17.029 -7.420 959 H LEU 636 H LEU 636 -9.180 15.956 -9.240 960 HA LEU 636 HA LEU 636 -9.610 17.660 -11.323 961 1HB LEU 636 1HB LEU 636 -11.056 15.598 -9.902 962 2HB LEU 636 2HB LEU 636 -12.147 16.858 -10.443 963 HG LEU 636 HG LEU 636 -11.837 14.909 -12.010 964 1HD1 LEU 636 3HD1 LEU 636 -11.249 17.712 -12.992 965 2HD1 LEU 636 1HD1 LEU 636 -11.673 16.346 -14.053 966 3HD1 LEU 636 2HD1 LEU 636 -12.836 16.920 -12.833 967 1HD2 LEU 636 2HD2 LEU 636 -9.251 14.982 -11.546 968 2HD2 LEU 636 3HD2 LEU 636 -9.883 14.475 -13.131 969 3HD2 LEU 636 1HD2 LEU 636 -9.253 16.125 -12.910 970 H THR 637 H THR 637 -11.002 17.876 -7.979 971 HA THR 637 HA THR 637 -12.329 20.324 -8.514 972 HB THR 637 HB THR 637 -13.252 19.103 -6.728 973 HG1 THR 637 1HG THR 637 -11.153 20.614 -5.365 974 1HG2 THR 637 2HG2 THR 637 -10.366 18.417 -6.124 975 2HG2 THR 637 3HG2 THR 637 -11.538 18.411 -4.784 976 3HG2 THR 637 1HG2 THR 637 -11.784 17.343 -6.186 977 H LYS 638 H LYS 638 -9.014 19.480 -7.773 978 HA LYS 638 HA LYS 638 -8.395 22.105 -6.773 979 1HB LYS 638 1HB LYS 638 -6.603 19.775 -7.521 980 2HB LYS 638 2HB LYS 638 -6.084 21.241 -6.715 981 1HG LYS 638 1HG LYS 638 -8.410 20.035 -5.372 982 2HG LYS 638 2HG LYS 638 -7.072 18.908 -5.478 983 1HD LYS 638 1HD LYS 638 -6.165 21.606 -4.718 984 2HD LYS 638 2HD LYS 638 -7.363 20.986 -3.599 985 1HE LYS 638 1HE LYS 638 -5.924 18.770 -3.662 986 2HE LYS 638 2HE LYS 638 -4.664 19.796 -4.318 987 H LEU 639 H LEU 639 -8.288 20.292 -9.846 988 HA LEU 639 HA LEU 639 -6.850 22.453 -11.128 989 1HB LEU 639 1HB LEU 639 -7.852 19.759 -12.027 990 2HB LEU 639 2HB LEU 639 -7.204 20.938 -13.151 991 HG LEU 639 HG LEU 639 -5.329 19.707 -12.764 992 1HD1 LEU 639 2HD1 LEU 639 -5.007 22.108 -11.990 993 2HD1 LEU 639 3HD1 LEU 639 -5.064 21.473 -10.328 994 3HD1 LEU 639 1HD1 LEU 639 -3.796 20.921 -11.449 995 1HD2 LEU 639 3HD2 LEU 639 -6.686 18.356 -10.967 996 2HD2 LEU 639 1HD2 LEU 639 -4.908 18.285 -11.010 997 3HD2 LEU 639 2HD2 LEU 639 -5.729 19.324 -9.820 998 H ALA 640 H ALA 640 -10.083 21.613 -10.303 999 HA ALA 640 HA ALA 640 -11.605 22.333 -12.417 1000 1HB ALA 640 3HB ALA 640 -12.222 21.615 -10.004 1001 2HB ALA 640 1HB ALA 640 -12.174 23.353 -9.622 1002 3HB ALA 640 2HB ALA 640 -13.318 22.741 -10.842 1003 H ALA 641 H ALA 641 -9.619 24.431 -10.313 1004 HA ALA 641 HA ALA 641 -10.722 26.869 -11.172 1005 1HB ALA 641 3HB ALA 641 -8.583 25.892 -9.477 1006 2HB ALA 641 2HB ALA 641 -9.429 27.458 -9.432 1007 3HB ALA 641 1HB ALA 641 -8.002 27.247 -10.475 1008 H ALA 642 H ALA 642 -8.352 24.604 -12.540 1009 HA ALA 642 HA ALA 642 -7.110 26.371 -14.315 1010 1HB ALA 642 3HB ALA 642 -6.766 23.782 -13.556 1011 2HB ALA 642 2HB ALA 642 -6.022 24.489 -15.010 1012 3HB ALA 642 1HB ALA 642 -7.523 23.544 -15.149 1013 H TRP 643 H TRP 643 -10.326 25.017 -14.203 1014 HA TRP 643 HA TRP 643 -10.739 25.436 -17.050 1015 1HB TRP 643 1HB TRP 643 -12.349 24.210 -14.830 1016 2HB TRP 643 2HB TRP 643 -13.114 24.683 -16.334 1017 HD1 TRP 643 HD TRP 643 -12.600 23.146 -18.494 1018 HE1 TRP 643 1HE TRP 643 -11.491 20.787 -18.903 1019 HE3 TRP 643 3HE TRP 643 -10.449 22.775 -13.901 1020 HZ2 TRP 643 2HZ TRP 643 -9.874 19.069 -17.297 1021 HZ3 TRP 643 3HZ TRP 643 -9.121 20.725 -13.403 1022 HH2 TRP 643 HH TRP 643 -8.818 18.911 -15.012 1023 H GLY 644 H GLY 644 -10.767 27.157 -14.079 1024 1HA GLY 644 2HA GLY 644 -12.637 29.162 -15.196 1025 2HA GLY 644 1HA GLY 644 -11.107 29.578 -14.449 1026 H GLY 645 H GLY 645 -11.928 26.960 -12.664 1027 1HA GLY 645 2HA GLY 645 -13.580 28.536 -10.780 1028 2HA GLY 645 1HA GLY 645 -12.236 27.528 -10.283 1029 H SER 646 H SER 646 -13.616 26.216 -8.935 1030 HA SER 646 HA SER 646 -14.710 24.038 -10.351 1031 1HB SER 646 1HB SER 646 -13.548 24.067 -8.028 1032 2HB SER 646 2HB SER 646 -15.086 24.613 -7.390 1033 HG SER 646 HG SER 646 -16.051 22.678 -7.897 1034 H GLY 647 H GLY 647 -17.008 23.187 -9.816 1035 1HA GLY 647 2HA GLY 647 -19.008 24.995 -8.939 1036 2HA GLY 647 1HA GLY 647 -19.243 23.456 -9.745 1037 H SER 648 H SER 648 -17.119 25.076 -11.738 1038 HA SER 648 HA SER 648 -19.042 26.783 -12.987 1039 1HB SER 648 1HB SER 648 -17.241 27.503 -14.385 1040 2HB SER 648 2HB SER 648 -16.540 27.267 -12.796 1041 HG SER 648 HG SER 648 -16.520 25.053 -14.599 1042 H GLU 649 H GLU 649 -19.863 26.499 -15.174 1043 HA GLU 649 HA GLU 649 -20.761 24.016 -15.748 1044 1HB GLU 649 1HB GLU 649 -21.763 25.954 -16.774 1045 2HB GLU 649 2HB GLU 649 -20.261 26.413 -17.552 1046 1HG GLU 649 1HG GLU 649 -21.539 25.386 -19.284 1047 2HG GLU 649 2HG GLU 649 -20.375 24.163 -18.815 1048 HE2 GLU 649 HE GLU 649 -24.076 23.150 -18.707 1049 H ALA 650 H ALA 650 -17.863 25.686 -17.158 1050 HA ALA 650 HA ALA 650 -17.094 23.747 -18.933 1051 1HB ALA 650 1HB ALA 650 -15.729 25.887 -17.337 1052 2HB ALA 650 2HB ALA 650 -14.708 24.695 -18.176 1053 3HB ALA 650 3HB ALA 650 -15.860 25.688 -19.100 1054 H TYR 651 H TYR 651 -15.537 24.175 -15.676 1055 HA TYR 651 HA TYR 651 -14.268 21.768 -15.591 1056 1HB TYR 651 1HB TYR 651 -13.880 23.433 -13.880 1057 2HB TYR 651 2HB TYR 651 -15.594 23.666 -13.602 1058 HD1 TYR 651 1HD TYR 651 -16.452 22.859 -11.607 1059 HD2 TYR 651 2HD TYR 651 -13.066 20.896 -13.334 1060 HE1 TYR 651 1HE TYR 651 -16.336 21.289 -9.612 1061 HE2 TYR 651 2HE TYR 651 -12.961 19.332 -11.332 1062 HH TYR 651 HH TYR 651 -13.718 18.918 -9.334 1063 H GLN 652 H GLN 652 -17.699 22.505 -14.810 1064 HA GLN 652 HA GLN 652 -18.312 20.163 -13.540 1065 1HB GLN 652 1HB GLN 652 -19.922 22.081 -15.247 1066 2HB GLN 652 2HB GLN 652 -20.677 20.643 -14.589 1067 1HG GLN 652 1HG GLN 652 -19.130 21.927 -12.495 1068 2HG GLN 652 2HG GLN 652 -20.157 23.127 -13.253 1069 1HE2 GLN 652 1HE2 GLN 652 -20.038 21.218 -10.728 1070 2HE2 GLN 652 2HE2 GLN 652 -21.691 20.752 -10.508 1071 H GLY 653 H GLY 653 -18.554 20.960 -17.077 1072 1HA GLY 653 2HA GLY 653 -18.581 19.644 -18.897 1073 2HA GLY 653 1HA GLY 653 -19.499 18.492 -17.948 1074 H VAL 654 H VAL 654 -16.301 19.480 -16.802 1075 HA VAL 654 HA VAL 654 -14.954 17.303 -18.106 1076 HB VAL 654 HB VAL 654 -14.172 19.409 -16.095 1077 1HG1 VAL 654 2HG1 VAL 654 -12.953 17.264 -15.654 1078 2HG1 VAL 654 3HG1 VAL 654 -12.316 17.341 -17.315 1079 3HG1 VAL 654 1HG1 VAL 654 -11.901 18.614 -16.143 1080 1HG2 VAL 654 2HG2 VAL 654 -14.390 19.426 -18.889 1081 2HG2 VAL 654 3HG2 VAL 654 -13.566 20.628 -17.867 1082 3HG2 VAL 654 1HG2 VAL 654 -12.647 19.273 -18.565 1083 H GLN 655 H GLN 655 -16.068 18.157 -14.771 1084 HA GLN 655 HA GLN 655 -15.034 16.033 -13.450 1085 1HB GLN 655 1HB GLN 655 -17.215 17.953 -13.052 1086 2HB GLN 655 2HB GLN 655 -17.586 16.409 -12.311 1087 1HG GLN 655 1HG GLN 655 -14.790 17.230 -11.835 1088 2HG GLN 655 2HG GLN 655 -15.938 18.409 -11.231 1089 1HE2 GLN 655 1HE2 GLN 655 -14.343 17.069 -9.509 1090 2HE2 GLN 655 2HE2 GLN 655 -15.245 15.944 -8.549 1091 H GLN 656 H GLN 656 -18.123 16.218 -15.320 1092 HA GLN 656 HA GLN 656 -18.928 13.629 -14.660 1093 1HB GLN 656 1HB GLN 656 -19.791 15.798 -16.461 1094 2HB GLN 656 2HB GLN 656 -20.104 14.211 -17.134 1095 1HG GLN 656 1HG GLN 656 -21.954 14.127 -15.821 1096 2HG GLN 656 2HG GLN 656 -20.881 13.931 -14.450 1097 1HE2 GLN 656 1HE2 GLN 656 -21.417 16.705 -16.604 1098 2HE2 GLN 656 2HE2 GLN 656 -21.935 17.832 -15.394 1099 H LYS 657 H LYS 657 -16.973 15.020 -17.338 1100 HA LYS 657 HA LYS 657 -16.889 12.697 -18.900 1101 1HB LYS 657 1HB LYS 657 -15.090 15.121 -18.698 1102 2HB LYS 657 2HB LYS 657 -14.812 13.834 -19.853 1103 1HG LYS 657 1HG LYS 657 -16.907 14.223 -20.967 1104 2HG LYS 657 2HG LYS 657 -17.529 15.186 -19.641 1105 1HD LYS 657 1HD LYS 657 -15.931 16.988 -20.116 1106 2HD LYS 657 2HD LYS 657 -15.113 16.008 -21.317 1107 1HE LYS 657 1HE LYS 657 -16.836 16.237 -22.892 1108 2HE LYS 657 2HE LYS 657 -18.073 16.465 -21.672 1109 H TRP 658 H TRP 658 -15.209 13.707 -15.956 1110 HA TRP 658 HA TRP 658 -13.094 11.815 -16.219 1111 1HB TRP 658 1HB TRP 658 -12.756 13.816 -14.943 1112 2HB TRP 658 2HB TRP 658 -14.121 13.458 -13.903 1113 HD1 TRP 658 HD TRP 658 -13.613 11.957 -11.775 1114 HE1 TRP 658 1HE TRP 658 -11.520 10.748 -10.718 1115 HE3 TRP 658 3HE TRP 658 -10.565 12.575 -15.798 1116 HZ2 TRP 658 2HZ TRP 658 -8.883 10.198 -11.661 1117 HZ3 TRP 658 3HZ TRP 658 -8.246 11.672 -15.648 1118 HH2 TRP 658 HH TRP 658 -7.392 10.518 -13.670 1119 H ASP 659 H ASP 659 -16.073 12.065 -14.136 1120 HA ASP 659 HA ASP 659 -15.817 9.544 -13.061 1121 1HB ASP 659 1HB ASP 659 -17.360 11.467 -12.341 1122 2HB ASP 659 2HB ASP 659 -18.433 11.003 -13.647 1123 HD2 ASP 659 HD ASP 659 -17.857 9.099 -10.283 1124 H ALA 660 H ALA 660 -17.109 10.758 -16.147 1125 HA ALA 660 HA ALA 660 -18.784 8.700 -16.885 1126 1HB ALA 660 2HB ALA 660 -18.817 10.561 -18.280 1127 2HB ALA 660 3HB ALA 660 -17.043 10.688 -18.331 1128 3HB ALA 660 1HB ALA 660 -17.871 9.415 -19.260 1129 H THR 661 H THR 661 -15.727 8.958 -18.709 1130 HA THR 661 HA THR 661 -15.500 6.262 -19.189 1131 HB THR 661 HB THR 661 -13.233 6.862 -19.934 1132 HG1 THR 661 1HG THR 661 -13.790 9.305 -18.408 1133 1HG2 THR 661 3HG2 THR 661 -15.395 8.122 -20.954 1134 2HG2 THR 661 1HG2 THR 661 -14.608 9.536 -20.211 1135 3HG2 THR 661 2HG2 THR 661 -13.746 8.582 -21.441 1136 H ALA 662 H ALA 662 -14.787 8.030 -16.244 1137 HA ALA 662 HA ALA 662 -12.878 6.406 -15.109 1138 1HB ALA 662 3HB ALA 662 -13.338 8.319 -13.891 1139 2HB ALA 662 2HB ALA 662 -14.258 7.125 -12.944 1140 3HB ALA 662 1HB ALA 662 -15.098 8.170 -14.115 1141 H THR 663 H THR 663 -16.282 6.231 -13.931 1142 HA THR 663 HA THR 663 -16.117 3.674 -12.966 1143 HB THR 663 HB THR 663 -17.993 4.972 -12.316 1144 HG1 THR 663 1HG THR 663 -19.662 3.564 -13.028 1145 1HG2 THR 663 3HG2 THR 663 -17.878 5.926 -15.075 1146 2HG2 THR 663 1HG2 THR 663 -19.525 5.370 -14.693 1147 3HG2 THR 663 2HG2 THR 663 -18.757 6.627 -13.695 1148 H GLU 664 H GLU 664 -16.271 4.713 -16.307 1149 HA GLU 664 HA GLU 664 -17.357 2.345 -17.320 1150 1HB GLU 664 1HB GLU 664 -17.242 4.540 -18.539 1151 2HB GLU 664 2HB GLU 664 -15.507 4.347 -18.690 1152 1HG GLU 664 1HG GLU 664 -16.619 3.591 -20.756 1153 2HG GLU 664 2HG GLU 664 -15.834 2.236 -19.970 1154 HE2 GLU 664 HE GLU 664 -19.418 2.470 -21.016 1155 H LEU 665 H LEU 665 -13.954 3.534 -16.920 1156 HA LEU 665 HA LEU 665 -12.893 1.047 -17.876 1157 1HB LEU 665 1HB LEU 665 -11.903 3.371 -18.162 1158 2HB LEU 665 2HB LEU 665 -11.425 3.277 -16.478 1159 HG LEU 665 HG LEU 665 -9.579 2.711 -17.969 1160 1HD1 LEU 665 2HD1 LEU 665 -10.170 1.477 -15.678 1161 2HD1 LEU 665 3HD1 LEU 665 -10.203 0.063 -16.758 1162 3HD1 LEU 665 1HD1 LEU 665 -8.736 1.065 -16.649 1163 1HD2 LEU 665 2HD2 LEU 665 -11.152 1.747 -19.756 1164 2HD2 LEU 665 3HD2 LEU 665 -9.572 0.962 -19.518 1165 3HD2 LEU 665 1HD2 LEU 665 -11.044 0.225 -18.840 1166 H ASN 666 H ASN 666 -13.949 2.433 -14.825 1167 HA ASN 666 HA ASN 666 -12.367 0.771 -13.204 1168 1HB ASN 666 1HB ASN 666 -13.952 2.979 -12.764 1169 2HB ASN 666 2HB ASN 666 -15.028 1.723 -12.186 1170 1HD2 ASN 666 1HD2 ASN 666 -13.395 3.892 -10.884 1171 2HD2 ASN 666 2HD2 ASN 666 -12.516 3.117 -9.609 1172 H ASN 667 H ASN 667 -15.923 0.834 -14.039 1173 HA ASN 667 HA ASN 667 -16.579 -1.517 -12.817 1174 1HB ASN 667 1HB ASN 667 -18.647 -1.297 -13.925 1175 2HB ASN 667 2HB ASN 667 -18.033 0.340 -14.054 1176 1HD2 ASN 667 1HD2 ASN 667 -18.121 1.227 -15.962 1177 2HD2 ASN 667 2HD2 ASN 667 -18.117 0.428 -17.499 1178 H ALA 668 H ALA 668 -15.385 -0.802 -16.157 1179 HA ALA 668 HA ALA 668 -15.708 -3.342 -17.239 1180 1HB ALA 668 1HB ALA 668 -15.214 -1.204 -18.461 1181 2HB ALA 668 3HB ALA 668 -14.166 -2.559 -18.943 1182 3HB ALA 668 2HB ALA 668 -13.543 -1.294 -17.856 1183 H LEU 669 H LEU 669 -12.955 -1.840 -15.434 1184 HA LEU 669 HA LEU 669 -11.212 -3.989 -15.694 1185 1HB LEU 669 1HB LEU 669 -11.427 -1.528 -14.157 1186 2HB LEU 669 2HB LEU 669 -10.666 -2.810 -13.236 1187 HG LEU 669 HG LEU 669 -9.729 -2.214 -16.032 1188 1HD1 LEU 669 1HD1 LEU 669 -9.873 -0.096 -14.556 1189 2HD1 LEU 669 2HD1 LEU 669 -8.517 -0.818 -13.657 1190 3HD1 LEU 669 3HD1 LEU 669 -8.344 -0.460 -15.392 1191 1HD2 LEU 669 1HD2 LEU 669 -9.040 -4.190 -14.349 1192 2HD2 LEU 669 2HD2 LEU 669 -7.914 -3.465 -15.522 1193 3HD2 LEU 669 3HD2 LEU 669 -7.886 -2.942 -13.821 1194 H GLN 670 H GLN 670 -13.905 -3.342 -13.420 1195 HA GLN 670 HA GLN 670 -13.280 -5.389 -11.653 1196 1HB GLN 670 1HB GLN 670 -15.604 -3.632 -12.228 1197 2HB GLN 670 2HB GLN 670 -16.032 -5.163 -11.490 1198 1HG GLN 670 1HG GLN 670 -14.052 -3.106 -10.409 1199 2HG GLN 670 2HG GLN 670 -15.611 -3.520 -9.724 1200 1HE2 GLN 670 1HE2 GLN 670 -15.919 -5.467 -8.663 1201 2HE2 GLN 670 2HE2 GLN 670 -14.613 -6.450 -8.089 1202 H ASN 671 H ASN 671 -15.586 -5.270 -14.460 1203 HA ASN 671 HA ASN 671 -16.289 -7.963 -14.192 1204 1HB ASN 671 1HB ASN 671 -17.435 -5.949 -15.504 1205 2HB ASN 671 2HB ASN 671 -16.407 -6.455 -16.830 1206 1HD2 ASN 671 1HD2 ASN 671 -16.996 -8.089 -18.071 1207 2HD2 ASN 671 2HD2 ASN 671 -18.317 -9.173 -17.789 1208 H LEU 672 H LEU 672 -13.627 -6.184 -15.685 1209 HA LEU 672 HA LEU 672 -12.902 -8.247 -17.526 1210 1HB LEU 672 1HB LEU 672 -12.382 -6.043 -18.146 1211 2HB LEU 672 2HB LEU 672 -11.654 -5.675 -16.595 1212 HG LEU 672 HG LEU 672 -10.061 -5.943 -18.524 1213 1HD1 LEU 672 1HD1 LEU 672 -9.577 -6.259 -15.990 1214 2HD1 LEU 672 2HD1 LEU 672 -9.409 -7.980 -16.413 1215 3HD1 LEU 672 3HD1 LEU 672 -8.361 -6.767 -17.187 1216 1HD2 LEU 672 2HD2 LEU 672 -11.355 -7.963 -19.438 1217 2HD2 LEU 672 3HD2 LEU 672 -9.577 -8.019 -19.484 1218 3HD2 LEU 672 1HD2 LEU 672 -10.464 -8.916 -18.228 1219 H ALA 673 H ALA 673 -11.874 -7.150 -14.249 1220 HA ALA 673 HA ALA 673 -9.864 -9.209 -14.125 1221 1HB ALA 673 3HB ALA 673 -10.093 -6.747 -13.012 1222 2HB ALA 673 1HB ALA 673 -10.743 -7.738 -11.685 1223 3HB ALA 673 2HB ALA 673 -9.104 -8.048 -12.306 1224 H ARG 674 H ARG 674 -13.274 -8.909 -13.602 1225 HA ARG 674 HA ARG 674 -13.466 -10.746 -11.495 1226 1HB ARG 674 1HB ARG 674 -15.363 -9.470 -13.463 1227 2HB ARG 674 2HB ARG 674 -15.930 -10.899 -12.621 1228 1HG ARG 674 1HG ARG 674 -14.586 -8.876 -10.886 1229 2HG ARG 674 2HG ARG 674 -16.085 -8.337 -11.614 1230 1HD ARG 674 1HD ARG 674 -17.289 -9.569 -10.135 1231 2HD ARG 674 2HD ARG 674 -16.485 -11.036 -10.656 1232 HE ARG 674 HE ARG 674 -14.962 -10.851 -8.850 1233 2HH1 ARG 674 1HH ARG 674 -14.956 -8.622 -6.186 1234 1HH2 ARG 674 2HH2 ARG 674 -16.994 -7.955 -9.052 1235 2HH2 ARG 674 1HH2 ARG 674 -16.520 -7.363 -7.495 1236 H THR 675 H THR 675 -13.096 -10.977 -14.996 1237 HA THR 675 HA THR 675 -13.720 -13.850 -14.887 1238 HB THR 675 HB THR 675 -13.432 -12.034 -17.331 1239 HG1 THR 675 1HG THR 675 -15.147 -11.288 -15.916 1240 1HG2 THR 675 1HG2 THR 675 -13.484 -14.659 -17.499 1241 2HG2 THR 675 2HG2 THR 675 -15.178 -14.504 -16.975 1242 3HG2 THR 675 3HG2 THR 675 -14.642 -13.739 -18.490 1243 H ILE 676 H ILE 676 -11.150 -11.635 -14.754 1244 HA ILE 676 HA ILE 676 -9.335 -13.478 -16.107 1245 HB ILE 676 HB ILE 676 -9.170 -10.613 -15.233 1246 1HG1 ILE 676 1HG1 ILE 676 -8.877 -12.083 -17.860 1247 2HG1 ILE 676 2HG1 ILE 676 -10.115 -10.930 -17.403 1248 1HG2 ILE 676 3HG2 ILE 676 -6.999 -12.527 -15.207 1249 2HG2 ILE 676 1HG2 ILE 676 -6.715 -11.253 -16.417 1250 3HG2 ILE 676 2HG2 ILE 676 -7.019 -10.816 -14.718 1251 1HD1 ILE 676 3HD1 ILE 676 -8.046 -9.299 -17.020 1252 2HD1 ILE 676 1HD1 ILE 676 -7.225 -10.433 -18.119 1253 3HD1 ILE 676 2HD1 ILE 676 -8.686 -9.570 -18.658 1254 H SER 677 H SER 677 -9.784 -11.753 -12.948 1255 HA SER 677 HA SER 677 -7.727 -12.693 -11.568 1256 1HB SER 677 1HB SER 677 -9.349 -11.224 -10.543 1257 2HB SER 677 2HB SER 677 -10.630 -12.410 -10.701 1258 HG SER 677 HG SER 677 -8.270 -13.006 -9.164 1259 H GLU 678 H GLU 678 -10.488 -14.556 -12.778 1260 HA GLU 678 HA GLU 678 -10.133 -16.761 -11.084 1261 1HB GLU 678 1HB GLU 678 -11.606 -17.933 -12.733 1262 2HB GLU 678 2HB GLU 678 -12.257 -16.389 -12.220 1263 1HG GLU 678 1HG GLU 678 -10.866 -15.517 -14.370 1264 2HG GLU 678 2HG GLU 678 -11.100 -17.175 -14.887 1265 HE2 GLU 678 HE GLU 678 -14.140 -16.058 -16.105 1266 H ALA 679 H ALA 679 -8.879 -15.840 -14.328 1267 HA ALA 679 HA ALA 679 -7.835 -18.125 -15.261 1268 1HB ALA 679 1HB ALA 679 -5.886 -15.923 -15.344 1269 2HB ALA 679 2HB ALA 679 -6.767 -16.718 -16.671 1270 3HB ALA 679 3HB ALA 679 -7.541 -15.407 -15.748 1271 H GLY 680 H GLY 680 -6.756 -16.280 -12.407 1272 1HA GLY 680 2HA GLY 680 -5.476 -16.970 -10.672 1273 2HA GLY 680 1HA GLY 680 -4.254 -17.143 -11.915 1274 H GLN 681 H GLN 681 -6.832 -18.854 -10.095 1275 HA GLN 681 HA GLN 681 -5.514 -21.342 -10.866 1276 1HB GLN 681 1HB GLN 681 -6.166 -20.221 -8.202 1277 2HB GLN 681 2HB GLN 681 -6.684 -21.882 -8.407 1278 1HG GLN 681 1HG GLN 681 -4.453 -22.631 -8.922 1279 2HG GLN 681 2HG GLN 681 -3.878 -20.997 -9.186 1280 1HE2 GLN 681 1HE2 GLN 681 -3.106 -23.229 -7.332 1281 2HE2 GLN 681 2HE2 GLN 681 -3.051 -22.532 -5.747 1282 H ALA 682 H ALA 682 -8.545 -19.618 -10.046 1283 HA ALA 682 HA ALA 682 -10.387 -21.572 -9.994 1284 1HB ALA 682 2HB ALA 682 -10.422 -18.854 -11.348 1285 2HB ALA 682 3HB ALA 682 -11.877 -19.867 -11.187 1286 3HB ALA 682 1HB ALA 682 -11.031 -19.288 -9.732 1287 H MET 683 H MET 683 -9.637 -19.854 -13.108 1288 HA MET 683 HA MET 683 -10.856 -21.586 -14.752 1289 1HB MET 683 1HB MET 683 -9.718 -19.404 -15.364 1290 2HB MET 683 2HB MET 683 -8.160 -20.194 -15.226 1291 1HG MET 683 1HG MET 683 -8.597 -20.314 -17.548 1292 2HG MET 683 2HG MET 683 -9.083 -21.901 -16.986 1293 1HE MET 683 1HE MET 683 -10.881 -22.914 -17.272 1294 2HE MET 683 2HE MET 683 -12.234 -22.196 -16.365 1295 3HE MET 683 3HE MET 683 -12.352 -22.398 -18.130 1296 H ALA 684 H ALA 684 -7.979 -22.174 -12.860 1297 HA ALA 684 HA ALA 684 -7.289 -24.490 -14.508 1298 1HB ALA 684 2HB ALA 684 -5.865 -22.944 -12.317 1299 2HB ALA 684 3HB ALA 684 -5.272 -24.506 -12.930 1300 3HB ALA 684 1HB ALA 684 -5.401 -23.110 -14.027 1301 H SER 685 H SER 685 -9.793 -24.455 -13.029 1302 HA SER 685 HA SER 685 -9.126 -26.337 -10.905 1303 1HB SER 685 1HB SER 685 -11.466 -24.443 -11.297 1304 2HB SER 685 2HB SER 685 -11.599 -25.814 -10.213 1305 HG SER 685 HG SER 685 -10.728 -24.466 -8.785 1306 H THR 686 H THR 686 -12.396 -25.942 -12.241 1307 HA THR 686 HA THR 686 -12.088 -28.282 -13.946 1308 HB THR 686 HB THR 686 -12.727 -28.789 -11.381 1309 HG1 THR 686 1HG THR 686 -13.998 -29.675 -13.869 1310 1HG2 THR 686 3HG2 THR 686 -14.754 -27.215 -11.487 1311 2HG2 THR 686 1HG2 THR 686 -15.441 -28.311 -12.711 1312 3HG2 THR 686 2HG2 THR 686 -15.142 -28.898 -11.057 1313 H GLU 687 H GLU 687 -13.385 -28.249 -15.724 1314 HA GLU 687 HA GLU 687 -14.396 -25.921 -16.591 1315 1HB GLU 687 1HB GLU 687 -14.766 -28.784 -17.301 1316 2HB GLU 687 2HB GLU 687 -16.042 -27.729 -17.875 1317 1HG GLU 687 1HG GLU 687 -14.383 -26.258 -18.976 1318 2HG GLU 687 2HG GLU 687 -13.065 -27.213 -18.327 1319 HE2 GLU 687 HE GLU 687 -12.972 -29.189 -20.943 1320 H GLY 688 H GLY 688 -15.933 -24.595 -15.734 1321 1HA GLY 688 2HA GLY 688 -18.388 -25.866 -14.685 1322 2HA GLY 688 1HA GLY 688 -18.307 -24.295 -15.458 1323 H ASN 689 H ASN 689 -15.518 -24.060 -13.899 1324 HA ASN 689 HA ASN 689 -16.704 -23.496 -11.307 1325 1HB ASN 689 1HB ASN 689 -14.499 -23.695 -10.378 1326 2HB ASN 689 2HB ASN 689 -14.590 -24.983 -11.564 1327 1HD2 ASN 689 1HD2 ASN 689 -13.610 -24.716 -13.612 1328 2HD2 ASN 689 2HD2 ASN 689 -12.280 -23.632 -13.853 1329 H VAL 690 H VAL 690 -16.148 -22.015 -14.221 1330 HA VAL 690 HA VAL 690 -15.024 -19.559 -13.118 1331 HB VAL 690 HB VAL 690 -14.560 -20.899 -15.440 1332 1HG1 VAL 690 1HG1 VAL 690 -16.954 -20.139 -16.110 1333 2HG1 VAL 690 2HG1 VAL 690 -16.204 -18.544 -16.356 1334 3HG1 VAL 690 3HG1 VAL 690 -15.629 -19.950 -17.283 1335 1HG2 VAL 690 3HG2 VAL 690 -13.618 -18.652 -14.176 1336 2HG2 VAL 690 1HG2 VAL 690 -13.005 -19.294 -15.719 1337 3HG2 VAL 690 2HG2 VAL 690 -14.212 -17.986 -15.716 1338 H THR 691 H THR 691 -16.141 -17.483 -14.142 1339 HA THR 691 HA THR 691 -18.471 -17.000 -12.938 1340 HB THR 691 HB THR 691 -17.384 -16.029 -15.623 1341 HG1 THR 691 1HG THR 691 -16.183 -15.513 -13.687 1342 1HG2 THR 691 1HG2 THR 691 -19.751 -15.041 -13.962 1343 2HG2 THR 691 2HG2 THR 691 -18.841 -13.966 -15.051 1344 3HG2 THR 691 3HG2 THR 691 -19.713 -15.371 -15.710 1345 H GLY 692 H GLY 692 -18.150 -18.580 -16.162 1346 1HA GLY 692 2HA GLY 692 -19.572 -20.088 -17.101 1347 2HA GLY 692 1HA GLY 692 -20.637 -18.697 -17.103 1348 H MET 693 H MET 693 -19.402 -20.920 -14.496 1349 HA MET 693 HA MET 693 -22.190 -21.542 -13.935 1350 1HB MET 693 1HB MET 693 -19.695 -23.069 -14.042 1351 2HB MET 693 2HB MET 693 -20.391 -23.220 -12.441 1352 1HG MET 693 1HG MET 693 -21.389 -24.996 -13.682 1353 2HG MET 693 2HG MET 693 -22.635 -23.765 -13.622 1354 1HE MET 693 2HE MET 693 -23.969 -23.981 -15.165 1355 2HE MET 693 3HE MET 693 -23.758 -23.461 -16.854 1356 3HE MET 693 1HE MET 693 -23.605 -25.182 -16.427 1357 H PHE 694 H PHE 694 -19.093 -20.422 -12.505 1358 HA PHE 694 HA PHE 694 -19.413 -20.481 -9.902 1359 1HB PHE 694 1HB PHE 694 -18.307 -18.654 -11.916 1360 2HB PHE 694 2HB PHE 694 -18.890 -17.710 -10.559 1361 HD1 PHE 694 1HD PHE 694 -18.299 -19.814 -8.407 1362 HD2 PHE 694 2HD PHE 694 -15.986 -18.278 -11.616 1363 HE1 PHE 694 1HE PHE 694 -16.196 -20.335 -7.141 1364 HE2 PHE 694 2HE PHE 694 -13.882 -18.800 -10.350 1365 HZ PHE 694 HZ PHE 694 -14.012 -19.822 -8.127 1366 H ALA 695 H ALA 695 -21.162 -20.261 -8.590 1367 HA ALA 695 HA ALA 695 -23.456 -18.848 -9.324 1368 1HB ALA 695 2HB ALA 695 -22.461 -20.450 -7.109 1369 2HB ALA 695 1HB ALA 695 -24.135 -20.204 -7.663 1370 3HB ALA 695 3HB ALA 695 -23.401 -19.061 -6.513 No H/Q in entry = 1370 Start of MODEL 27 1 H ALA 1 H ALA 1 -9.005 41.884 -9.667 2 HA ALA 1 HA ALA 1 -6.500 40.696 -8.822 3 1HB ALA 1 2HB ALA 1 -8.760 39.182 -10.108 4 2HB ALA 1 1HB ALA 1 -8.991 39.855 -8.476 5 3HB ALA 1 3HB ALA 1 -7.676 38.695 -8.783 6 H GLU 2 H GLU 2 -5.089 39.530 -10.224 7 HA GLU 2 HA GLU 2 -5.244 40.518 -12.934 8 1HB GLU 2 1HB GLU 2 -3.132 40.133 -11.104 9 2HB GLU 2 2HB GLU 2 -2.900 38.873 -12.300 10 1HG GLU 2 1HG GLU 2 -3.573 41.185 -13.802 11 2HG GLU 2 2HG GLU 2 -2.486 41.762 -12.554 12 HE2 GLU 2 HE GLU 2 0.221 40.705 -13.683 13 H MET 3 H MET 3 -4.317 37.367 -11.352 14 HA MET 3 HA MET 3 -5.089 35.997 -13.742 15 1HB MET 3 1HB MET 3 -4.008 35.113 -11.013 16 2HB MET 3 2HB MET 3 -4.374 33.968 -12.288 17 1HG MET 3 1HG MET 3 -2.443 36.314 -12.621 18 2HG MET 3 2HG MET 3 -1.937 34.690 -12.201 19 1HE MET 3 3HE MET 3 -0.457 35.509 -14.306 20 2HE MET 3 1HE MET 3 -0.606 33.735 -14.325 21 3HE MET 3 2HE MET 3 -0.795 34.661 -15.834 22 H LYS 4 H LYS 4 -6.491 33.931 -13.522 23 HA LYS 4 HA LYS 4 -8.895 34.711 -12.086 24 1HB LYS 4 1HB LYS 4 -10.036 33.142 -13.510 25 2HB LYS 4 2HB LYS 4 -9.013 34.166 -14.496 26 1HG LYS 4 1HG LYS 4 -7.215 32.260 -14.205 27 2HG LYS 4 2HG LYS 4 -8.571 31.268 -13.708 28 1HD LYS 4 1HD LYS 4 -9.499 32.561 -16.037 29 2HD LYS 4 2HD LYS 4 -7.826 32.190 -16.402 30 1HE LYS 4 1HE LYS 4 -8.355 30.010 -16.733 31 2HE LYS 4 2HE LYS 4 -8.947 29.883 -15.088 32 H THR 5 H THR 5 -6.547 31.981 -12.373 33 HA THR 5 HA THR 5 -7.602 31.004 -9.799 34 HB THR 5 HB THR 5 -7.017 28.734 -10.634 35 HG1 THR 5 1HG THR 5 -6.389 28.838 -13.043 36 1HG2 THR 5 2HG2 THR 5 -9.001 30.451 -11.917 37 2HG2 THR 5 3HG2 THR 5 -8.318 29.318 -13.108 38 3HG2 THR 5 1HG2 THR 5 -9.077 28.698 -11.623 39 H ASP 6 H ASP 6 -4.692 29.915 -11.558 40 HA ASP 6 HA ASP 6 -2.776 31.451 -10.630 41 1HB ASP 6 1HB ASP 6 -3.936 29.872 -8.381 42 2HB ASP 6 2HB ASP 6 -2.189 29.789 -8.496 43 HD2 ASP 6 HD ASP 6 -2.189 33.459 -8.162 44 H ALA 7 H ALA 7 -0.979 30.570 -11.687 45 HA ALA 7 HA ALA 7 -1.128 27.954 -12.748 46 1HB ALA 7 1HB ALA 7 0.731 30.285 -12.800 47 2HB ALA 7 2HB ALA 7 1.447 28.694 -13.153 48 3HB ALA 7 3HB ALA 7 0.094 29.299 -14.138 49 H ALA 8 H ALA 8 0.637 29.496 -10.008 50 HA ALA 8 HA ALA 8 2.232 27.292 -9.384 51 1HB ALA 8 1HB ALA 8 2.980 29.137 -8.271 52 2HB ALA 8 3HB ALA 8 1.885 28.555 -6.994 53 3HB ALA 8 2HB ALA 8 1.349 29.831 -8.113 54 H THR 9 H THR 9 -1.045 28.316 -8.232 55 HA THR 9 HA THR 9 -1.338 26.143 -6.449 56 HB THR 9 HB THR 9 -2.615 28.538 -6.940 57 HG1 THR 9 1HG THR 9 -4.061 27.604 -5.312 58 1HG2 THR 9 2HG2 THR 9 -4.405 26.260 -7.937 59 2HG2 THR 9 3HG2 THR 9 -4.998 27.868 -7.459 60 3HG2 THR 9 1HG2 THR 9 -3.922 27.699 -8.867 61 H LEU 10 H LEU 10 -2.105 26.610 -9.919 62 HA LEU 10 HA LEU 10 -3.558 24.185 -10.111 63 1HB LEU 10 1HB LEU 10 -2.352 26.107 -12.083 64 2HB LEU 10 2HB LEU 10 -3.069 24.597 -12.609 65 HG LEU 10 HG LEU 10 -4.482 26.809 -11.094 66 1HD1 LEU 10 3HD1 LEU 10 -4.550 25.948 -13.991 67 2HD1 LEU 10 1HD1 LEU 10 -5.806 26.964 -13.243 68 3HD1 LEU 10 2HD1 LEU 10 -4.124 27.540 -13.318 69 1HD2 LEU 10 2HD2 LEU 10 -5.399 24.071 -11.960 70 2HD2 LEU 10 3HD2 LEU 10 -5.534 24.851 -10.366 71 3HD2 LEU 10 1HD2 LEU 10 -6.542 25.414 -11.721 72 H ALA 11 H ALA 11 -0.145 25.176 -10.739 73 HA ALA 11 HA ALA 11 0.645 22.667 -11.740 74 1HB ALA 11 1HB ALA 11 2.321 24.802 -10.362 75 2HB ALA 11 2HB ALA 11 2.889 23.562 -11.505 76 3HB ALA 11 3HB ALA 11 1.818 24.866 -12.068 77 H GLN 12 H GLN 12 0.149 23.999 -8.493 78 HA GLN 12 HA GLN 12 1.751 22.172 -7.137 79 1HB GLN 12 1HB GLN 12 0.039 24.349 -6.498 80 2HB GLN 12 2HB GLN 12 -0.581 22.986 -5.588 81 1HG GLN 12 1HG GLN 12 1.181 23.031 -4.153 82 2HG GLN 12 2HG GLN 12 2.339 23.022 -5.469 83 1HE2 GLN 12 1HE2 GLN 12 3.723 24.580 -5.070 84 2HE2 GLN 12 2HE2 GLN 12 3.355 26.236 -4.717 85 H GLU 13 H GLU 13 -1.651 22.093 -8.278 86 HA GLU 13 HA GLU 13 -1.968 19.496 -7.046 87 1HB GLU 13 1HB GLU 13 -3.944 21.288 -8.526 88 2HB GLU 13 2HB GLU 13 -4.357 19.735 -7.824 89 1HG GLU 13 1HG GLU 13 -4.633 20.695 -5.791 90 2HG GLU 13 2HG GLU 13 -2.972 21.252 -5.803 91 HE2 GLU 13 HE GLU 13 -3.057 23.330 -5.364 92 H ALA 14 H ALA 14 -1.919 21.124 -10.262 93 HA ALA 14 HA ALA 14 -2.616 18.961 -11.829 94 1HB ALA 14 2HB ALA 14 -2.328 21.389 -12.495 95 2HB ALA 14 3HB ALA 14 -0.571 21.107 -12.508 96 3HB ALA 14 1HB ALA 14 -1.624 20.214 -13.631 97 H GLY 15 H GLY 15 0.650 20.023 -10.660 98 1HA GLY 15 2HA GLY 15 2.537 18.844 -10.322 99 2HA GLY 15 1HA GLY 15 2.225 18.154 -11.903 100 H ASN 16 H ASN 16 0.264 17.814 -8.880 101 HA ASN 16 HA ASN 16 1.276 15.262 -8.316 102 1HB ASN 16 1HB ASN 16 0.325 16.278 -6.423 103 2HB ASN 16 2HB ASN 16 -0.988 16.997 -7.335 104 1HD2 ASN 16 1HD2 ASN 16 -2.783 16.287 -6.450 105 2HD2 ASN 16 2HD2 ASN 16 -3.214 14.637 -6.149 106 H PHE 17 H PHE 17 -1.387 16.616 -10.262 107 HA PHE 17 HA PHE 17 -2.830 14.179 -10.504 108 1HB PHE 17 1HB PHE 17 -3.821 16.461 -10.778 109 2HB PHE 17 2HB PHE 17 -2.696 16.822 -12.073 110 HD1 PHE 17 1HD PHE 17 -3.272 16.369 -14.292 111 HD2 PHE 17 2HD PHE 17 -5.494 14.547 -11.170 112 HE1 PHE 17 1HE PHE 17 -4.933 15.518 -15.971 113 HE2 PHE 17 2HE PHE 17 -7.155 13.696 -12.848 114 HZ PHE 17 HZ PHE 17 -6.855 14.192 -15.229 115 H GLU 18 H GLU 18 -0.692 16.085 -12.748 116 HA GLU 18 HA GLU 18 -0.789 14.577 -14.922 117 1HB GLU 18 1HB GLU 18 1.422 16.110 -13.593 118 2HB GLU 18 2HB GLU 18 1.873 15.081 -14.938 119 1HG GLU 18 1HG GLU 18 0.976 16.521 -16.449 120 2HG GLU 18 2HG GLU 18 -0.556 16.560 -15.597 121 HE2 GLU 18 HE GLU 18 -0.651 18.752 -15.923 122 H ARG 19 H ARG 19 0.865 13.750 -11.858 123 HA ARG 19 HA ARG 19 2.243 11.560 -12.916 124 1HB ARG 19 1HB ARG 19 2.269 12.945 -10.520 125 2HB ARG 19 2HB ARG 19 1.471 11.464 -10.030 126 1HG ARG 19 1HG ARG 19 3.330 10.107 -10.618 127 2HG ARG 19 2HG ARG 19 3.995 11.313 -11.701 128 1HD ARG 19 1HD ARG 19 3.825 12.481 -9.058 129 2HD ARG 19 2HD ARG 19 4.590 10.912 -8.910 130 HE ARG 19 HE ARG 19 5.669 12.422 -11.152 131 2HH1 ARG 19 1HH ARG 19 8.601 13.347 -9.536 132 1HH2 ARG 19 2HH2 ARG 19 5.867 12.036 -7.636 133 2HH2 ARG 19 1HH2 ARG 19 7.484 12.649 -7.535 134 H ILE 20 H ILE 20 -0.957 12.032 -11.339 135 HA ILE 20 HA ILE 20 -1.545 9.301 -11.023 136 HB ILE 20 HB ILE 20 -3.422 11.650 -11.302 137 1HG1 ILE 20 1HG1 ILE 20 -2.465 10.527 -8.681 138 2HG1 ILE 20 2HG1 ILE 20 -1.491 11.711 -9.531 139 1HG2 ILE 20 1HG2 ILE 20 -4.251 9.174 -11.445 140 2HG2 ILE 20 2HG2 ILE 20 -3.974 9.184 -9.686 141 3HG2 ILE 20 3HG2 ILE 20 -5.104 10.349 -10.416 142 1HD1 ILE 20 2HD1 ILE 20 -4.028 12.836 -9.695 143 2HD1 ILE 20 3HD1 ILE 20 -4.048 12.066 -8.091 144 3HD1 ILE 20 1HD1 ILE 20 -2.792 13.264 -8.488 145 H SER 21 H SER 21 -2.102 11.680 -13.668 146 HA SER 21 HA SER 21 -3.711 10.031 -15.194 147 1HB SER 21 1HB SER 21 -3.690 12.296 -15.830 148 2HB SER 21 2HB SER 21 -1.943 12.412 -15.761 149 HG SER 21 HG SER 21 -2.985 12.331 -17.965 150 H GLY 22 H GLY 22 -0.126 10.518 -15.112 151 1HA GLY 22 2HA GLY 22 1.570 9.336 -15.996 152 2HA GLY 22 1HA GLY 22 0.491 8.828 -17.280 153 H ASP 23 H ASP 23 0.518 8.268 -13.683 154 HA ASP 23 HA ASP 23 1.347 5.657 -13.836 155 1HB ASP 23 1HB ASP 23 -0.300 7.226 -11.825 156 2HB ASP 23 2HB ASP 23 -0.004 5.518 -11.564 157 HD2 ASP 23 HD ASP 23 2.363 5.017 -11.812 158 H LEU 24 H LEU 24 -1.979 7.117 -13.612 159 HA LEU 24 HA LEU 24 -3.459 4.816 -13.507 160 1HB LEU 24 1HB LEU 24 -4.226 7.178 -13.239 161 2HB LEU 24 2HB LEU 24 -4.179 7.350 -14.982 162 HG LEU 24 HG LEU 24 -5.809 5.357 -15.055 163 1HD1 LEU 24 2HD1 LEU 24 -5.311 4.960 -12.503 164 2HD1 LEU 24 3HD1 LEU 24 -6.608 6.159 -12.284 165 3HD1 LEU 24 1HD1 LEU 24 -6.929 4.655 -13.180 166 1HD2 LEU 24 3HD2 LEU 24 -6.450 8.149 -14.154 167 2HD2 LEU 24 1HD2 LEU 24 -6.701 7.377 -15.738 168 3HD2 LEU 24 2HD2 LEU 24 -7.749 6.951 -14.364 169 H LYS 25 H LYS 25 -2.111 6.524 -16.389 170 HA LYS 25 HA LYS 25 -3.288 4.778 -18.253 171 1HB LYS 25 1HB LYS 25 -2.666 6.670 -19.320 172 2HB LYS 25 2HB LYS 25 -1.313 6.973 -18.250 173 1HG LYS 25 1HG LYS 25 0.170 5.733 -19.531 174 2HG LYS 25 2HG LYS 25 -1.049 4.572 -20.020 175 1HD LYS 25 1HD LYS 25 -0.426 5.868 -21.981 176 2HD LYS 25 2HD LYS 25 -2.060 6.320 -21.536 177 1HE LYS 25 1HE LYS 25 -1.301 8.472 -21.603 178 2HE LYS 25 2HE LYS 25 -0.572 8.127 -20.047 179 H THR 26 H THR 26 -0.128 4.816 -16.521 180 HA THR 26 HA THR 26 1.109 2.754 -17.876 181 HB THR 26 HB THR 26 1.231 3.998 -15.130 182 HG1 THR 26 1HG THR 26 2.323 4.738 -17.157 183 1HG2 THR 26 1HG2 THR 26 2.372 1.304 -15.914 184 2HG2 THR 26 2HG2 THR 26 3.393 2.418 -14.973 185 3HG2 THR 26 3HG2 THR 26 1.832 1.870 -14.315 186 H GLN 27 H GLN 27 -1.009 2.513 -14.942 187 HA GLN 27 HA GLN 27 -0.865 -0.233 -14.798 188 1HB GLN 27 1HB GLN 27 -3.137 1.621 -13.955 189 2HB GLN 27 2HB GLN 27 -2.953 -0.038 -13.423 190 1HG GLN 27 1HG GLN 27 -0.773 2.056 -13.017 191 2HG GLN 27 2HG GLN 27 -2.043 1.785 -11.840 192 1HE2 GLN 27 1HE2 GLN 27 0.646 0.328 -13.572 193 2HE2 GLN 27 2HE2 GLN 27 0.991 -0.947 -12.452 194 H ILE 28 H ILE 28 -3.205 1.928 -16.514 195 HA ILE 28 HA ILE 28 -4.969 -0.002 -17.371 196 HB ILE 28 HB ILE 28 -4.084 2.640 -18.494 197 1HG1 ILE 28 1HG1 ILE 28 -6.622 1.691 -17.132 198 2HG1 ILE 28 2HG1 ILE 28 -5.361 2.670 -16.409 199 1HG2 ILE 28 2HG2 ILE 28 -5.434 0.551 -19.944 200 2HG2 ILE 28 3HG2 ILE 28 -6.529 1.933 -19.702 201 3HG2 ILE 28 1HG2 ILE 28 -4.948 2.177 -20.483 202 1HD1 ILE 28 3HD1 ILE 28 -6.373 3.765 -18.973 203 2HD1 ILE 28 1HD1 ILE 28 -7.601 3.671 -17.688 204 3HD1 ILE 28 2HD1 ILE 28 -6.096 4.584 -17.417 205 H ASP 29 H ASP 29 -1.779 0.986 -18.696 206 HA ASP 29 HA ASP 29 -2.006 -0.480 -21.041 207 1HB ASP 29 1HB ASP 29 -0.257 1.326 -20.266 208 2HB ASP 29 2HB ASP 29 0.609 -0.024 -19.561 209 HD2 ASP 29 HD ASP 29 0.592 1.831 -22.043 210 H GLN 30 H GLN 30 -0.769 -1.198 -17.724 211 HA GLN 30 HA GLN 30 0.451 -3.586 -18.228 212 1HB GLN 30 1HB GLN 30 -1.109 -2.723 -15.752 213 2HB GLN 30 2HB GLN 30 0.000 -4.080 -15.802 214 1HG GLN 30 1HG GLN 30 0.620 -1.123 -16.053 215 2HG GLN 30 2HG GLN 30 1.327 -2.299 -14.962 216 1HE2 GLN 30 1HE2 GLN 30 2.299 -0.393 -17.160 217 2HE2 GLN 30 2HE2 GLN 30 3.390 -1.340 -18.116 218 H VAL 31 H VAL 31 -3.007 -2.943 -17.328 219 HA VAL 31 HA VAL 31 -3.784 -5.631 -17.358 220 HB VAL 31 HB VAL 31 -5.257 -3.019 -17.692 221 1HG1 VAL 31 2HG1 VAL 31 -6.484 -4.858 -18.846 222 2HG1 VAL 31 3HG1 VAL 31 -6.506 -5.761 -17.312 223 3HG1 VAL 31 1HG1 VAL 31 -7.354 -4.201 -17.439 224 1HG2 VAL 31 3HG2 VAL 31 -4.105 -4.189 -15.470 225 2HG2 VAL 31 1HG2 VAL 31 -5.404 -2.973 -15.452 226 3HG2 VAL 31 2HG2 VAL 31 -5.805 -4.704 -15.352 227 H GLU 32 H GLU 32 -4.170 -3.022 -19.863 228 HA GLU 32 HA GLU 32 -5.342 -4.493 -21.780 229 1HB GLU 32 1HB GLU 32 -3.500 -2.136 -21.768 230 2HB GLU 32 2HB GLU 32 -3.711 -2.933 -23.314 231 1HG GLU 32 1HG GLU 32 -6.279 -2.821 -22.792 232 2HG GLU 32 2HG GLU 32 -5.839 -1.654 -21.561 233 HE2 GLU 32 HE GLU 32 -7.278 -1.079 -24.017 234 H SER 33 H SER 33 -1.883 -4.460 -20.839 235 HA SER 33 HA SER 33 -1.158 -6.107 -23.045 236 1HB SER 33 1HB SER 33 0.197 -4.421 -21.251 237 2HB SER 33 2HB SER 33 0.747 -6.023 -20.804 238 HG SER 33 HG SER 33 2.140 -5.463 -22.423 239 H THR 34 H THR 34 -1.346 -6.486 -19.430 240 HA THR 34 HA THR 34 -0.689 -9.167 -19.308 241 HB THR 34 HB THR 34 -2.167 -7.151 -17.634 242 HG1 THR 34 1HG THR 34 -0.417 -7.998 -16.224 243 1HG2 THR 34 3HG2 THR 34 -3.532 -9.279 -17.374 244 2HG2 THR 34 1HG2 THR 34 -2.030 -10.131 -16.940 245 3HG2 THR 34 2HG2 THR 34 -2.647 -8.828 -15.896 246 H ALA 35 H ALA 35 -3.904 -7.634 -19.876 247 HA ALA 35 HA ALA 35 -5.442 -9.903 -19.758 248 1HB ALA 35 2HB ALA 35 -5.955 -7.842 -21.885 249 2HB ALA 35 1HB ALA 35 -5.946 -7.326 -20.182 250 3HB ALA 35 3HB ALA 35 -7.083 -8.583 -20.725 251 H GLY 36 H GLY 36 -3.227 -8.745 -22.313 252 1HA GLY 36 2HA GLY 36 -2.327 -9.852 -24.059 253 2HA GLY 36 1HA GLY 36 -3.993 -10.173 -24.498 254 H SER 37 H SER 37 -1.975 -11.357 -21.717 255 HA SER 37 HA SER 37 -1.637 -13.896 -22.825 256 1HB SER 37 1HB SER 37 -1.479 -13.000 -19.913 257 2HB SER 37 2HB SER 37 -0.857 -14.517 -20.531 258 HG SER 37 HG SER 37 0.385 -12.126 -20.465 259 H LEU 38 H LEU 38 -4.130 -12.377 -20.776 260 HA LEU 38 HA LEU 38 -5.335 -14.756 -19.889 261 1HB LEU 38 1HB LEU 38 -6.010 -11.867 -19.979 262 2HB LEU 38 2HB LEU 38 -7.347 -12.986 -19.799 263 HG LEU 38 HG LEU 38 -6.904 -12.645 -17.605 264 1HD1 LEU 38 3HD1 LEU 38 -6.367 -15.073 -18.238 265 2HD1 LEU 38 1HD1 LEU 38 -4.665 -14.632 -17.964 266 3HD1 LEU 38 2HD1 LEU 38 -5.844 -14.493 -16.638 267 1HD2 LEU 38 3HD2 LEU 38 -4.007 -12.166 -18.342 268 2HD2 LEU 38 1HD2 LEU 38 -5.226 -10.961 -17.865 269 3HD2 LEU 38 2HD2 LEU 38 -4.635 -12.147 -16.677 270 H GLN 39 H GLN 39 -6.482 -12.407 -22.420 271 HA GLN 39 HA GLN 39 -8.446 -13.995 -23.407 272 1HB GLN 39 1HB GLN 39 -7.875 -12.678 -25.638 273 2HB GLN 39 2HB GLN 39 -8.507 -11.829 -24.242 274 1HG GLN 39 1HG GLN 39 -5.607 -12.043 -24.025 275 2HG GLN 39 2HG GLN 39 -6.032 -11.363 -25.584 276 1HE2 GLN 39 1HE2 GLN 39 -7.837 -11.148 -22.550 277 2HE2 GLN 39 2HE2 GLN 39 -7.732 -9.432 -22.340 278 H GLY 40 H GLY 40 -4.984 -14.381 -23.675 279 1HA GLY 40 2HA GLY 40 -3.705 -15.618 -25.137 280 2HA GLY 40 1HA GLY 40 -5.139 -16.093 -26.025 281 H GLN 41 H GLN 41 -6.009 -16.473 -22.827 282 HA GLN 41 HA GLN 41 -5.467 -19.299 -23.011 283 1HB GLN 41 1HB GLN 41 -3.610 -18.115 -21.648 284 2HB GLN 41 2HB GLN 41 -4.836 -17.814 -20.433 285 1HG GLN 41 1HG GLN 41 -3.952 -20.544 -21.478 286 2HG GLN 41 2HG GLN 41 -3.630 -19.885 -19.886 287 1HE2 GLN 41 1HE2 GLN 41 -5.955 -18.785 -19.116 288 2HE2 GLN 41 2HE2 GLN 41 -7.214 -19.967 -18.971 289 H TRP 42 H TRP 42 -7.606 -19.929 -23.131 290 HA TRP 42 HA TRP 42 -9.188 -19.623 -20.775 291 1HB TRP 42 1HB TRP 42 -10.075 -18.215 -23.299 292 2HB TRP 42 2HB TRP 42 -11.114 -18.558 -21.930 293 HD1 TRP 42 HD TRP 42 -9.258 -15.745 -23.220 294 HE1 TRP 42 1HE TRP 42 -8.607 -13.922 -21.426 295 HE3 TRP 42 3HE TRP 42 -10.102 -18.683 -19.157 296 HZ2 TRP 42 2HZ TRP 42 -8.519 -13.913 -18.574 297 HZ3 TRP 42 3HZ TRP 42 -9.709 -17.691 -16.904 298 HH2 TRP 42 HH TRP 42 -8.945 -15.392 -16.576 299 H ARG 43 H ARG 43 -11.546 -20.627 -21.473 300 HA ARG 43 HA ARG 43 -11.680 -22.275 -23.644 301 1HB ARG 43 1HB ARG 43 -10.149 -23.418 -21.356 302 2HB ARG 43 2HB ARG 43 -11.435 -24.457 -21.937 303 1HG ARG 43 1HG ARG 43 -9.943 -23.281 -24.175 304 2HG ARG 43 2HG ARG 43 -8.869 -24.134 -23.085 305 1HD ARG 43 1HD ARG 43 -11.257 -25.736 -23.449 306 2HD ARG 43 2HD ARG 43 -10.670 -25.254 -25.028 307 HE ARG 43 HE ARG 43 -8.708 -26.525 -24.690 308 2HH1 ARG 43 1HH ARG 43 -7.799 -28.584 -22.044 309 1HH2 ARG 43 2HH2 ARG 43 -10.553 -26.328 -21.672 310 2HH2 ARG 43 1HH2 ARG 43 -9.611 -27.541 -20.871 311 H GLY 44 H GLY 44 -12.213 -22.614 -20.049 312 1HA GLY 44 2HA GLY 44 -14.080 -23.019 -18.857 313 2HA GLY 44 1HA GLY 44 -14.846 -23.626 -20.311 314 H ALA 45 H ALA 45 -14.872 -21.439 -22.036 315 HA ALA 45 HA ALA 45 -16.052 -19.634 -22.528 316 1HB ALA 45 2HB ALA 45 -17.515 -20.886 -20.306 317 2HB ALA 45 3HB ALA 45 -17.814 -19.136 -20.439 318 3HB ALA 45 1HB ALA 45 -18.125 -20.200 -21.831 319 H ALA 46 H ALA 46 -14.014 -19.896 -19.839 320 HA ALA 46 HA ALA 46 -14.285 -17.453 -18.567 321 1HB ALA 46 3HB ALA 46 -11.800 -17.835 -18.068 322 2HB ALA 46 1HB ALA 46 -12.910 -19.147 -17.606 323 3HB ALA 46 2HB ALA 46 -11.926 -19.293 -19.082 324 H GLY 47 H GLY 47 -13.175 -18.256 -21.792 325 1HA GLY 47 2HA GLY 47 -12.176 -17.043 -23.416 326 2HA GLY 47 1HA GLY 47 -11.542 -15.950 -22.201 327 H THR 48 H THR 48 -14.726 -16.876 -23.701 328 HA THR 48 HA THR 48 -15.304 -14.400 -24.745 329 HB THR 48 HB THR 48 -17.660 -15.303 -24.755 330 HG1 THR 48 1HG THR 48 -16.467 -17.566 -23.372 331 1HG2 THR 48 2HG2 THR 48 -15.858 -16.276 -26.342 332 2HG2 THR 48 3HG2 THR 48 -15.693 -17.605 -25.169 333 3HG2 THR 48 1HG2 THR 48 -17.245 -17.338 -25.999 334 H ALA 49 H ALA 49 -15.416 -15.459 -21.390 335 HA ALA 49 HA ALA 49 -17.142 -13.324 -20.572 336 1HB ALA 49 3HB ALA 49 -15.362 -15.273 -19.055 337 2HB ALA 49 1HB ALA 49 -16.504 -14.140 -18.293 338 3HB ALA 49 2HB ALA 49 -17.108 -15.435 -19.355 339 H ALA 50 H ALA 50 -13.598 -14.061 -20.462 340 HA ALA 50 HA ALA 50 -13.015 -11.522 -19.273 341 1HB ALA 50 2HB ALA 50 -10.627 -12.475 -20.167 342 2HB ALA 50 1HB ALA 50 -11.570 -13.984 -20.112 343 3HB ALA 50 3HB ALA 50 -11.389 -12.994 -18.644 344 H GLN 51 H GLN 51 -12.244 -13.061 -22.482 345 HA GLN 51 HA GLN 51 -11.139 -10.971 -23.704 346 1HB GLN 51 1HB GLN 51 -11.195 -12.843 -25.057 347 2HB GLN 51 2HB GLN 51 -12.842 -13.251 -24.621 348 1HG GLN 51 1HG GLN 51 -12.419 -10.714 -26.188 349 2HG GLN 51 2HG GLN 51 -12.203 -12.229 -27.041 350 1HE2 GLN 51 1HE2 GLN 51 -14.382 -9.936 -25.911 351 2HE2 GLN 51 2HE2 GLN 51 -15.875 -10.770 -26.185 352 H ALA 52 H ALA 52 -14.569 -11.373 -22.857 353 HA ALA 52 HA ALA 52 -15.485 -9.244 -24.513 354 1HB ALA 52 1HB ALA 52 -17.028 -10.974 -23.926 355 2HB ALA 52 3HB ALA 52 -17.549 -9.524 -23.034 356 3HB ALA 52 2HB ALA 52 -16.657 -10.815 -22.192 357 H ALA 53 H ALA 53 -14.559 -9.641 -21.044 358 HA ALA 53 HA ALA 53 -15.270 -7.047 -20.268 359 1HB ALA 53 1HB ALA 53 -13.004 -8.633 -19.047 360 2HB ALA 53 3HB ALA 53 -14.689 -9.185 -18.891 361 3HB ALA 53 2HB ALA 53 -14.209 -7.597 -18.246 362 H VAL 54 H VAL 54 -12.027 -8.462 -21.121 363 HA VAL 54 HA VAL 54 -10.610 -6.105 -20.971 364 HB VAL 54 HB VAL 54 -9.198 -7.833 -21.165 365 1HG1 VAL 54 3HG1 VAL 54 -11.380 -9.114 -22.779 366 2HG1 VAL 54 1HG1 VAL 54 -9.729 -9.772 -22.876 367 3HG1 VAL 54 2HG1 VAL 54 -10.562 -9.687 -21.305 368 1HG2 VAL 54 3HG2 VAL 54 -9.020 -6.255 -23.301 369 2HG2 VAL 54 1HG2 VAL 54 -7.978 -7.684 -23.100 370 3HG2 VAL 54 2HG2 VAL 54 -9.414 -7.771 -24.148 371 H VAL 55 H VAL 55 -12.671 -7.432 -23.585 372 HA VAL 55 HA VAL 55 -11.873 -5.674 -25.592 373 HB VAL 55 HB VAL 55 -14.213 -7.413 -25.005 374 1HG1 VAL 55 2HG1 VAL 55 -14.353 -4.980 -26.686 375 2HG1 VAL 55 3HG1 VAL 55 -14.942 -6.474 -27.453 376 3HG1 VAL 55 1HG1 VAL 55 -15.651 -5.924 -25.916 377 1HG2 VAL 55 2HG2 VAL 55 -12.016 -8.080 -26.160 378 2HG2 VAL 55 3HG2 VAL 55 -13.538 -8.567 -26.943 379 3HG2 VAL 55 1HG2 VAL 55 -12.624 -7.172 -27.565 380 H ARG 56 H ARG 56 -14.663 -5.474 -23.270 381 HA ARG 56 HA ARG 56 -15.467 -2.983 -24.133 382 1HB ARG 56 1HB ARG 56 -15.947 -4.732 -21.759 383 2HB ARG 56 2HB ARG 56 -16.252 -3.030 -21.478 384 1HG ARG 56 1HG ARG 56 -18.317 -4.083 -22.264 385 2HG ARG 56 2HG ARG 56 -17.745 -2.972 -23.493 386 1HD ARG 56 1HD ARG 56 -16.459 -5.365 -24.180 387 2HD ARG 56 2HD ARG 56 -18.020 -5.917 -23.607 388 HE ARG 56 HE ARG 56 -18.220 -3.633 -25.428 389 2HH1 ARG 56 1HH ARG 56 -19.417 -5.514 -28.092 390 1HH2 ARG 56 2HH2 ARG 56 -18.002 -7.165 -25.249 391 2HH2 ARG 56 1HH2 ARG 56 -18.731 -7.413 -26.801 392 H PHE 57 H PHE 57 -13.363 -3.988 -21.346 393 HA PHE 57 HA PHE 57 -12.909 -1.491 -20.288 394 1HB PHE 57 1HB PHE 57 -12.054 -3.291 -19.020 395 2HB PHE 57 2HB PHE 57 -11.577 -4.190 -20.448 396 HD1 PHE 57 1HD PHE 57 -10.576 -1.516 -18.125 397 HD2 PHE 57 2HD PHE 57 -9.373 -3.987 -21.358 398 HE1 PHE 57 1HE PHE 57 -8.188 -0.837 -17.755 399 HE2 PHE 57 2HE PHE 57 -6.985 -3.308 -20.989 400 HZ PHE 57 HZ PHE 57 -6.421 -1.741 -19.192 401 H GLN 58 H GLN 58 -11.213 -3.206 -22.976 402 HA GLN 58 HA GLN 58 -9.123 -1.468 -23.251 403 1HB GLN 58 1HB GLN 58 -10.612 -3.263 -25.177 404 2HB GLN 58 2HB GLN 58 -9.332 -2.228 -25.777 405 1HG GLN 58 1HG GLN 58 -8.605 -3.702 -23.303 406 2HG GLN 58 2HG GLN 58 -8.965 -4.749 -24.662 407 1HE2 GLN 58 1HE2 GLN 58 -6.868 -5.416 -24.906 408 2HE2 GLN 58 2HE2 GLN 58 -5.604 -4.419 -25.545 409 H GLU 59 H GLU 59 -12.273 -1.447 -25.079 410 HA GLU 59 HA GLU 59 -11.790 0.864 -26.455 411 1HB GLU 59 1HB GLU 59 -14.435 -0.275 -25.451 412 2HB GLU 59 2HB GLU 59 -14.308 0.999 -26.648 413 1HG GLU 59 1HG GLU 59 -12.665 -1.445 -27.188 414 2HG GLU 59 2HG GLU 59 -14.401 -1.670 -27.268 415 HE2 GLU 59 HE GLU 59 -14.409 -1.829 -29.451 416 H ALA 60 H ALA 60 -12.672 0.360 -23.073 417 HA ALA 60 HA ALA 60 -13.502 3.097 -22.703 418 1HB ALA 60 2HB ALA 60 -13.057 0.749 -20.819 419 2HB ALA 60 3HB ALA 60 -13.652 2.346 -20.304 420 3HB ALA 60 1HB ALA 60 -14.613 1.359 -21.432 421 H ALA 61 H ALA 61 -10.580 1.116 -22.513 422 HA ALA 61 HA ALA 61 -9.093 2.636 -20.738 423 1HB ALA 61 3HB ALA 61 -8.696 0.345 -22.063 424 2HB ALA 61 1HB ALA 61 -7.789 1.424 -23.151 425 3HB ALA 61 2HB ALA 61 -7.339 1.309 -21.432 426 H ASN 62 H ASN 62 -9.125 2.801 -24.375 427 HA ASN 62 HA ASN 62 -7.509 4.969 -24.593 428 1HB ASN 62 1HB ASN 62 -9.279 5.362 -26.684 429 2HB ASN 62 2HB ASN 62 -7.961 4.208 -26.720 430 1HD2 ASN 62 1HD2 ASN 62 -8.381 2.025 -25.953 431 2HD2 ASN 62 2HD2 ASN 62 -9.937 1.305 -26.204 432 H LYS 63 H LYS 63 -11.143 4.807 -24.398 433 HA LYS 63 HA LYS 63 -11.659 7.507 -24.579 434 1HB LYS 63 1HB LYS 63 -13.268 5.528 -24.643 435 2HB LYS 63 2HB LYS 63 -13.233 5.549 -22.892 436 1HG LYS 63 1HG LYS 63 -14.800 7.184 -22.912 437 2HG LYS 63 2HG LYS 63 -13.635 8.258 -23.660 438 1HD LYS 63 1HD LYS 63 -15.784 8.006 -24.973 439 2HD LYS 63 2HD LYS 63 -14.342 7.625 -25.894 440 1HE LYS 63 1HE LYS 63 -14.784 5.319 -25.912 441 2HE LYS 63 2HE LYS 63 -15.697 5.370 -24.416 442 H GLN 64 H GLN 64 -10.501 5.534 -21.841 443 HA GLN 64 HA GLN 64 -10.952 7.601 -19.960 444 1HB GLN 64 1HB GLN 64 -10.064 4.832 -19.953 445 2HB GLN 64 2HB GLN 64 -8.980 5.796 -18.969 446 1HG GLN 64 1HG GLN 64 -11.813 6.503 -18.527 447 2HG GLN 64 2HG GLN 64 -11.492 4.814 -18.188 448 1HE2 GLN 64 1HE2 GLN 64 -9.569 7.795 -17.858 449 2HE2 GLN 64 2HE2 GLN 64 -9.198 7.632 -16.174 450 H LYS 65 H LYS 65 -8.243 6.494 -22.023 451 HA LYS 65 HA LYS 65 -6.290 8.101 -20.744 452 1HB LYS 65 1HB LYS 65 -6.466 6.292 -23.064 453 2HB LYS 65 2HB LYS 65 -5.334 7.613 -23.276 454 1HG LYS 65 1HG LYS 65 -3.905 6.207 -22.149 455 2HG LYS 65 2HG LYS 65 -4.671 6.902 -20.734 456 1HD LYS 65 1HD LYS 65 -4.994 4.663 -20.237 457 2HD LYS 65 2HD LYS 65 -6.458 4.939 -21.159 458 1HE LYS 65 1HE LYS 65 -4.679 4.335 -23.185 459 2HE LYS 65 2HE LYS 65 -4.034 3.358 -21.882 460 H GLN 66 H GLN 66 -8.564 8.526 -23.489 461 HA GLN 66 HA GLN 66 -7.441 10.890 -24.410 462 1HB GLN 66 1HB GLN 66 -9.118 9.413 -25.611 463 2HB GLN 66 2HB GLN 66 -10.368 10.049 -24.560 464 1HG GLN 66 1HG GLN 66 -8.655 12.093 -25.923 465 2HG GLN 66 2HG GLN 66 -9.704 11.162 -26.972 466 1HE2 GLN 66 1HE2 GLN 66 -10.131 13.781 -26.816 467 2HE2 GLN 66 2HE2 GLN 66 -11.567 14.168 -25.929 468 H GLU 67 H GLU 67 -10.182 10.260 -22.117 469 HA GLU 67 HA GLU 67 -10.581 13.007 -21.646 470 1HB GLU 67 1HB GLU 67 -12.500 11.762 -21.219 471 2HB GLU 67 2HB GLU 67 -11.615 10.426 -20.509 472 1HG GLU 67 1HG GLU 67 -12.764 11.508 -18.691 473 2HG GLU 67 2HG GLU 67 -11.073 11.940 -18.525 474 HE2 GLU 67 HE GLU 67 -13.200 14.949 -18.308 475 H LEU 68 H LEU 68 -8.499 10.486 -20.290 476 HA LEU 68 HA LEU 68 -7.948 11.908 -17.876 477 1HB LEU 68 1HB LEU 68 -7.824 9.540 -17.852 478 2HB LEU 68 2HB LEU 68 -6.743 9.503 -19.231 479 HG LEU 68 HG LEU 68 -5.139 10.865 -17.638 480 1HD1 LEU 68 3HD1 LEU 68 -7.287 9.967 -15.837 481 2HD1 LEU 68 1HD1 LEU 68 -5.642 9.568 -15.289 482 3HD1 LEU 68 2HD1 LEU 68 -6.077 11.258 -15.640 483 1HD2 LEU 68 2HD2 LEU 68 -5.337 8.221 -18.465 484 2HD2 LEU 68 3HD2 LEU 68 -3.928 8.999 -17.704 485 3HD2 LEU 68 1HD2 LEU 68 -5.101 8.108 -16.704 486 H ASP 69 H ASP 69 -6.546 11.653 -21.158 487 HA ASP 69 HA ASP 69 -4.210 13.064 -20.424 488 1HB ASP 69 1HB ASP 69 -4.539 11.440 -22.405 489 2HB ASP 69 2HB ASP 69 -5.393 12.738 -23.215 490 HD2 ASP 69 HD ASP 69 -3.358 14.552 -24.174 491 H GLU 70 H GLU 70 -7.236 13.774 -22.321 492 HA GLU 70 HA GLU 70 -6.708 16.336 -23.016 493 1HB GLU 70 1HB GLU 70 -9.009 16.534 -23.487 494 2HB GLU 70 2HB GLU 70 -8.738 14.804 -23.561 495 1HG GLU 70 1HG GLU 70 -9.517 14.597 -21.178 496 2HG GLU 70 2HG GLU 70 -9.825 16.321 -21.141 497 HE2 GLU 70 HE GLU 70 -12.943 15.425 -21.775 498 H ILE 71 H ILE 71 -8.149 15.111 -19.929 499 HA ILE 71 HA ILE 71 -8.643 17.613 -18.809 500 HB ILE 71 HB ILE 71 -8.186 14.867 -17.677 501 1HG1 ILE 71 1HG1 ILE 71 -10.662 16.607 -17.867 502 2HG1 ILE 71 2HG1 ILE 71 -10.253 15.314 -18.977 503 1HG2 ILE 71 2HG2 ILE 71 -7.429 16.773 -16.117 504 2HG2 ILE 71 3HG2 ILE 71 -9.159 17.176 -16.007 505 3HG2 ILE 71 1HG2 ILE 71 -8.585 15.572 -15.491 506 1HD1 ILE 71 3HD1 ILE 71 -10.217 14.611 -16.063 507 2HD1 ILE 71 1HD1 ILE 71 -11.809 14.926 -16.794 508 3HD1 ILE 71 2HD1 ILE 71 -10.762 13.649 -17.458 509 H SER 72 H SER 72 -5.742 15.463 -18.718 510 HA SER 72 HA SER 72 -4.325 17.107 -16.973 511 1HB SER 72 1HB SER 72 -2.349 15.791 -17.707 512 2HB SER 72 2HB SER 72 -3.718 14.759 -17.344 513 HG SER 72 HG SER 72 -2.470 14.357 -19.419 514 H THR 73 H THR 73 -5.095 17.318 -20.381 515 HA THR 73 HA THR 73 -2.898 19.166 -20.903 516 HB THR 73 HB THR 73 -4.960 17.643 -22.532 517 HG1 THR 73 1HG THR 73 -2.827 17.131 -23.550 518 1HG2 THR 73 3HG2 THR 73 -4.690 20.153 -23.315 519 2HG2 THR 73 1HG2 THR 73 -3.038 19.659 -23.755 520 3HG2 THR 73 2HG2 THR 73 -4.437 18.860 -24.511 521 H ASN 74 H ASN 74 -6.275 19.142 -19.988 522 HA ASN 74 HA ASN 74 -6.966 21.598 -21.078 523 1HB ASN 74 1HB ASN 74 -8.011 19.764 -18.951 524 2HB ASN 74 2HB ASN 74 -8.513 21.435 -18.791 525 1HD2 ASN 74 1HD2 ASN 74 -8.838 18.494 -20.501 526 2HD2 ASN 74 2HD2 ASN 74 -10.032 18.973 -21.660 527 H ILE 75 H ILE 75 -4.986 20.611 -18.345 528 HA ILE 75 HA ILE 75 -5.302 22.918 -16.752 529 HB ILE 75 HB ILE 75 -2.934 21.055 -16.853 530 1HG1 ILE 75 1HG1 ILE 75 -4.954 19.700 -16.770 531 2HG1 ILE 75 2HG1 ILE 75 -4.105 19.644 -15.237 532 1HG2 ILE 75 2HG2 ILE 75 -4.013 23.031 -14.869 533 2HG2 ILE 75 3HG2 ILE 75 -3.107 21.606 -14.306 534 3HG2 ILE 75 1HG2 ILE 75 -2.342 22.763 -15.421 535 1HD1 ILE 75 2HD1 ILE 75 -6.414 21.561 -15.783 536 2HD1 ILE 75 3HD1 ILE 75 -6.624 19.952 -15.050 537 3HD1 ILE 75 1HD1 ILE 75 -5.664 21.194 -14.211 538 H ARG 76 H ARG 76 -2.660 21.882 -19.027 539 HA ARG 76 HA ARG 76 -1.183 24.136 -18.849 540 1HB ARG 76 1HB ARG 76 -1.706 22.417 -21.328 541 2HB ARG 76 2HB ARG 76 -0.376 23.549 -21.180 542 1HG ARG 76 1HG ARG 76 0.757 21.700 -20.415 543 2HG ARG 76 2HG ARG 76 0.021 22.137 -18.886 544 1HD ARG 76 1HD ARG 76 -1.014 20.117 -18.851 545 2HD ARG 76 2HD ARG 76 -1.955 20.607 -20.246 546 HE ARG 76 HE ARG 76 -0.544 19.337 -21.643 547 2HH1 ARG 76 1HH ARG 76 2.198 17.347 -20.879 548 1HH2 ARG 76 2HH2 ARG 76 0.890 19.586 -18.413 549 2HH2 ARG 76 1HH2 ARG 76 2.113 18.400 -18.728 550 H GLN 77 H GLN 77 -4.245 23.571 -20.565 551 HA GLN 77 HA GLN 77 -4.021 25.890 -22.175 552 1HB GLN 77 1HB GLN 77 -6.377 24.080 -21.494 553 2HB GLN 77 2HB GLN 77 -6.480 25.407 -22.634 554 1HG GLN 77 1HG GLN 77 -4.141 23.831 -23.288 555 2HG GLN 77 2HG GLN 77 -5.499 22.741 -23.096 556 1HE2 GLN 77 1HE2 GLN 77 -4.002 25.147 -25.003 557 2HE2 GLN 77 2HE2 GLN 77 -5.153 25.239 -26.295 558 H ALA 78 H ALA 78 -4.782 25.270 -18.865 559 HA ALA 78 HA ALA 78 -6.605 27.459 -18.543 560 1HB ALA 78 1HB ALA 78 -5.044 26.001 -16.388 561 2HB ALA 78 2HB ALA 78 -6.624 26.808 -16.254 562 3HB ALA 78 3HB ALA 78 -6.475 25.290 -17.172 563 H GLY 79 H GLY 79 -3.184 27.057 -18.884 564 1HA GLY 79 2HA GLY 79 -2.782 29.804 -17.865 565 2HA GLY 79 1HA GLY 79 -1.935 29.091 -19.223 566 H VAL 80 H VAL 80 -2.063 26.442 -17.398 567 HA VAL 80 HA VAL 80 0.252 27.206 -15.755 568 HB VAL 80 HB VAL 80 -1.323 26.566 -14.220 569 1HG1 VAL 80 2HG1 VAL 80 -2.321 24.533 -16.236 570 2HG1 VAL 80 3HG1 VAL 80 -2.901 24.630 -14.556 571 3HG1 VAL 80 1HG1 VAL 80 -3.148 26.001 -15.664 572 1HG2 VAL 80 3HG2 VAL 80 0.799 25.003 -14.381 573 2HG2 VAL 80 1HG2 VAL 80 -0.511 24.649 -13.229 574 3HG2 VAL 80 2HG2 VAL 80 -0.415 23.759 -14.767 575 H GLN 81 H GLN 81 1.838 26.873 -17.361 576 HA GLN 81 HA GLN 81 2.179 24.059 -17.991 577 1HB GLN 81 1HB GLN 81 3.110 24.965 -20.292 578 2HB GLN 81 2HB GLN 81 1.389 24.705 -20.085 579 1HG GLN 81 1HG GLN 81 0.912 26.933 -20.254 580 2HG GLN 81 2HG GLN 81 2.217 27.387 -19.176 581 1HE2 GLN 81 1HE2 GLN 81 2.127 29.129 -20.923 582 2HE2 GLN 81 2HE2 GLN 81 3.211 28.950 -22.263 583 H TYR 82 H TYR 82 3.302 26.491 -16.242 584 HA TYR 82 HA TYR 82 6.062 25.646 -16.570 585 1HB TYR 82 1HB TYR 82 6.807 27.967 -16.825 586 2HB TYR 82 2HB TYR 82 5.505 27.765 -17.981 587 HD1 TYR 82 1HD TYR 82 3.060 28.287 -16.892 588 HD2 TYR 82 2HD TYR 82 6.791 29.914 -15.573 589 HE1 TYR 82 1HE TYR 82 1.840 30.261 -15.853 590 HE2 TYR 82 2HE TYR 82 5.558 31.882 -14.539 591 HH TYR 82 HH TYR 82 3.506 33.042 -14.774 592 H SER 83 H SER 83 6.724 25.042 -14.574 593 HA SER 83 HA SER 83 6.013 26.779 -12.380 594 1HB SER 83 1HB SER 83 5.663 24.457 -11.069 595 2HB SER 83 2HB SER 83 4.335 25.294 -11.849 596 HG SER 83 HG SER 83 5.740 22.946 -12.684 597 H ARG 84 H ARG 84 7.755 23.818 -13.530 598 HA ARG 84 HA ARG 84 9.727 24.198 -11.488 599 1HB ARG 84 1HB ARG 84 10.706 22.100 -12.365 600 2HB ARG 84 2HB ARG 84 8.982 21.901 -12.122 601 1HG ARG 84 1HG ARG 84 9.635 22.924 -14.819 602 2HG ARG 84 2HG ARG 84 10.378 21.371 -14.492 603 1HD ARG 84 1HD ARG 84 8.359 20.259 -14.445 604 2HD ARG 84 2HD ARG 84 7.536 21.567 -13.617 605 HE ARG 84 HE ARG 84 7.997 22.633 -16.124 606 2HH1 ARG 84 1HH ARG 84 5.502 21.201 -18.071 607 1HH2 ARG 84 2HH2 ARG 84 6.491 19.623 -15.014 608 2HH2 ARG 84 1HH2 ARG 84 5.426 19.509 -16.375 609 H ALA 85 H ALA 85 9.126 25.909 -14.147 610 HA ALA 85 HA ALA 85 11.095 25.809 -15.957 611 1HB ALA 85 1HB ALA 85 10.562 28.027 -16.432 612 2HB ALA 85 2HB ALA 85 9.137 27.517 -15.495 613 3HB ALA 85 3HB ALA 85 10.420 28.471 -14.714 614 H ASP 86 H ASP 86 11.342 27.401 -12.702 615 HA ASP 86 HA ASP 86 13.869 28.329 -12.932 616 1HB ASP 86 1HB ASP 86 12.802 26.982 -10.415 617 2HB ASP 86 2HB ASP 86 13.949 28.305 -10.500 618 HD2 ASP 86 HD ASP 86 10.681 27.465 -10.759 619 H GLU 87 H GLU 87 12.696 25.060 -11.875 620 HA GLU 87 HA GLU 87 15.065 23.973 -11.121 621 1HB GLU 87 1HB GLU 87 12.424 23.065 -11.687 622 2HB GLU 87 2HB GLU 87 13.496 22.009 -12.585 623 1HG GLU 87 1HG GLU 87 14.611 22.479 -9.939 624 2HG GLU 87 2HG GLU 87 12.944 21.963 -9.779 625 HE2 GLU 87 HE GLU 87 12.508 19.923 -10.226 626 H GLU 88 H GLU 88 13.848 24.677 -14.380 627 HA GLU 88 HA GLU 88 15.566 22.979 -15.760 628 1HB GLU 88 1HB GLU 88 13.477 24.647 -16.426 629 2HB GLU 88 2HB GLU 88 14.832 25.545 -17.079 630 1HG GLU 88 1HG GLU 88 14.407 24.160 -18.892 631 2HG GLU 88 2HG GLU 88 15.549 23.145 -18.033 632 HE2 GLU 88 HE GLU 88 12.332 22.673 -19.318 633 H GLN 89 H GLN 89 15.802 26.512 -14.944 634 HA GLN 89 HA GLN 89 18.558 26.431 -15.816 635 1HB GLN 89 1HB GLN 89 16.827 28.294 -16.412 636 2HB GLN 89 2HB GLN 89 17.086 28.876 -14.780 637 1HG GLN 89 1HG GLN 89 19.569 28.980 -15.252 638 2HG GLN 89 2HG GLN 89 19.247 28.499 -16.906 639 1HE2 GLN 89 1HE2 GLN 89 20.397 30.582 -17.226 640 2HE2 GLN 89 2HE2 GLN 89 19.465 32.038 -17.322 641 H GLN 90 H GLN 90 17.510 25.066 -13.318 642 HA GLN 90 HA GLN 90 17.882 26.299 -11.017 643 1HB GLN 90 1HB GLN 90 17.373 23.946 -11.071 644 2HB GLN 90 2HB GLN 90 18.879 23.559 -11.880 645 1HG GLN 90 1HG GLN 90 19.024 22.985 -9.482 646 2HG GLN 90 2HG GLN 90 20.167 24.255 -9.873 647 1HE2 GLN 90 1HE2 GLN 90 20.105 26.117 -8.821 648 2HE2 GLN 90 2HE2 GLN 90 18.887 26.623 -7.698 649 H GLN 91 H GLN 91 20.709 24.440 -12.330 650 HA GLN 91 HA GLN 91 22.397 26.468 -11.130 651 1HB GLN 91 1HB GLN 91 22.760 23.568 -11.873 652 2HB GLN 91 2HB GLN 91 24.181 24.591 -11.795 653 1HG GLN 91 1HG GLN 91 23.968 24.966 -9.491 654 2HG GLN 91 2HG GLN 91 22.230 24.739 -9.502 655 1HE2 GLN 91 1HE2 GLN 91 21.426 22.549 -9.988 656 2HE2 GLN 91 2HE2 GLN 91 22.290 21.180 -9.371 657 H ALA 92 H ALA 92 22.973 24.289 -13.965 658 HA ALA 92 HA ALA 92 23.426 26.703 -15.576 659 1HB ALA 92 3HB ALA 92 25.591 26.145 -15.769 660 2HB ALA 92 1HB ALA 92 25.336 24.736 -14.712 661 3HB ALA 92 2HB ALA 92 25.118 24.580 -16.472 662 H LEU 93 H LEU 93 23.675 23.171 -16.291 663 HA LEU 93 HA LEU 93 21.380 23.527 -18.091 664 1HB LEU 93 1HB LEU 93 22.493 21.819 -19.535 665 2HB LEU 93 2HB LEU 93 23.255 23.396 -19.483 666 HG LEU 93 HG LEU 93 24.514 21.856 -17.470 667 1HD1 LEU 93 2HD1 LEU 93 24.200 20.312 -20.058 668 2HD1 LEU 93 3HD1 LEU 93 25.395 19.949 -18.789 669 3HD1 LEU 93 1HD1 LEU 93 23.655 19.822 -18.436 670 1HD2 LEU 93 1HD2 LEU 93 25.392 22.785 -20.213 671 2HD2 LEU 93 2HD2 LEU 93 25.638 23.598 -18.648 672 3HD2 LEU 93 3HD2 LEU 93 26.488 22.075 -19.004 673 H SER 94 H SER 94 20.364 22.936 -15.854 674 HA SER 94 HA SER 94 20.727 20.396 -14.836 675 1HB SER 94 1HB SER 94 19.064 20.984 -13.366 676 2HB SER 94 2HB SER 94 19.350 22.578 -14.036 677 HG SER 94 HG SER 94 17.628 21.908 -15.690 678 H SER 95 H SER 95 19.319 21.446 -17.803 679 HA SER 95 HA SER 95 17.433 19.314 -17.975 680 1HB SER 95 1HB SER 95 16.755 21.227 -19.167 681 2HB SER 95 2HB SER 95 18.362 21.541 -19.790 682 HG SER 95 HG SER 95 16.925 19.164 -20.553 683 H GLN 96 H GLN 96 20.494 20.253 -19.713 684 HA GLN 96 HA GLN 96 20.655 17.551 -20.713 685 1HB GLN 96 1HB GLN 96 21.042 19.527 -22.222 686 2HB GLN 96 2HB GLN 96 22.451 19.953 -21.271 687 1HG GLN 96 1HG GLN 96 22.757 17.187 -21.894 688 2HG GLN 96 2HG GLN 96 22.196 17.942 -23.372 689 1HE2 GLN 96 1HE2 GLN 96 24.517 17.040 -23.731 690 2HE2 GLN 96 2HE2 GLN 96 25.801 18.196 -23.609 691 H MET 97 H MET 97 21.011 18.174 -17.809 692 HA MET 97 HA MET 97 23.539 18.388 -16.958 693 1HB MET 97 1HB MET 97 21.113 17.756 -15.830 694 2HB MET 97 2HB MET 97 21.895 16.193 -15.703 695 1HG MET 97 1HG MET 97 23.767 18.269 -14.883 696 2HG MET 97 2HG MET 97 22.262 18.470 -14.008 697 1HE MET 97 1HE MET 97 21.708 17.606 -12.234 698 2HE MET 97 2HE MET 97 22.010 15.993 -11.544 699 3HE MET 97 3HE MET 97 23.207 17.292 -11.327 700 H GLY 98 H GLY 98 24.896 16.500 -15.868 701 1HA GLY 98 2HA GLY 98 26.367 14.850 -16.318 702 2HA GLY 98 1HA GLY 98 25.824 14.842 -17.984 703 H PHE 99 H PHE 99 26.398 12.397 -17.041 704 HA PHE 99 HA PHE 99 24.034 10.989 -17.329 705 1HB PHE 99 1HB PHE 99 26.885 10.526 -16.425 706 2HB PHE 99 2HB PHE 99 25.748 9.248 -16.042 707 HD1 PHE 99 1HD PHE 99 24.851 7.831 -17.760 708 HD2 PHE 99 2HD PHE 99 27.368 11.092 -18.779 709 HE1 PHE 99 1HE PHE 99 25.104 6.911 -20.082 710 HE2 PHE 99 2HE PHE 99 27.621 10.172 -21.100 711 HZ PHE 99 HZ PHE 99 26.486 8.093 -21.724 712 H MET 601 H MET 601 9.686 -20.878 -20.134 713 HA MET 601 HA MET 601 7.736 -19.684 -21.521 714 1HB MET 601 1HB MET 601 10.523 -20.646 -22.132 715 2HB MET 601 2HB MET 601 9.567 -20.177 -23.524 716 1HG MET 601 1HG MET 601 9.500 -17.935 -22.906 717 2HG MET 601 2HG MET 601 9.500 -18.291 -21.191 718 1HE MET 601 2HE MET 601 11.097 -17.266 -20.017 719 2HE MET 601 3HE MET 601 12.794 -16.935 -20.438 720 3HE MET 601 1HE MET 601 11.484 -16.054 -21.261 721 H THR 602 H THR 602 6.482 -22.104 -21.039 722 HA THR 602 HA THR 602 6.634 -24.080 -22.932 723 HB THR 602 HB THR 602 4.171 -22.906 -21.536 724 HG1 THR 602 1HG THR 602 5.179 -23.856 -19.809 725 1HG2 THR 602 1HG2 THR 602 4.743 -25.491 -23.005 726 2HG2 THR 602 2HG2 THR 602 3.739 -25.553 -21.537 727 3HG2 THR 602 3HG2 THR 602 3.228 -24.560 -22.923 728 H GLU 603 H GLU 603 4.892 -20.932 -23.149 729 HA GLU 603 HA GLU 603 5.082 -21.157 -25.991 730 1HB GLU 603 1HB GLU 603 2.584 -20.685 -26.279 731 2HB GLU 603 2HB GLU 603 3.003 -22.319 -25.801 732 1HG GLU 603 1HG GLU 603 2.680 -20.643 -23.431 733 2HG GLU 603 2HG GLU 603 1.259 -20.515 -24.450 734 HE2 GLU 603 HE GLU 603 0.086 -23.383 -24.328 735 H GLN 604 H GLN 604 5.916 -19.190 -26.532 736 HA GLN 604 HA GLN 604 5.928 -17.041 -24.840 737 1HB GLN 604 1HB GLN 604 6.468 -17.461 -27.764 738 2HB GLN 604 2HB GLN 604 6.309 -15.805 -27.214 739 1HG GLN 604 1HG GLN 604 8.177 -15.954 -25.774 740 2HG GLN 604 2HG GLN 604 8.068 -17.698 -25.641 741 1HE2 GLN 604 1HE2 GLN 604 10.399 -17.442 -26.077 742 2HE2 GLN 604 2HE2 GLN 604 10.952 -17.446 -27.718 743 H GLN 605 H GLN 605 3.614 -17.956 -27.430 744 HA GLN 605 HA GLN 605 2.261 -15.707 -27.837 745 1HB GLN 605 1HB GLN 605 1.062 -18.471 -27.356 746 2HB GLN 605 2HB GLN 605 0.216 -17.148 -28.133 747 1HG GLN 605 1HG GLN 605 2.677 -17.282 -29.509 748 2HG GLN 605 2HG GLN 605 2.253 -18.961 -29.238 749 1HE2 GLN 605 1HE2 GLN 605 2.199 -16.893 -31.545 750 2HE2 GLN 605 2HE2 GLN 605 0.675 -17.159 -32.322 751 H TRP 606 H TRP 606 2.180 -17.729 -24.884 752 HA TRP 606 HA TRP 606 1.124 -15.530 -23.396 753 1HB TRP 606 1HB TRP 606 -0.872 -16.676 -22.566 754 2HB TRP 606 2HB TRP 606 -0.973 -16.288 -24.273 755 HD1 TRP 606 HD TRP 606 -0.589 -18.490 -25.999 756 HE1 TRP 606 1HE TRP 606 -1.237 -21.038 -25.764 757 HE3 TRP 606 3HE TRP 606 -1.111 -18.433 -20.941 758 HZ2 TRP 606 2HZ TRP 606 -1.881 -22.705 -23.539 759 HZ3 TRP 606 3HZ TRP 606 -1.752 -20.563 -19.816 760 HH2 TRP 606 HH TRP 606 -2.133 -22.649 -21.031 761 H ASN 607 H ASN 607 2.999 -15.726 -22.126 762 HA ASN 607 HA ASN 607 4.188 -18.049 -21.389 763 1HB ASN 607 1HB ASN 607 5.311 -15.952 -20.955 764 2HB ASN 607 2HB ASN 607 3.972 -15.339 -20.006 765 1HD2 ASN 607 1HD2 ASN 607 5.293 -14.896 -18.262 766 2HD2 ASN 607 2HD2 ASN 607 5.921 -16.118 -17.208 767 H PHE 608 H PHE 608 3.836 -19.575 -19.699 768 HA PHE 608 HA PHE 608 1.252 -19.729 -18.620 769 1HB PHE 608 1HB PHE 608 3.275 -21.454 -19.108 770 2HB PHE 608 2HB PHE 608 3.733 -21.073 -17.459 771 HD1 PHE 608 1HD PHE 608 1.959 -21.434 -15.631 772 HD2 PHE 608 2HD PHE 608 1.647 -23.076 -19.532 773 HE1 PHE 608 1HE PHE 608 0.326 -23.141 -14.783 774 HE2 PHE 608 2HE PHE 608 0.014 -24.782 -18.683 775 HZ PHE 608 HZ PHE 608 -0.627 -24.794 -16.319 776 H ALA 609 H ALA 609 4.467 -18.902 -17.152 777 HA ALA 609 HA ALA 609 3.335 -18.437 -14.588 778 1HB ALA 609 2HB ALA 609 5.986 -18.209 -15.939 779 2HB ALA 609 1HB ALA 609 5.557 -18.952 -14.380 780 3HB ALA 609 3HB ALA 609 5.733 -17.185 -14.505 781 H GLY 610 H GLY 610 3.030 -16.793 -17.508 782 1HA GLY 610 2HA GLY 610 2.975 -14.501 -17.991 783 2HA GLY 610 1HA GLY 610 3.027 -14.125 -16.280 784 H ILE 611 H ILE 611 0.924 -16.360 -18.233 785 HA ILE 611 HA ILE 611 -1.338 -14.693 -18.033 786 HB ILE 611 HB ILE 611 -0.937 -16.359 -19.802 787 1HG1 ILE 611 1HG1 ILE 611 -3.245 -15.444 -19.024 788 2HG1 ILE 611 2HG1 ILE 611 -3.175 -16.762 -20.177 789 1HG2 ILE 611 2HG2 ILE 611 -0.868 -18.184 -17.502 790 2HG2 ILE 611 3HG2 ILE 611 -1.887 -18.747 -18.849 791 3HG2 ILE 611 1HG2 ILE 611 -0.175 -18.353 -19.133 792 1HD1 ILE 611 1HD1 ILE 611 -3.189 -17.550 -17.286 793 2HD1 ILE 611 2HD1 ILE 611 -4.696 -16.855 -17.933 794 3HD1 ILE 611 3HD1 ILE 611 -3.996 -18.313 -18.677 795 H GLU 612 H GLU 612 0.238 -16.898 -15.835 796 HA GLU 612 HA GLU 612 -2.106 -17.470 -14.348 797 1HB GLU 612 1HB GLU 612 -0.341 -19.090 -14.259 798 2HB GLU 612 2HB GLU 612 0.865 -17.881 -13.865 799 1HG GLU 612 1HG GLU 612 -0.424 -17.452 -11.686 800 2HG GLU 612 2HG GLU 612 -1.407 -18.851 -12.073 801 HE2 GLU 612 HE GLU 612 -0.247 -20.891 -12.155 802 H ALA 613 H ALA 613 0.864 -15.456 -13.730 803 HA ALA 613 HA ALA 613 -0.335 -14.241 -11.440 804 1HB ALA 613 1HB ALA 613 1.749 -13.201 -11.174 805 2HB ALA 613 3HB ALA 613 2.078 -13.191 -12.923 806 3HB ALA 613 2HB ALA 613 2.175 -14.715 -12.009 807 H ALA 614 H ALA 614 -0.502 -13.798 -14.876 808 HA ALA 614 HA ALA 614 -0.700 -11.092 -15.183 809 1HB ALA 614 2HB ALA 614 -1.751 -13.525 -16.524 810 2HB ALA 614 3HB ALA 614 -2.628 -12.018 -16.883 811 3HB ALA 614 1HB ALA 614 -0.881 -12.128 -17.203 812 H ALA 615 H ALA 615 -3.317 -13.421 -14.229 813 HA ALA 615 HA ALA 615 -5.363 -11.594 -14.017 814 1HB ALA 615 2HB ALA 615 -6.496 -13.393 -13.225 815 2HB ALA 615 3HB ALA 615 -5.004 -14.290 -13.594 816 3HB ALA 615 1HB ALA 615 -5.302 -13.700 -11.942 817 H SER 616 H SER 616 -3.039 -12.701 -11.451 818 HA SER 616 HA SER 616 -4.016 -11.158 -9.437 819 1HB SER 616 1HB SER 616 -1.816 -12.836 -9.841 820 2HB SER 616 2HB SER 616 -1.066 -11.297 -9.466 821 HG SER 616 HG SER 616 -3.248 -12.080 -7.821 822 H ALA 617 H ALA 617 -2.058 -10.262 -12.259 823 HA ALA 617 HA ALA 617 -1.207 -7.752 -11.214 824 1HB ALA 617 1HB ALA 617 -0.463 -9.387 -13.293 825 2HB ALA 617 3HB ALA 617 0.024 -7.683 -13.121 826 3HB ALA 617 2HB ALA 617 -1.363 -8.112 -14.149 827 H ILE 618 H ILE 618 -3.983 -8.988 -13.115 828 HA ILE 618 HA ILE 618 -4.958 -6.484 -13.907 829 HB ILE 618 HB ILE 618 -6.344 -9.133 -13.484 830 1HG1 ILE 618 1HG1 ILE 618 -4.464 -9.124 -15.117 831 2HG1 ILE 618 2HG1 ILE 618 -6.021 -9.507 -15.823 832 1HG2 ILE 618 2HG2 ILE 618 -7.955 -7.289 -13.427 833 2HG2 ILE 618 3HG2 ILE 618 -7.317 -6.678 -14.972 834 3HG2 ILE 618 1HG2 ILE 618 -8.125 -8.263 -14.907 835 1HD1 ILE 618 2HD1 ILE 618 -5.502 -6.610 -15.843 836 2HD1 ILE 618 3HD1 ILE 618 -4.255 -7.530 -16.718 837 3HD1 ILE 618 1HD1 ILE 618 -5.966 -7.686 -17.183 838 H GLN 619 H GLN 619 -5.611 -8.565 -11.023 839 HA GLN 619 HA GLN 619 -7.599 -7.038 -9.945 840 1HB GLN 619 1HB GLN 619 -5.726 -9.109 -9.029 841 2HB GLN 619 2HB GLN 619 -6.132 -7.992 -7.742 842 1HG GLN 619 1HG GLN 619 -8.304 -9.176 -9.509 843 2HG GLN 619 2HG GLN 619 -7.683 -10.070 -8.136 844 1HE2 GLN 619 1HE2 GLN 619 -10.329 -8.933 -8.655 845 2HE2 GLN 619 2HE2 GLN 619 -10.703 -7.879 -7.333 846 H GLY 620 H GLY 620 -4.037 -6.886 -9.204 847 1HA GLY 620 2HA GLY 620 -2.760 -5.227 -8.391 848 2HA GLY 620 1HA GLY 620 -4.167 -4.666 -7.508 849 H ASN 621 H ASN 621 -3.815 -4.958 -11.091 850 HA ASN 621 HA ASN 621 -3.220 -2.260 -11.470 851 1HB ASN 621 1HB ASN 621 -4.216 -4.524 -13.230 852 2HB ASN 621 2HB ASN 621 -4.207 -2.897 -13.880 853 1HD2 ASN 621 1HD2 ASN 621 -2.052 -1.697 -13.009 854 2HD2 ASN 621 2HD2 ASN 621 -0.586 -2.509 -13.446 855 H VAL 622 H VAL 622 -6.199 -4.173 -11.089 856 HA VAL 622 HA VAL 622 -7.983 -2.304 -12.215 857 HB VAL 622 HB VAL 622 -8.229 -4.632 -10.324 858 1HG1 VAL 622 2HG1 VAL 622 -10.353 -2.660 -11.155 859 2HG1 VAL 622 3HG1 VAL 622 -10.764 -4.357 -10.811 860 3HG1 VAL 622 1HG1 VAL 622 -10.019 -3.349 -9.548 861 1HG2 VAL 622 3HG2 VAL 622 -8.027 -4.418 -13.106 862 2HG2 VAL 622 1HG2 VAL 622 -8.534 -5.848 -12.175 863 3HG2 VAL 622 2HG2 VAL 622 -9.755 -4.714 -12.800 864 H THR 623 H THR 623 -7.080 -3.058 -8.775 865 HA THR 623 HA THR 623 -8.572 -0.915 -7.712 866 HB THR 623 HB THR 623 -7.105 -1.464 -5.678 867 HG1 THR 623 1HG THR 623 -5.309 -2.662 -6.187 868 1HG2 THR 623 2HG2 THR 623 -9.204 -2.874 -6.450 869 2HG2 THR 623 3HG2 THR 623 -7.992 -4.053 -7.006 870 3HG2 THR 623 1HG2 THR 623 -8.073 -3.604 -5.285 871 H SER 624 H SER 624 -5.299 -1.162 -9.078 872 HA SER 624 HA SER 624 -4.207 1.078 -7.978 873 1HB SER 624 1HB SER 624 -3.870 -0.118 -10.760 874 2HB SER 624 2HB SER 624 -2.849 1.168 -10.148 875 HG SER 624 HG SER 624 -1.736 -0.678 -9.624 876 H ILE 625 H ILE 625 -6.338 0.725 -10.878 877 HA ILE 625 HA ILE 625 -6.216 3.473 -11.557 878 HB ILE 625 HB ILE 625 -7.623 1.046 -12.457 879 1HG1 ILE 625 1HG1 ILE 625 -7.093 2.760 -14.596 880 2HG1 ILE 625 2HG1 ILE 625 -5.785 3.072 -13.472 881 1HG2 ILE 625 3HG2 ILE 625 -8.909 3.754 -12.553 882 2HG2 ILE 625 1HG2 ILE 625 -9.114 2.626 -13.914 883 3HG2 ILE 625 2HG2 ILE 625 -9.636 2.153 -12.279 884 1HD1 ILE 625 1HD1 ILE 625 -6.593 0.215 -14.082 885 2HD1 ILE 625 2HD1 ILE 625 -5.532 1.110 -15.196 886 3HD1 ILE 625 3HD1 ILE 625 -5.025 0.836 -13.512 887 H HIS 626 H HIS 626 -8.189 1.477 -9.372 888 HA HIS 626 HA HIS 626 -10.281 3.305 -9.065 889 1HB HIS 626 1HB HIS 626 -10.312 0.890 -8.438 890 2HB HIS 626 2HB HIS 626 -9.252 1.250 -7.089 891 HD1 HIS 626 1HD HIS 626 -11.179 0.374 -5.488 892 HD2 HIS 626 2HD HIS 626 -12.102 3.838 -7.668 893 HE1 HIS 626 1HE HIS 626 -13.254 1.377 -4.393 894 H SER 627 H SER 627 -7.197 2.785 -7.244 895 HA SER 627 HA SER 627 -7.778 4.920 -5.482 896 1HB SER 627 1HB SER 627 -5.492 3.039 -5.965 897 2HB SER 627 2HB SER 627 -5.111 4.539 -5.143 898 HG SER 627 HG SER 627 -7.403 3.467 -4.072 899 H LEU 628 H LEU 628 -6.000 4.464 -8.548 900 HA LEU 628 HA LEU 628 -4.518 6.821 -8.504 901 1HB LEU 628 1HB LEU 628 -5.370 4.814 -10.491 902 2HB LEU 628 2HB LEU 628 -4.994 6.395 -11.146 903 HG LEU 628 HG LEU 628 -3.045 5.111 -9.262 904 1HD1 LEU 628 2HD1 LEU 628 -3.940 3.852 -11.664 905 2HD1 LEU 628 3HD1 LEU 628 -2.279 4.439 -11.916 906 3HD1 LEU 628 1HD1 LEU 628 -2.642 3.355 -10.552 907 1HD2 LEU 628 1HD2 LEU 628 -2.808 7.469 -10.115 908 2HD2 LEU 628 2HD2 LEU 628 -1.423 6.397 -10.429 909 3HD2 LEU 628 3HD2 LEU 628 -2.566 6.781 -11.738 910 H LEU 629 H LEU 629 -7.850 6.100 -9.705 911 HA LEU 629 HA LEU 629 -8.283 8.721 -10.656 912 1HB LEU 629 1HB LEU 629 -9.738 6.214 -10.406 913 2HB LEU 629 2HB LEU 629 -10.761 7.599 -10.081 914 HG LEU 629 HG LEU 629 -9.221 8.167 -12.428 915 1HD1 LEU 629 1HD1 LEU 629 -10.587 5.464 -12.457 916 2HD1 LEU 629 2HD1 LEU 629 -10.100 6.367 -13.912 917 3HD1 LEU 629 3HD1 LEU 629 -8.867 5.816 -12.752 918 1HD2 LEU 629 3HD2 LEU 629 -11.551 8.947 -11.606 919 2HD2 LEU 629 1HD2 LEU 629 -11.278 8.719 -13.350 920 3HD2 LEU 629 2HD2 LEU 629 -12.149 7.479 -12.416 921 H ASP 630 H ASP 630 -8.638 7.098 -7.502 922 HA ASP 630 HA ASP 630 -10.277 9.002 -6.341 923 1HB ASP 630 1HB ASP 630 -8.891 6.642 -5.565 924 2HB ASP 630 2HB ASP 630 -8.321 7.885 -4.470 925 HD2 ASP 630 HD ASP 630 -10.720 5.620 -4.660 926 H GLU 631 H GLU 631 -6.763 8.780 -6.950 927 HA GLU 631 HA GLU 631 -6.125 10.915 -5.189 928 1HB GLU 631 1HB GLU 631 -4.626 9.207 -7.168 929 2HB GLU 631 2HB GLU 631 -3.890 10.711 -6.652 930 1HG GLU 631 1HG GLU 631 -4.789 8.408 -4.863 931 2HG GLU 631 2HG GLU 631 -3.141 8.921 -5.164 932 HE2 GLU 631 HE GLU 631 -4.131 12.124 -4.107 933 H GLY 632 H GLY 632 -6.741 10.473 -8.696 934 1HA GLY 632 2HA GLY 632 -6.819 11.953 -10.404 935 2HA GLY 632 1HA GLY 632 -5.934 13.114 -9.435 936 H LYS 633 H LYS 633 -9.027 11.488 -8.541 937 HA LYS 633 HA LYS 633 -10.789 13.416 -9.376 938 1HB LYS 633 1HB LYS 633 -11.138 11.062 -8.310 939 2HB LYS 633 2HB LYS 633 -11.167 11.925 -6.786 940 1HG LYS 633 1HG LYS 633 -13.457 11.754 -7.583 941 2HG LYS 633 2HG LYS 633 -12.971 13.433 -7.713 942 1HD LYS 633 1HD LYS 633 -12.188 12.326 -10.180 943 2HD LYS 633 2HD LYS 633 -13.713 11.533 -9.841 944 1HE LYS 633 1HE LYS 633 -14.304 14.152 -9.151 945 2HE LYS 633 2HE LYS 633 -13.165 14.394 -10.461 946 H GLN 634 H GLN 634 -8.576 13.386 -6.585 947 HA GLN 634 HA GLN 634 -9.821 15.555 -5.299 948 1HB GLN 634 1HB GLN 634 -7.098 14.232 -5.053 949 2HB GLN 634 2HB GLN 634 -7.509 15.644 -4.100 950 1HG GLN 634 1HG GLN 634 -9.749 14.096 -3.685 951 2HG GLN 634 2HG GLN 634 -8.536 12.848 -3.890 952 1HE2 GLN 634 1HE2 GLN 634 -9.833 13.173 -1.517 953 2HE2 GLN 634 2HE2 GLN 634 -8.758 13.757 -0.292 954 H SER 635 H SER 635 -7.434 15.195 -7.894 955 HA SER 635 HA SER 635 -6.592 17.916 -7.676 956 1HB SER 635 1HB SER 635 -5.702 15.509 -9.026 957 2HB SER 635 2HB SER 635 -5.835 16.801 -10.202 958 HG SER 635 HG SER 635 -4.082 16.533 -7.996 959 H LEU 636 H LEU 636 -9.177 16.115 -9.144 960 HA LEU 636 HA LEU 636 -9.593 17.654 -11.446 961 1HB LEU 636 1HB LEU 636 -10.856 15.506 -10.022 962 2HB LEU 636 2HB LEU 636 -12.067 16.688 -10.473 963 HG LEU 636 HG LEU 636 -11.743 14.842 -12.119 964 1HD1 LEU 636 1HD1 LEU 636 -11.208 17.662 -13.087 965 2HD1 LEU 636 2HD1 LEU 636 -11.715 16.305 -14.122 966 3HD1 LEU 636 3HD1 LEU 636 -12.792 16.891 -12.832 967 1HD2 LEU 636 2HD2 LEU 636 -9.314 14.580 -11.874 968 2HD2 LEU 636 3HD2 LEU 636 -9.788 14.828 -13.571 969 3HD2 LEU 636 1HD2 LEU 636 -9.067 16.165 -12.643 970 H THR 637 H THR 637 -11.027 17.859 -8.118 971 HA THR 637 HA THR 637 -12.470 20.231 -8.737 972 HB THR 637 HB THR 637 -13.378 18.907 -6.991 973 HG1 THR 637 1HG THR 637 -12.972 20.313 -5.120 974 1HG2 THR 637 2HG2 THR 637 -10.486 18.514 -6.245 975 2HG2 THR 637 3HG2 THR 637 -11.666 18.549 -4.912 976 3HG2 THR 637 1HG2 THR 637 -11.827 17.344 -6.213 977 H LYS 638 H LYS 638 -9.221 19.518 -7.450 978 HA LYS 638 HA LYS 638 -8.774 22.217 -6.646 979 1HB LYS 638 1HB LYS 638 -6.979 19.803 -6.973 980 2HB LYS 638 2HB LYS 638 -6.377 21.370 -6.471 981 1HG LYS 638 1HG LYS 638 -8.414 21.203 -4.718 982 2HG LYS 638 2HG LYS 638 -8.221 19.485 -5.006 983 1HD LYS 638 1HD LYS 638 -5.835 21.248 -4.328 984 2HD LYS 638 2HD LYS 638 -6.843 20.562 -3.070 985 1HE LYS 638 1HE LYS 638 -4.669 19.284 -4.174 986 2HE LYS 638 2HE LYS 638 -5.981 18.460 -3.356 987 H LEU 639 H LEU 639 -8.564 20.362 -9.631 988 HA LEU 639 HA LEU 639 -6.951 22.450 -10.866 989 1HB LEU 639 1HB LEU 639 -7.878 19.737 -11.807 990 2HB LEU 639 2HB LEU 639 -7.023 20.877 -12.826 991 HG LEU 639 HG LEU 639 -5.861 19.930 -10.206 992 1HD1 LEU 639 1HD1 LEU 639 -6.474 17.981 -11.676 993 2HD1 LEU 639 2HD1 LEU 639 -5.339 18.627 -12.886 994 3HD1 LEU 639 3HD1 LEU 639 -4.744 18.128 -11.284 995 1HD2 LEU 639 3HD2 LEU 639 -5.064 21.933 -11.863 996 2HD2 LEU 639 1HD2 LEU 639 -3.980 21.007 -10.797 997 3HD2 LEU 639 2HD2 LEU 639 -4.134 20.561 -12.514 998 H ALA 640 H ALA 640 -10.224 21.633 -10.249 999 HA ALA 640 HA ALA 640 -11.580 22.217 -12.520 1000 1HB ALA 640 3HB ALA 640 -13.414 22.779 -11.086 1001 2HB ALA 640 1HB ALA 640 -12.445 21.570 -10.209 1002 3HB ALA 640 2HB ALA 640 -12.322 23.292 -9.777 1003 H ALA 641 H ALA 641 -9.808 24.445 -10.354 1004 HA ALA 641 HA ALA 641 -10.851 26.834 -11.332 1005 1HB ALA 641 2HB ALA 641 -9.344 27.740 -9.895 1006 2HB ALA 641 3HB ALA 641 -9.062 26.055 -9.394 1007 3HB ALA 641 1HB ALA 641 -7.986 26.820 -10.587 1008 H ALA 642 H ALA 642 -8.444 24.552 -12.622 1009 HA ALA 642 HA ALA 642 -7.242 26.280 -14.462 1010 1HB ALA 642 1HB ALA 642 -7.687 23.298 -14.815 1011 2HB ALA 642 2HB ALA 642 -6.327 24.287 -15.399 1012 3HB ALA 642 3HB ALA 642 -6.507 23.960 -13.658 1013 H TRP 643 H TRP 643 -10.432 24.895 -14.285 1014 HA TRP 643 HA TRP 643 -10.850 25.174 -17.151 1015 1HB TRP 643 1HB TRP 643 -12.411 23.986 -14.881 1016 2HB TRP 643 2HB TRP 643 -13.218 24.412 -16.377 1017 HD1 TRP 643 HD TRP 643 -12.820 22.781 -18.465 1018 HE1 TRP 643 1HE TRP 643 -11.642 20.454 -18.866 1019 HE3 TRP 643 3HE TRP 643 -10.332 22.683 -14.032 1020 HZ2 TRP 643 2HZ TRP 643 -9.842 18.869 -17.320 1021 HZ3 TRP 643 3HZ TRP 643 -8.885 20.709 -13.555 1022 HH2 TRP 643 HH TRP 643 -8.620 18.845 -15.114 1023 H GLY 644 H GLY 644 -11.723 26.598 -13.963 1024 1HA GLY 644 2HA GLY 644 -13.208 28.734 -15.348 1025 2HA GLY 644 1HA GLY 644 -11.854 29.136 -14.312 1026 H GLY 645 H GLY 645 -11.935 28.030 -12.016 1027 1HA GLY 645 2HA GLY 645 -14.390 28.844 -10.801 1028 2HA GLY 645 1HA GLY 645 -12.987 28.144 -10.018 1029 H SER 646 H SER 646 -13.923 26.535 -8.759 1030 HA SER 646 HA SER 646 -14.681 24.196 -10.107 1031 1HB SER 646 1HB SER 646 -15.394 23.617 -7.585 1032 2HB SER 646 2HB SER 646 -13.715 23.664 -8.082 1033 HG SER 646 HG SER 646 -15.211 25.600 -6.582 1034 H GLY 647 H GLY 647 -16.798 23.009 -9.717 1035 1HA GLY 647 2HA GLY 647 -19.088 24.398 -8.791 1036 2HA GLY 647 1HA GLY 647 -19.047 22.891 -9.685 1037 H SER 648 H SER 648 -17.210 24.842 -11.603 1038 HA SER 648 HA SER 648 -19.263 26.438 -12.735 1039 1HB SER 648 1HB SER 648 -17.573 27.236 -14.227 1040 2HB SER 648 2HB SER 648 -16.770 26.990 -12.690 1041 HG SER 648 HG SER 648 -16.804 24.829 -14.564 1042 H GLU 649 H GLU 649 -20.144 26.200 -14.928 1043 HA GLU 649 HA GLU 649 -21.033 23.694 -15.485 1044 1HB GLU 649 1HB GLU 649 -21.627 24.643 -17.752 1045 2HB GLU 649 2HB GLU 649 -22.144 25.632 -16.401 1046 1HG GLU 649 1HG GLU 649 -19.939 26.948 -16.689 1047 2HG GLU 649 2HG GLU 649 -19.725 26.086 -18.200 1048 HE2 GLU 649 HE GLU 649 -20.470 28.853 -17.359 1049 H ALA 650 H ALA 650 -18.274 25.483 -17.022 1050 HA ALA 650 HA ALA 650 -17.558 23.598 -18.881 1051 1HB ALA 650 3HB ALA 650 -16.247 25.822 -17.400 1052 2HB ALA 650 1HB ALA 650 -15.151 24.635 -18.146 1053 3HB ALA 650 2HB ALA 650 -16.335 25.506 -19.150 1054 H TYR 651 H TYR 651 -15.825 24.034 -15.715 1055 HA TYR 651 HA TYR 651 -14.461 21.678 -15.746 1056 1HB TYR 651 1HB TYR 651 -14.031 23.314 -14.023 1057 2HB TYR 651 2HB TYR 651 -15.735 23.502 -13.659 1058 HD1 TYR 651 1HD TYR 651 -13.020 20.919 -13.465 1059 HD2 TYR 651 2HD TYR 651 -16.587 22.519 -11.728 1060 HE1 TYR 651 1HE TYR 651 -12.781 19.331 -11.493 1061 HE2 TYR 651 2HE TYR 651 -16.337 20.926 -9.763 1062 HH TYR 651 HH TYR 651 -14.957 19.551 -8.729 1063 H GLN 652 H GLN 652 -17.876 22.260 -14.808 1064 HA GLN 652 HA GLN 652 -18.331 19.886 -13.526 1065 1HB GLN 652 1HB GLN 652 -20.082 21.773 -15.117 1066 2HB GLN 652 2HB GLN 652 -20.760 20.281 -14.497 1067 1HG GLN 652 1HG GLN 652 -19.181 21.597 -12.421 1068 2HG GLN 652 2HG GLN 652 -20.359 22.717 -13.077 1069 1HE2 GLN 652 1HE2 GLN 652 -20.301 21.572 -10.462 1070 2HE2 GLN 652 2HE2 GLN 652 -21.754 20.658 -10.228 1071 H GLY 653 H GLY 653 -18.825 20.698 -17.037 1072 1HA GLY 653 2HA GLY 653 -18.843 19.398 -18.869 1073 2HA GLY 653 1HA GLY 653 -19.698 18.215 -17.898 1074 H VAL 654 H VAL 654 -16.480 19.281 -16.871 1075 HA VAL 654 HA VAL 654 -15.136 17.136 -18.233 1076 HB VAL 654 HB VAL 654 -14.342 19.297 -16.293 1077 1HG1 VAL 654 2HG1 VAL 654 -13.069 17.224 -15.757 1078 2HG1 VAL 654 3HG1 VAL 654 -12.490 17.181 -17.440 1079 3HG1 VAL 654 1HG1 VAL 654 -12.043 18.539 -16.380 1080 1HG2 VAL 654 3HG2 VAL 654 -14.640 19.274 -19.046 1081 2HG2 VAL 654 1HG2 VAL 654 -13.685 20.445 -18.105 1082 3HG2 VAL 654 2HG2 VAL 654 -12.892 19.024 -18.826 1083 H GLN 655 H GLN 655 -16.141 17.965 -14.859 1084 HA GLN 655 HA GLN 655 -14.996 15.876 -13.575 1085 1HB GLN 655 1HB GLN 655 -17.239 17.717 -13.103 1086 2HB GLN 655 2HB GLN 655 -17.497 16.168 -12.325 1087 1HG GLN 655 1HG GLN 655 -14.727 17.026 -11.960 1088 2HG GLN 655 2HG GLN 655 -15.822 18.287 -11.432 1089 1HE2 GLN 655 1HE2 GLN 655 -14.119 16.795 -9.766 1090 2HE2 GLN 655 2HE2 GLN 655 -15.070 15.870 -8.651 1091 H GLN 656 H GLN 656 -18.161 15.965 -15.322 1092 HA GLN 656 HA GLN 656 -18.871 13.361 -14.630 1093 1HB GLN 656 1HB GLN 656 -19.807 15.455 -16.524 1094 2HB GLN 656 2HB GLN 656 -20.194 13.815 -17.007 1095 1HG GLN 656 1HG GLN 656 -21.965 13.949 -15.587 1096 2HG GLN 656 2HG GLN 656 -20.805 13.796 -14.282 1097 1HE2 GLN 656 1HE2 GLN 656 -21.428 16.424 -16.596 1098 2HE2 GLN 656 2HE2 GLN 656 -21.786 17.661 -15.437 1099 H LYS 657 H LYS 657 -16.920 14.770 -17.275 1100 HA LYS 657 HA LYS 657 -16.856 12.443 -18.864 1101 1HB LYS 657 1HB LYS 657 -15.154 14.936 -18.713 1102 2HB LYS 657 2HB LYS 657 -14.792 13.635 -19.830 1103 1HG LYS 657 1HG LYS 657 -16.996 13.836 -20.885 1104 2HG LYS 657 2HG LYS 657 -17.528 14.980 -19.668 1105 1HD LYS 657 1HD LYS 657 -15.276 16.265 -20.547 1106 2HD LYS 657 2HD LYS 657 -15.710 15.405 -22.010 1107 1HE LYS 657 1HE LYS 657 -18.173 16.355 -21.336 1108 2HE LYS 657 2HE LYS 657 -17.189 17.595 -20.584 1109 H TRP 658 H TRP 658 -14.985 13.619 -16.060 1110 HA TRP 658 HA TRP 658 -12.882 11.758 -16.321 1111 1HB TRP 658 1HB TRP 658 -12.574 13.755 -15.048 1112 2HB TRP 658 2HB TRP 658 -13.924 13.375 -13.997 1113 HD1 TRP 658 HD TRP 658 -13.383 11.867 -11.876 1114 HE1 TRP 658 1HE TRP 658 -11.254 10.723 -10.817 1115 HE3 TRP 658 3HE TRP 658 -10.346 12.603 -15.887 1116 HZ2 TRP 658 2HZ TRP 658 -8.598 10.265 -11.755 1117 HZ3 TRP 658 3HZ TRP 658 -7.999 11.777 -15.734 1118 HH2 TRP 658 HH TRP 658 -7.113 10.643 -13.758 1119 H ASP 659 H ASP 659 -15.827 11.888 -14.180 1120 HA ASP 659 HA ASP 659 -15.438 9.346 -13.157 1121 1HB ASP 659 1HB ASP 659 -17.429 11.458 -13.045 1122 2HB ASP 659 2HB ASP 659 -18.251 9.923 -13.243 1123 HD2 ASP 659 HD ASP 659 -16.952 10.911 -9.708 1124 H ALA 660 H ALA 660 -16.902 10.616 -16.137 1125 HA ALA 660 HA ALA 660 -18.597 8.560 -16.836 1126 1HB ALA 660 2HB ALA 660 -18.646 10.546 -18.117 1127 2HB ALA 660 1HB ALA 660 -17.947 9.337 -19.221 1128 3HB ALA 660 3HB ALA 660 -16.889 10.511 -18.403 1129 H THR 661 H THR 661 -15.596 8.910 -18.756 1130 HA THR 661 HA THR 661 -15.377 6.235 -19.355 1131 HB THR 661 HB THR 661 -13.044 6.891 -20.021 1132 HG1 THR 661 1HG THR 661 -12.687 8.226 -18.089 1133 1HG2 THR 661 3HG2 THR 661 -15.315 7.931 -21.130 1134 2HG2 THR 661 1HG2 THR 661 -14.565 9.431 -20.534 1135 3HG2 THR 661 2HG2 THR 661 -13.686 8.390 -21.680 1136 H ALA 662 H ALA 662 -14.558 7.896 -16.370 1137 HA ALA 662 HA ALA 662 -12.639 6.164 -15.380 1138 1HB ALA 662 3HB ALA 662 -12.926 8.095 -14.129 1139 2HB ALA 662 2HB ALA 662 -13.823 6.927 -13.129 1140 3HB ALA 662 1HB ALA 662 -14.702 8.021 -14.224 1141 H THR 663 H THR 663 -15.935 6.163 -13.939 1142 HA THR 663 HA THR 663 -15.906 3.625 -13.002 1143 HB THR 663 HB THR 663 -17.692 5.115 -12.397 1144 HG1 THR 663 1HG THR 663 -19.476 3.715 -12.993 1145 1HG2 THR 663 3HG2 THR 663 -17.659 5.816 -15.201 1146 2HG2 THR 663 1HG2 THR 663 -19.282 5.199 -14.807 1147 3HG2 THR 663 2HG2 THR 663 -18.607 6.572 -13.897 1148 H GLU 664 H GLU 664 -16.389 4.644 -16.375 1149 HA GLU 664 HA GLU 664 -17.493 2.321 -17.323 1150 1HB GLU 664 1HB GLU 664 -17.365 4.328 -18.690 1151 2HB GLU 664 2HB GLU 664 -15.613 4.324 -18.639 1152 1HG GLU 664 1HG GLU 664 -16.360 3.419 -20.793 1153 2HG GLU 664 2HG GLU 664 -15.581 2.147 -19.873 1154 HE2 GLU 664 HE GLU 664 -17.479 0.164 -19.443 1155 H LEU 665 H LEU 665 -14.009 3.257 -16.965 1156 HA LEU 665 HA LEU 665 -13.150 0.676 -17.883 1157 1HB LEU 665 1HB LEU 665 -11.979 2.875 -18.277 1158 2HB LEU 665 2HB LEU 665 -11.525 2.862 -16.584 1159 HG LEU 665 HG LEU 665 -10.626 0.411 -17.312 1160 1HD1 LEU 665 3HD1 LEU 665 -10.745 2.066 -19.806 1161 2HD1 LEU 665 1HD1 LEU 665 -9.361 0.980 -19.541 1162 3HD1 LEU 665 2HD1 LEU 665 -11.015 0.322 -19.575 1163 1HD2 LEU 665 1HD2 LEU 665 -9.423 3.101 -17.049 1164 2HD2 LEU 665 2HD2 LEU 665 -9.033 1.573 -16.224 1165 3HD2 LEU 665 3HD2 LEU 665 -8.422 1.878 -17.868 1166 H ASN 666 H ASN 666 -13.648 2.393 -14.779 1167 HA ASN 666 HA ASN 666 -12.288 0.698 -13.142 1168 1HB ASN 666 1HB ASN 666 -13.810 2.903 -12.740 1169 2HB ASN 666 2HB ASN 666 -14.998 1.708 -12.258 1170 1HD2 ASN 666 1HD2 ASN 666 -12.498 3.623 -11.253 1171 2HD2 ASN 666 2HD2 ASN 666 -12.062 2.844 -9.768 1172 H ASN 667 H ASN 667 -15.571 0.466 -14.608 1173 HA ASN 667 HA ASN 667 -16.312 -1.796 -13.099 1174 1HB ASN 667 1HB ASN 667 -17.408 -0.638 -15.716 1175 2HB ASN 667 2HB ASN 667 -18.184 -1.934 -14.829 1176 1HD2 ASN 667 1HD2 ASN 667 -18.763 1.002 -15.494 1177 2HD2 ASN 667 2HD2 ASN 667 -19.300 1.697 -14.001 1178 H ALA 668 H ALA 668 -15.180 -1.149 -16.492 1179 HA ALA 668 HA ALA 668 -15.304 -3.747 -17.440 1180 1HB ALA 668 3HB ALA 668 -14.843 -1.453 -18.609 1181 2HB ALA 668 2HB ALA 668 -14.072 -2.920 -19.258 1182 3HB ALA 668 1HB ALA 668 -13.137 -1.798 -18.240 1183 H LEU 669 H LEU 669 -12.654 -1.984 -15.719 1184 HA LEU 669 HA LEU 669 -10.790 -4.052 -15.880 1185 1HB LEU 669 1HB LEU 669 -11.131 -1.519 -14.450 1186 2HB LEU 669 2HB LEU 669 -10.207 -2.707 -13.550 1187 HG LEU 669 HG LEU 669 -9.502 -2.158 -16.418 1188 1HD1 LEU 669 1HD1 LEU 669 -9.748 0.044 -15.231 1189 2HD1 LEU 669 2HD1 LEU 669 -8.458 -0.484 -14.123 1190 3HD1 LEU 669 3HD1 LEU 669 -8.119 -0.300 -15.861 1191 1HD2 LEU 669 1HD2 LEU 669 -8.509 -4.031 -14.969 1192 2HD2 LEU 669 2HD2 LEU 669 -7.384 -2.972 -15.855 1193 3HD2 LEU 669 3HD2 LEU 669 -7.647 -2.730 -14.111 1194 H GLN 670 H GLN 670 -13.265 -3.232 -13.371 1195 HA GLN 670 HA GLN 670 -12.543 -5.248 -11.630 1196 1HB GLN 670 1HB GLN 670 -14.829 -3.415 -12.015 1197 2HB GLN 670 2HB GLN 670 -15.289 -4.927 -11.258 1198 1HG GLN 670 1HG GLN 670 -12.781 -3.904 -10.124 1199 2HG GLN 670 2HG GLN 670 -14.057 -2.708 -10.006 1200 1HE2 GLN 670 1HE2 GLN 670 -12.607 -4.747 -8.179 1201 2HE2 GLN 670 2HE2 GLN 670 -13.877 -5.456 -7.238 1202 H ASN 671 H ASN 671 -15.116 -5.172 -14.195 1203 HA ASN 671 HA ASN 671 -16.005 -7.736 -13.773 1204 1HB ASN 671 1HB ASN 671 -16.697 -5.672 -15.452 1205 2HB ASN 671 2HB ASN 671 -15.924 -6.739 -16.607 1206 1HD2 ASN 671 1HD2 ASN 671 -17.375 -7.840 -17.667 1207 2HD2 ASN 671 2HD2 ASN 671 -18.773 -8.634 -17.024 1208 H LEU 672 H LEU 672 -13.159 -6.413 -15.437 1209 HA LEU 672 HA LEU 672 -12.605 -8.714 -17.004 1210 1HB LEU 672 1HB LEU 672 -11.788 -6.637 -17.753 1211 2HB LEU 672 2HB LEU 672 -11.055 -6.262 -16.207 1212 HG LEU 672 HG LEU 672 -9.807 -8.640 -17.024 1213 1HD1 LEU 672 3HD1 LEU 672 -10.700 -7.095 -19.343 1214 2HD1 LEU 672 1HD1 LEU 672 -8.940 -7.355 -19.304 1215 3HD1 LEU 672 2HD1 LEU 672 -10.047 -8.748 -19.240 1216 1HD2 LEU 672 2HD2 LEU 672 -9.029 -6.367 -15.902 1217 2HD2 LEU 672 3HD2 LEU 672 -7.884 -7.450 -16.730 1218 3HD2 LEU 672 1HD2 LEU 672 -8.508 -6.008 -17.566 1219 H ALA 673 H ALA 673 -11.203 -7.374 -13.931 1220 HA ALA 673 HA ALA 673 -9.535 -9.587 -13.493 1221 1HB ALA 673 3HB ALA 673 -10.086 -7.065 -12.327 1222 2HB ALA 673 1HB ALA 673 -10.360 -8.271 -11.047 1223 3HB ALA 673 2HB ALA 673 -8.791 -8.204 -11.886 1224 H ARG 674 H ARG 674 -12.976 -9.059 -13.104 1225 HA ARG 674 HA ARG 674 -13.362 -10.923 -11.060 1226 1HB ARG 674 1HB ARG 674 -15.147 -9.629 -13.149 1227 2HB ARG 674 2HB ARG 674 -15.791 -10.910 -12.141 1228 1HG ARG 674 1HG ARG 674 -14.360 -9.084 -10.425 1229 2HG ARG 674 2HG ARG 674 -15.397 -8.130 -11.468 1230 1HD ARG 674 1HD ARG 674 -17.380 -9.195 -10.697 1231 2HD ARG 674 2HD ARG 674 -16.516 -10.601 -10.109 1232 HE ARG 674 HE ARG 674 -15.749 -8.113 -8.756 1233 2HH1 ARG 674 1HH ARG 674 -17.349 -8.940 -5.786 1234 1HH2 ARG 674 2HH2 ARG 674 -18.008 -10.843 -8.744 1235 2HH2 ARG 674 1HH2 ARG 674 -18.391 -10.679 -7.063 1236 H THR 675 H THR 675 -13.077 -11.097 -14.609 1237 HA THR 675 HA THR 675 -13.695 -13.972 -14.493 1238 HB THR 675 HB THR 675 -13.651 -12.018 -16.854 1239 HG1 THR 675 1HG THR 675 -15.705 -11.650 -16.116 1240 1HG2 THR 675 3HG2 THR 675 -13.467 -14.743 -17.036 1241 2HG2 THR 675 1HG2 THR 675 -15.227 -14.574 -16.832 1242 3HG2 THR 675 2HG2 THR 675 -14.407 -13.765 -18.189 1243 H ILE 676 H ILE 676 -11.124 -11.786 -14.434 1244 HA ILE 676 HA ILE 676 -9.397 -13.575 -15.966 1245 HB ILE 676 HB ILE 676 -9.243 -10.729 -15.067 1246 1HG1 ILE 676 1HG1 ILE 676 -8.966 -12.235 -17.665 1247 2HG1 ILE 676 2HG1 ILE 676 -10.112 -10.980 -17.239 1248 1HG2 ILE 676 2HG2 ILE 676 -7.021 -12.585 -14.994 1249 2HG2 ILE 676 3HG2 ILE 676 -6.750 -11.305 -16.200 1250 3HG2 ILE 676 1HG2 ILE 676 -7.098 -10.875 -14.508 1251 1HD1 ILE 676 3HD1 ILE 676 -7.872 -9.539 -16.876 1252 2HD1 ILE 676 1HD1 ILE 676 -7.221 -10.731 -18.028 1253 3HD1 ILE 676 2HD1 ILE 676 -8.613 -9.719 -18.484 1254 H SER 677 H SER 677 -9.602 -11.926 -12.737 1255 HA SER 677 HA SER 677 -7.468 -13.012 -11.553 1256 1HB SER 677 1HB SER 677 -9.136 -11.396 -10.551 1257 2HB SER 677 2HB SER 677 -10.213 -12.746 -10.248 1258 HG SER 677 HG SER 677 -7.829 -13.464 -9.234 1259 H GLU 678 H GLU 678 -10.467 -14.635 -12.514 1260 HA GLU 678 HA GLU 678 -10.204 -16.856 -10.848 1261 1HB GLU 678 1HB GLU 678 -11.830 -17.916 -12.416 1262 2HB GLU 678 2HB GLU 678 -12.327 -16.309 -11.926 1263 1HG GLU 678 1HG GLU 678 -11.108 -15.485 -14.094 1264 2HG GLU 678 2HG GLU 678 -11.130 -17.167 -14.586 1265 HE2 GLU 678 HE GLU 678 -12.616 -17.151 -16.032 1266 H ALA 679 H ALA 679 -8.587 -15.848 -13.797 1267 HA ALA 679 HA ALA 679 -7.896 -18.096 -15.077 1268 1HB ALA 679 1HB ALA 679 -6.253 -15.664 -14.308 1269 2HB ALA 679 2HB ALA 679 -5.627 -16.925 -15.397 1270 3HB ALA 679 3HB ALA 679 -7.079 -16.001 -15.848 1271 H GLY 680 H GLY 680 -6.983 -17.155 -11.784 1272 1HA GLY 680 2HA GLY 680 -5.973 -18.312 -10.143 1273 2HA GLY 680 1HA GLY 680 -4.748 -18.701 -11.334 1274 H GLN 681 H GLN 681 -7.839 -19.764 -9.862 1275 HA GLN 681 HA GLN 681 -7.278 -22.415 -10.945 1276 1HB GLN 681 1HB GLN 681 -6.819 -22.008 -8.417 1277 2HB GLN 681 2HB GLN 681 -8.560 -21.928 -8.233 1278 1HG GLN 681 1HG GLN 681 -8.388 -24.199 -7.955 1279 2HG GLN 681 2HG GLN 681 -8.372 -24.223 -9.707 1280 1HE2 GLN 681 1HE2 GLN 681 -6.999 -25.727 -10.298 1281 2HE2 GLN 681 2HE2 GLN 681 -5.364 -25.918 -9.758 1282 H ALA 682 H ALA 682 -9.408 -19.767 -10.784 1283 HA ALA 682 HA ALA 682 -11.777 -21.438 -11.160 1284 1HB ALA 682 2HB ALA 682 -11.284 -18.517 -10.527 1285 2HB ALA 682 3HB ALA 682 -12.872 -19.088 -11.093 1286 3HB ALA 682 1HB ALA 682 -12.183 -19.728 -9.582 1287 H MET 683 H MET 683 -9.383 -20.993 -13.082 1288 HA MET 683 HA MET 683 -10.364 -19.386 -15.154 1289 1HB MET 683 1HB MET 683 -7.950 -20.048 -14.805 1290 2HB MET 683 2HB MET 683 -8.356 -21.710 -15.187 1291 1HG MET 683 1HG MET 683 -9.174 -19.651 -17.214 1292 2HG MET 683 2HG MET 683 -7.453 -19.932 -17.050 1293 1HE MET 683 1HE MET 683 -6.610 -22.207 -16.544 1294 2HE MET 683 2HE MET 683 -7.755 -23.556 -16.351 1295 3HE MET 683 3HE MET 683 -6.774 -23.426 -17.831 1296 H ALA 684 H ALA 684 -11.151 -22.593 -14.062 1297 HA ALA 684 HA ALA 684 -12.311 -23.250 -16.674 1298 1HB ALA 684 1HB ALA 684 -10.908 -25.011 -15.950 1299 2HB ALA 684 2HB ALA 684 -11.458 -24.874 -14.263 1300 3HB ALA 684 3HB ALA 684 -12.545 -25.546 -15.501 1301 H SER 685 H SER 685 -13.018 -23.195 -13.113 1302 HA SER 685 HA SER 685 -15.761 -22.589 -13.855 1303 1HB SER 685 1HB SER 685 -14.838 -24.690 -11.854 1304 2HB SER 685 2HB SER 685 -16.464 -24.038 -11.845 1305 HG SER 685 HG SER 685 -15.243 -25.823 -13.660 1306 H THR 686 H THR 686 -14.808 -23.329 -10.527 1307 HA THR 686 HA THR 686 -13.760 -20.905 -9.712 1308 HB THR 686 HB THR 686 -16.435 -20.580 -10.552 1309 HG1 THR 686 1HG THR 686 -14.598 -19.039 -10.133 1310 1HG2 THR 686 1HG2 THR 686 -16.922 -21.734 -8.206 1311 2HG2 THR 686 2HG2 THR 686 -16.346 -20.186 -7.543 1312 3HG2 THR 686 3HG2 THR 686 -17.762 -20.220 -8.621 1313 H GLU 687 H GLU 687 -13.375 -20.835 -7.464 1314 HA GLU 687 HA GLU 687 -14.539 -22.127 -5.498 1315 1HB GLU 687 1HB GLU 687 -13.323 -24.129 -7.284 1316 2HB GLU 687 2HB GLU 687 -12.743 -24.275 -5.637 1317 1HG GLU 687 1HG GLU 687 -14.927 -24.640 -4.760 1318 2HG GLU 687 2HG GLU 687 -15.713 -23.950 -6.166 1319 HE2 GLU 687 HE GLU 687 -16.308 -25.887 -7.803 1320 H GLY 688 H GLY 688 -13.561 -20.887 -3.957 1321 1HA GLY 688 2HA GLY 688 -10.694 -21.160 -3.563 1322 2HA GLY 688 1HA GLY 688 -11.856 -20.387 -2.503 1323 H ASN 689 H ASN 689 -11.446 -19.797 -6.039 1324 HA ASN 689 HA ASN 689 -9.920 -17.470 -5.640 1325 1HB ASN 689 1HB ASN 689 -10.933 -19.051 -7.869 1326 2HB ASN 689 2HB ASN 689 -11.277 -17.360 -8.178 1327 1HD2 ASN 689 1HD2 ASN 689 -8.850 -19.792 -7.746 1328 2HD2 ASN 689 2HD2 ASN 689 -7.466 -18.871 -8.235 1329 H VAL 690 H VAL 690 -13.246 -17.968 -7.072 1330 HA VAL 690 HA VAL 690 -14.192 -15.666 -5.562 1331 HB VAL 690 HB VAL 690 -15.333 -15.292 -8.049 1332 1HG1 VAL 690 3HG1 VAL 690 -14.258 -13.718 -6.224 1333 2HG1 VAL 690 1HG1 VAL 690 -12.850 -13.777 -7.311 1334 3HG1 VAL 690 2HG1 VAL 690 -14.415 -13.180 -7.913 1335 1HG2 VAL 690 2HG2 VAL 690 -13.569 -16.890 -8.937 1336 2HG2 VAL 690 3HG2 VAL 690 -13.629 -15.287 -9.709 1337 3HG2 VAL 690 1HG2 VAL 690 -12.361 -15.652 -8.514 1338 H THR 691 H THR 691 -15.873 -16.486 -4.431 1339 HA THR 691 HA THR 691 -17.722 -18.245 -5.896 1340 HB THR 691 HB THR 691 -16.490 -19.741 -4.478 1341 HG1 THR 691 1HG THR 691 -18.874 -19.726 -4.201 1342 1HG2 THR 691 2HG2 THR 691 -16.699 -17.491 -2.427 1343 2HG2 THR 691 3HG2 THR 691 -16.387 -19.173 -1.936 1344 3HG2 THR 691 1HG2 THR 691 -15.231 -18.325 -2.991 1345 H GLY 692 H GLY 692 -17.311 -15.243 -4.689 1346 1HA GLY 692 2HA GLY 692 -18.710 -13.637 -3.976 1347 2HA GLY 692 1HA GLY 692 -19.441 -14.835 -2.926 1348 H MET 693 H MET 693 -19.400 -13.702 -6.368 1349 HA MET 693 HA MET 693 -22.263 -14.187 -6.389 1350 1HB MET 693 1HB MET 693 -20.375 -12.230 -7.631 1351 2HB MET 693 2HB MET 693 -21.624 -12.791 -8.726 1352 1HG MET 693 1HG MET 693 -22.759 -11.014 -7.738 1353 2HG MET 693 2HG MET 693 -23.233 -12.295 -6.640 1354 1HE MET 693 1HE MET 693 -23.576 -11.817 -4.738 1355 2HE MET 693 2HE MET 693 -22.309 -11.598 -3.507 1356 3HE MET 693 3HE MET 693 -23.252 -10.199 -4.074 1357 H PHE 694 H PHE 694 -19.231 -14.765 -8.265 1358 HA PHE 694 HA PHE 694 -20.577 -16.265 -10.275 1359 1HB PHE 694 1HB PHE 694 -18.424 -15.007 -10.593 1360 2HB PHE 694 2HB PHE 694 -17.655 -15.976 -9.351 1361 HD1 PHE 694 1HD PHE 694 -15.880 -16.777 -10.739 1362 HD2 PHE 694 2HD PHE 694 -19.919 -17.407 -11.877 1363 HE1 PHE 694 1HE PHE 694 -15.132 -18.420 -12.484 1364 HE2 PHE 694 2HE PHE 694 -19.172 -19.049 -13.622 1365 HZ PHE 694 HZ PHE 694 -16.787 -19.536 -13.905 1366 H ALA 695 H ALA 695 -21.777 -17.878 -9.063 1367 HA ALA 695 HA ALA 695 -20.034 -19.936 -7.891 1368 1HB ALA 695 1HB ALA 695 -22.983 -19.459 -7.327 1369 2HB ALA 695 2HB ALA 695 -21.855 -20.503 -6.430 1370 3HB ALA 695 3HB ALA 695 -21.673 -18.734 -6.364 No H/Q in entry = 1370 Start of MODEL 28 1 H ALA 1 H ALA 1 -5.440 38.343 -3.029 2 HA ALA 1 HA ALA 1 -6.064 36.409 -3.987 3 1HB ALA 1 2HB ALA 1 -5.376 35.443 -1.999 4 2HB ALA 1 1HB ALA 1 -7.059 34.868 -2.058 5 3HB ALA 1 3HB ALA 1 -6.630 36.263 -1.039 6 H GLU 2 H GLU 2 -7.602 36.608 -5.578 7 HA GLU 2 HA GLU 2 -10.360 36.715 -4.640 8 1HB GLU 2 1HB GLU 2 -10.845 37.557 -6.997 9 2HB GLU 2 2HB GLU 2 -9.909 38.643 -5.990 10 1HG GLU 2 1HG GLU 2 -8.177 36.765 -7.453 11 2HG GLU 2 2HG GLU 2 -9.191 37.688 -8.544 12 HE2 GLU 2 HE GLU 2 -7.445 38.804 -9.201 13 H MET 3 H MET 3 -7.945 34.966 -6.558 14 HA MET 3 HA MET 3 -9.943 32.886 -6.934 15 1HB MET 3 1HB MET 3 -8.142 34.224 -8.971 16 2HB MET 3 2HB MET 3 -8.444 32.509 -9.167 17 1HG MET 3 1HG MET 3 -10.687 34.553 -8.825 18 2HG MET 3 2HG MET 3 -10.072 34.072 -10.394 19 1HE MET 3 2HE MET 3 -10.542 32.099 -11.595 20 2HE MET 3 3HE MET 3 -11.945 31.060 -11.244 21 3HE MET 3 1HE MET 3 -12.166 32.814 -11.457 22 H LYS 4 H LYS 4 -9.129 30.717 -6.832 23 HA LYS 4 HA LYS 4 -6.461 30.592 -5.640 24 1HB LYS 4 1HB LYS 4 -7.173 28.545 -4.607 25 2HB LYS 4 2HB LYS 4 -8.387 29.772 -4.309 26 1HG LYS 4 1HG LYS 4 -9.562 28.834 -6.464 27 2HG LYS 4 2HG LYS 4 -8.512 27.446 -6.260 28 1HD LYS 4 1HD LYS 4 -9.717 28.143 -3.698 29 2HD LYS 4 2HD LYS 4 -10.971 27.980 -4.911 30 1HE LYS 4 1HE LYS 4 -10.710 25.716 -5.029 31 2HE LYS 4 2HE LYS 4 -8.967 25.840 -5.156 32 H THR 5 H THR 5 -7.879 30.388 -8.634 33 HA THR 5 HA THR 5 -6.792 27.955 -9.602 34 HB THR 5 HB THR 5 -8.723 29.201 -10.616 35 HG1 THR 5 1HG THR 5 -7.506 27.827 -12.014 36 1HG2 THR 5 1HG2 THR 5 -7.164 31.481 -10.363 37 2HG2 THR 5 2HG2 THR 5 -6.884 31.047 -12.066 38 3HG2 THR 5 3HG2 THR 5 -8.541 31.334 -11.481 39 H ASP 6 H ASP 6 -5.234 30.665 -8.403 40 HA ASP 6 HA ASP 6 -3.398 31.573 -9.937 41 1HB ASP 6 1HB ASP 6 -3.163 30.322 -7.209 42 2HB ASP 6 2HB ASP 6 -1.670 30.790 -7.999 43 HD2 ASP 6 HD ASP 6 -1.296 33.361 -7.496 44 H ALA 7 H ALA 7 -1.745 30.851 -11.332 45 HA ALA 7 HA ALA 7 -1.636 28.249 -12.187 46 1HB ALA 7 1HB ALA 7 -0.251 30.747 -12.628 47 2HB ALA 7 2HB ALA 7 0.925 29.411 -12.598 48 3HB ALA 7 3HB ALA 7 -0.447 29.365 -13.731 49 H ALA 8 H ALA 8 0.137 29.881 -9.533 50 HA ALA 8 HA ALA 8 2.097 28.008 -9.076 51 1HB ALA 8 3HB ALA 8 2.392 29.849 -7.753 52 2HB ALA 8 2HB ALA 8 1.511 28.860 -6.565 53 3HB ALA 8 1HB ALA 8 0.645 30.090 -7.516 54 H THR 9 H THR 9 -1.323 28.102 -7.891 55 HA THR 9 HA THR 9 -1.069 25.690 -6.413 56 HB THR 9 HB THR 9 -2.872 27.823 -6.626 57 HG1 THR 9 1HG THR 9 -3.067 26.760 -4.695 58 1HG2 THR 9 1HG2 THR 9 -4.052 25.251 -7.777 59 2HG2 THR 9 2HG2 THR 9 -5.054 26.449 -6.922 60 3HG2 THR 9 3HG2 THR 9 -4.207 26.904 -8.420 61 H LEU 10 H LEU 10 -2.525 26.467 -9.639 62 HA LEU 10 HA LEU 10 -3.351 23.912 -10.236 63 1HB LEU 10 1HB LEU 10 -2.395 26.175 -11.983 64 2HB LEU 10 2HB LEU 10 -3.053 24.686 -12.631 65 HG LEU 10 HG LEU 10 -4.491 26.692 -10.876 66 1HD1 LEU 10 2HD1 LEU 10 -4.065 27.122 -13.393 67 2HD1 LEU 10 3HD1 LEU 10 -5.293 25.860 -13.653 68 3HD1 LEU 10 1HD1 LEU 10 -5.709 27.333 -12.745 69 1HD2 LEU 10 2HD2 LEU 10 -5.291 23.929 -11.771 70 2HD2 LEU 10 3HD2 LEU 10 -5.380 24.662 -10.151 71 3HD2 LEU 10 1HD2 LEU 10 -6.505 25.185 -11.428 72 H ALA 11 H ALA 11 -0.189 25.494 -11.073 73 HA ALA 11 HA ALA 11 0.957 23.294 -12.276 74 1HB ALA 11 2HB ALA 11 2.364 25.385 -10.571 75 2HB ALA 11 3HB ALA 11 3.049 24.456 -11.925 76 3HB ALA 11 1HB ALA 11 1.790 25.677 -12.231 77 H GLN 12 H GLN 12 0.330 24.007 -8.865 78 HA GLN 12 HA GLN 12 2.176 22.077 -7.921 79 1HB GLN 12 1HB GLN 12 0.746 24.198 -6.804 80 2HB GLN 12 2HB GLN 12 -0.040 22.796 -6.106 81 1HG GLN 12 1HG GLN 12 1.749 22.325 -4.777 82 2HG GLN 12 2HG GLN 12 2.879 22.475 -6.108 83 1HE2 GLN 12 1HE2 GLN 12 1.043 24.213 -3.669 84 2HE2 GLN 12 2HE2 GLN 12 2.028 25.636 -3.595 85 H GLU 13 H GLU 13 -1.220 22.132 -8.948 86 HA GLU 13 HA GLU 13 -1.612 19.484 -7.857 87 1HB GLU 13 1HB GLU 13 -3.484 21.472 -9.205 88 2HB GLU 13 2HB GLU 13 -3.983 19.847 -8.783 89 1HG GLU 13 1HG GLU 13 -4.443 20.588 -6.691 90 2HG GLU 13 2HG GLU 13 -2.726 20.833 -6.444 91 HE2 GLU 13 HE GLU 13 -5.249 22.599 -8.213 92 H ALA 14 H ALA 14 -1.710 21.253 -11.022 93 HA ALA 14 HA ALA 14 -2.314 19.127 -12.651 94 1HB ALA 14 1HB ALA 14 -1.587 21.814 -12.913 95 2HB ALA 14 2HB ALA 14 -0.316 20.935 -13.796 96 3HB ALA 14 3HB ALA 14 -2.026 20.705 -14.235 97 H GLY 15 H GLY 15 0.771 20.048 -11.090 98 1HA GLY 15 2HA GLY 15 2.788 19.045 -11.043 99 2HA GLY 15 1HA GLY 15 2.422 18.287 -12.580 100 H ASN 16 H ASN 16 0.555 18.013 -9.499 101 HA ASN 16 HA ASN 16 1.660 15.488 -8.903 102 1HB ASN 16 1HB ASN 16 0.359 15.608 -6.952 103 2HB ASN 16 2HB ASN 16 0.446 17.309 -7.365 104 1HD2 ASN 16 1HD2 ASN 16 -1.486 14.374 -7.709 105 2HD2 ASN 16 2HD2 ASN 16 -3.037 15.132 -7.854 106 H PHE 17 H PHE 17 -1.036 16.772 -10.803 107 HA PHE 17 HA PHE 17 -2.610 14.416 -10.803 108 1HB PHE 17 1HB PHE 17 -3.459 16.716 -11.304 109 2HB PHE 17 2HB PHE 17 -2.333 16.869 -12.638 110 HD1 PHE 17 1HD PHE 17 -5.292 14.953 -11.483 111 HD2 PHE 17 2HD PHE 17 -2.930 16.160 -14.795 112 HE1 PHE 17 1HE PHE 17 -7.027 14.042 -13.052 113 HE2 PHE 17 2HE PHE 17 -4.665 15.250 -16.364 114 HZ PHE 17 HZ PHE 17 -6.692 14.202 -15.474 115 H GLU 18 H GLU 18 -0.410 15.943 -13.267 116 HA GLU 18 HA GLU 18 -0.623 14.250 -15.275 117 1HB GLU 18 1HB GLU 18 1.708 15.718 -14.093 118 2HB GLU 18 2HB GLU 18 2.079 14.524 -15.320 119 1HG GLU 18 1HG GLU 18 -0.190 15.997 -16.273 120 2HG GLU 18 2HG GLU 18 0.948 17.177 -15.654 121 HE2 GLU 18 HE GLU 18 2.926 16.992 -18.323 122 H ARG 19 H ARG 19 0.948 13.559 -12.139 123 HA ARG 19 HA ARG 19 2.192 11.211 -12.956 124 1HB ARG 19 1HB ARG 19 2.273 12.733 -10.697 125 2HB ARG 19 2HB ARG 19 1.211 11.464 -10.121 126 1HG ARG 19 1HG ARG 19 2.855 9.815 -10.264 127 2HG ARG 19 2HG ARG 19 3.680 10.593 -11.600 128 1HD ARG 19 1HD ARG 19 5.150 11.541 -10.154 129 2HD ARG 19 2HD ARG 19 3.838 12.393 -9.363 130 HE ARG 19 HE ARG 19 5.093 9.883 -8.468 131 2HH1 ARG 19 1HH ARG 19 3.193 9.718 -5.565 132 1HH2 ARG 19 2HH2 ARG 19 2.316 12.057 -8.128 133 2HH2 ARG 19 1HH2 ARG 19 1.883 11.460 -6.561 134 H ILE 20 H ILE 20 -1.018 11.942 -11.459 135 HA ILE 20 HA ILE 20 -1.785 9.262 -11.118 136 HB ILE 20 HB ILE 20 -3.444 11.768 -11.418 137 1HG1 ILE 20 1HG1 ILE 20 -2.751 10.436 -8.812 138 2HG1 ILE 20 2HG1 ILE 20 -1.613 11.542 -9.557 139 1HG2 ILE 20 3HG2 ILE 20 -4.776 9.759 -11.808 140 2HG2 ILE 20 1HG2 ILE 20 -4.188 9.058 -10.282 141 3HG2 ILE 20 2HG2 ILE 20 -5.202 10.521 -10.257 142 1HD1 ILE 20 1HD1 ILE 20 -4.092 12.873 -9.762 143 2HD1 ILE 20 2HD1 ILE 20 -4.106 12.132 -8.144 144 3HD1 ILE 20 3HD1 ILE 20 -2.786 13.233 -8.607 145 H SER 21 H SER 21 -2.356 11.670 -13.760 146 HA SER 21 HA SER 21 -3.966 10.055 -15.285 147 1HB SER 21 1HB SER 21 -3.220 11.519 -17.199 148 2HB SER 21 2HB SER 21 -3.745 12.411 -15.785 149 HG SER 21 HG SER 21 -1.742 13.242 -16.690 150 H GLY 22 H GLY 22 -0.371 10.591 -15.500 151 1HA GLY 22 2HA GLY 22 1.281 9.300 -16.306 152 2HA GLY 22 1HA GLY 22 0.161 8.808 -17.561 153 H ASP 23 H ASP 23 0.515 8.248 -13.977 154 HA ASP 23 HA ASP 23 1.207 5.642 -14.122 155 1HB ASP 23 1HB ASP 23 -0.356 7.264 -12.097 156 2HB ASP 23 2HB ASP 23 -0.156 5.544 -11.830 157 HD2 ASP 23 HD ASP 23 2.939 8.039 -11.881 158 H LEU 24 H LEU 24 -2.105 7.126 -13.886 159 HA LEU 24 HA LEU 24 -3.593 4.825 -13.731 160 1HB LEU 24 1HB LEU 24 -4.358 7.178 -13.449 161 2HB LEU 24 2HB LEU 24 -4.317 7.368 -15.190 162 HG LEU 24 HG LEU 24 -5.944 5.343 -15.239 163 1HD1 LEU 24 1HD1 LEU 24 -5.486 5.045 -12.667 164 2HD1 LEU 24 2HD1 LEU 24 -6.776 6.263 -12.513 165 3HD1 LEU 24 3HD1 LEU 24 -7.097 4.727 -13.354 166 1HD2 LEU 24 1HD2 LEU 24 -6.413 8.206 -14.730 167 2HD2 LEU 24 2HD2 LEU 24 -7.053 7.137 -16.001 168 3HD2 LEU 24 3HD2 LEU 24 -7.803 7.149 -14.387 169 H LYS 25 H LYS 25 -2.108 6.425 -16.581 170 HA LYS 25 HA LYS 25 -3.374 4.681 -18.437 171 1HB LYS 25 1HB LYS 25 -2.819 6.632 -19.472 172 2HB LYS 25 2HB LYS 25 -1.377 6.880 -18.507 173 1HG LYS 25 1HG LYS 25 -0.035 5.657 -19.934 174 2HG LYS 25 2HG LYS 25 -1.292 4.491 -20.296 175 1HD LYS 25 1HD LYS 25 -0.850 5.773 -22.318 176 2HD LYS 25 2HD LYS 25 -2.441 6.217 -21.733 177 1HE LYS 25 1HE LYS 25 -1.735 8.379 -21.828 178 2HE LYS 25 2HE LYS 25 -0.781 8.030 -20.400 179 H THR 26 H THR 26 -0.292 4.736 -16.613 180 HA THR 26 HA THR 26 0.991 2.688 -18.020 181 HB THR 26 HB THR 26 1.178 4.016 -15.314 182 HG1 THR 26 1HG THR 26 3.010 3.288 -17.490 183 1HG2 THR 26 1HG2 THR 26 2.159 1.272 -15.956 184 2HG2 THR 26 2HG2 THR 26 3.424 2.399 -15.410 185 3HG2 THR 26 3HG2 THR 26 2.012 2.077 -14.375 186 H GLN 27 H GLN 27 -1.335 2.593 -15.275 187 HA GLN 27 HA GLN 27 -1.057 -0.189 -14.969 188 1HB GLN 27 1HB GLN 27 -3.379 1.584 -14.097 189 2HB GLN 27 2HB GLN 27 -2.972 0.008 -13.447 190 1HG GLN 27 1HG GLN 27 -0.895 2.215 -13.401 191 2HG GLN 27 2HG GLN 27 -2.172 2.213 -12.200 192 1HE2 GLN 27 1HE2 GLN 27 0.855 1.586 -12.366 193 2HE2 GLN 27 2HE2 GLN 27 1.045 0.138 -11.435 194 H ILE 28 H ILE 28 -3.366 1.970 -16.706 195 HA ILE 28 HA ILE 28 -5.176 -0.002 -17.461 196 HB ILE 28 HB ILE 28 -4.415 2.695 -18.527 197 1HG1 ILE 28 1HG1 ILE 28 -6.954 1.617 -17.266 198 2HG1 ILE 28 2HG1 ILE 28 -5.705 2.509 -16.421 199 1HG2 ILE 28 1HG2 ILE 28 -5.637 0.616 -20.075 200 2HG2 ILE 28 2HG2 ILE 28 -6.838 1.889 -19.752 201 3HG2 ILE 28 3HG2 ILE 28 -5.289 2.303 -20.525 202 1HD1 ILE 28 2HD1 ILE 28 -6.984 3.674 -18.913 203 2HD1 ILE 28 3HD1 ILE 28 -7.780 3.821 -17.328 204 3HD1 ILE 28 1HD1 ILE 28 -6.163 4.522 -17.581 205 H ASP 29 H ASP 29 -2.108 1.146 -18.962 206 HA ASP 29 HA ASP 29 -2.407 -0.364 -21.277 207 1HB ASP 29 1HB ASP 29 -0.669 1.551 -20.447 208 2HB ASP 29 2HB ASP 29 0.334 0.146 -20.144 209 HD2 ASP 29 HD ASP 29 -1.001 2.092 -22.601 210 H GLN 30 H GLN 30 -0.934 -0.944 -18.037 211 HA GLN 30 HA GLN 30 0.430 -3.249 -18.605 212 1HB GLN 30 1HB GLN 30 -0.700 -1.953 -16.168 213 2HB GLN 30 2HB GLN 30 -0.376 -3.668 -16.014 214 1HG GLN 30 1HG GLN 30 1.914 -3.402 -16.199 215 2HG GLN 30 2HG GLN 30 1.781 -2.081 -17.343 216 1HE2 GLN 30 1HE2 GLN 30 3.435 -1.082 -16.070 217 2HE2 GLN 30 2HE2 GLN 30 3.042 -0.192 -14.637 218 H VAL 31 H VAL 31 -3.023 -2.754 -17.666 219 HA VAL 31 HA VAL 31 -3.632 -5.495 -17.489 220 HB VAL 31 HB VAL 31 -5.238 -2.973 -17.843 221 1HG1 VAL 31 3HG1 VAL 31 -6.136 -5.813 -18.042 222 2HG1 VAL 31 1HG1 VAL 31 -7.153 -4.690 -17.107 223 3HG1 VAL 31 2HG1 VAL 31 -6.785 -4.347 -18.815 224 1HG2 VAL 31 2HG2 VAL 31 -3.994 -3.978 -15.642 225 2HG2 VAL 31 3HG2 VAL 31 -5.459 -2.967 -15.592 226 3HG2 VAL 31 1HG2 VAL 31 -5.597 -4.739 -15.493 227 H GLU 32 H GLU 32 -4.078 -3.034 -20.118 228 HA GLU 32 HA GLU 32 -5.324 -4.576 -21.930 229 1HB GLU 32 1HB GLU 32 -3.516 -2.230 -22.022 230 2HB GLU 32 2HB GLU 32 -3.561 -3.138 -23.520 231 1HG GLU 32 1HG GLU 32 -6.199 -3.085 -23.132 232 2HG GLU 32 2HG GLU 32 -5.825 -1.723 -22.094 233 HE2 GLU 32 HE GLU 32 -6.966 -0.431 -24.262 234 H SER 33 H SER 33 -1.808 -4.509 -21.152 235 HA SER 33 HA SER 33 -1.199 -6.340 -23.231 236 1HB SER 33 1HB SER 33 0.246 -4.562 -21.616 237 2HB SER 33 2HB SER 33 0.772 -6.134 -21.048 238 HG SER 33 HG SER 33 1.680 -6.600 -22.988 239 H THR 34 H THR 34 -1.352 -6.466 -19.601 240 HA THR 34 HA THR 34 -0.701 -9.134 -19.289 241 HB THR 34 HB THR 34 -2.133 -6.983 -17.763 242 HG1 THR 34 1HG THR 34 -0.472 -8.001 -16.234 243 1HG2 THR 34 3HG2 THR 34 -3.587 -9.037 -17.382 244 2HG2 THR 34 1HG2 THR 34 -2.126 -9.911 -16.863 245 3HG2 THR 34 2HG2 THR 34 -2.708 -8.515 -15.925 246 H ALA 35 H ALA 35 -3.902 -7.633 -19.990 247 HA ALA 35 HA ALA 35 -5.449 -9.889 -19.703 248 1HB ALA 35 1HB ALA 35 -6.018 -8.030 -21.977 249 2HB ALA 35 3HB ALA 35 -5.900 -7.316 -20.351 250 3HB ALA 35 2HB ALA 35 -7.087 -8.603 -20.674 251 H GLY 36 H GLY 36 -3.017 -9.093 -22.115 252 1HA GLY 36 2HA GLY 36 -2.157 -10.298 -23.807 253 2HA GLY 36 1HA GLY 36 -3.816 -10.546 -24.312 254 H SER 37 H SER 37 -1.833 -11.702 -21.484 255 HA SER 37 HA SER 37 -1.662 -14.302 -22.405 256 1HB SER 37 1HB SER 37 -1.536 -13.203 -19.562 257 2HB SER 37 2HB SER 37 -1.069 -14.834 -20.002 258 HG SER 37 HG SER 37 0.613 -12.955 -19.918 259 H LEU 38 H LEU 38 -4.273 -12.513 -20.914 260 HA LEU 38 HA LEU 38 -5.615 -14.832 -19.885 261 1HB LEU 38 1HB LEU 38 -6.217 -11.903 -20.092 262 2HB LEU 38 2HB LEU 38 -7.500 -13.037 -19.718 263 HG LEU 38 HG LEU 38 -6.881 -12.482 -17.604 264 1HD1 LEU 38 1HD1 LEU 38 -6.401 -14.961 -18.081 265 2HD1 LEU 38 2HD1 LEU 38 -4.683 -14.512 -17.966 266 3HD1 LEU 38 3HD1 LEU 38 -5.764 -14.257 -16.575 267 1HD2 LEU 38 1HD2 LEU 38 -4.375 -11.656 -18.889 268 2HD2 LEU 38 2HD2 LEU 38 -5.274 -10.928 -17.536 269 3HD2 LEU 38 3HD2 LEU 38 -4.168 -12.291 -17.239 270 H GLN 39 H GLN 39 -6.591 -12.369 -22.377 271 HA GLN 39 HA GLN 39 -8.576 -13.844 -23.471 272 1HB GLN 39 1HB GLN 39 -7.940 -12.493 -25.637 273 2HB GLN 39 2HB GLN 39 -8.479 -11.630 -24.211 274 1HG GLN 39 1HG GLN 39 -5.627 -12.025 -23.980 275 2HG GLN 39 2HG GLN 39 -5.955 -11.403 -25.585 276 1HE2 GLN 39 1HE2 GLN 39 -7.751 -10.892 -22.573 277 2HE2 GLN 39 2HE2 GLN 39 -7.540 -9.176 -22.470 278 H GLY 40 H GLY 40 -5.064 -14.167 -23.895 279 1HA GLY 40 2HA GLY 40 -3.825 -15.483 -25.277 280 2HA GLY 40 1HA GLY 40 -5.256 -15.873 -26.211 281 H GLN 41 H GLN 41 -6.193 -16.340 -23.038 282 HA GLN 41 HA GLN 41 -5.767 -19.176 -23.326 283 1HB GLN 41 1HB GLN 41 -3.861 -18.173 -21.921 284 2HB GLN 41 2HB GLN 41 -5.066 -17.787 -20.709 285 1HG GLN 41 1HG GLN 41 -4.323 -20.557 -21.748 286 2HG GLN 41 2HG GLN 41 -4.076 -19.934 -20.129 287 1HE2 GLN 41 1HE2 GLN 41 -6.122 -19.085 -19.052 288 2HE2 GLN 41 2HE2 GLN 41 -7.540 -20.074 -19.166 289 H TRP 42 H TRP 42 -7.885 -19.827 -23.386 290 HA TRP 42 HA TRP 42 -9.484 -19.450 -21.058 291 1HB TRP 42 1HB TRP 42 -10.280 -18.017 -23.596 292 2HB TRP 42 2HB TRP 42 -11.387 -18.378 -22.286 293 HD1 TRP 42 HD TRP 42 -9.457 -15.553 -23.428 294 HE1 TRP 42 1HE TRP 42 -8.877 -13.772 -21.570 295 HE3 TRP 42 3HE TRP 42 -10.502 -18.569 -19.470 296 HZ2 TRP 42 2HZ TRP 42 -8.920 -13.823 -18.717 297 HZ3 TRP 42 3HZ TRP 42 -10.207 -17.625 -17.182 298 HH2 TRP 42 HH TRP 42 -9.445 -15.339 -16.772 299 H ARG 43 H ARG 43 -11.262 -20.970 -21.075 300 HA ARG 43 HA ARG 43 -11.454 -22.574 -23.469 301 1HB ARG 43 1HB ARG 43 -10.769 -23.621 -20.684 302 2HB ARG 43 2HB ARG 43 -11.446 -24.664 -21.920 303 1HG ARG 43 1HG ARG 43 -9.166 -23.041 -22.895 304 2HG ARG 43 2HG ARG 43 -8.733 -24.107 -21.573 305 1HD ARG 43 1HD ARG 43 -10.436 -25.306 -23.737 306 2HD ARG 43 2HD ARG 43 -8.786 -24.914 -24.178 307 HE ARG 43 HE ARG 43 -8.906 -26.321 -21.634 308 2HH1 ARG 43 1HH ARG 43 -7.903 -29.391 -22.912 309 1HH2 ARG 43 2HH2 ARG 43 -8.967 -26.803 -25.144 310 2HH2 ARG 43 1HH2 ARG 43 -8.384 -28.432 -25.055 311 H GLY 44 H GLY 44 -13.459 -21.006 -23.233 312 1HA GLY 44 2HA GLY 44 -15.452 -22.143 -21.380 313 2HA GLY 44 1HA GLY 44 -15.790 -22.048 -23.097 314 H ALA 45 H ALA 45 -17.280 -20.695 -20.987 315 HA ALA 45 HA ALA 45 -17.649 -18.229 -22.112 316 1HB ALA 45 1HB ALA 45 -18.398 -19.639 -19.624 317 2HB ALA 45 3HB ALA 45 -19.397 -18.674 -20.737 318 3HB ALA 45 2HB ALA 45 -18.417 -17.864 -19.491 319 H ALA 46 H ALA 46 -15.292 -19.287 -19.646 320 HA ALA 46 HA ALA 46 -14.536 -16.892 -18.577 321 1HB ALA 46 3HB ALA 46 -12.241 -18.043 -18.425 322 2HB ALA 46 1HB ALA 46 -13.623 -18.913 -17.717 323 3HB ALA 46 2HB ALA 46 -12.987 -19.397 -19.307 324 H GLY 47 H GLY 47 -14.138 -18.089 -21.867 325 1HA GLY 47 2HA GLY 47 -13.060 -17.262 -23.671 326 2HA GLY 47 1HA GLY 47 -11.987 -16.372 -22.610 327 H THR 48 H THR 48 -15.414 -16.362 -23.810 328 HA THR 48 HA THR 48 -15.294 -13.746 -24.759 329 HB THR 48 HB THR 48 -17.882 -14.986 -23.807 330 HG1 THR 48 1HG THR 48 -16.095 -15.880 -25.960 331 1HG2 THR 48 1HG2 THR 48 -16.883 -13.297 -26.051 332 2HG2 THR 48 2HG2 THR 48 -17.976 -14.608 -26.554 333 3HG2 THR 48 3HG2 THR 48 -18.520 -13.404 -25.362 334 H ALA 49 H ALA 49 -16.132 -15.034 -21.529 335 HA ALA 49 HA ALA 49 -17.296 -12.758 -20.484 336 1HB ALA 49 2HB ALA 49 -15.671 -15.034 -19.323 337 2HB ALA 49 1HB ALA 49 -17.426 -14.750 -19.227 338 3HB ALA 49 3HB ALA 49 -16.307 -13.731 -18.290 339 H ALA 50 H ALA 50 -13.808 -13.743 -20.607 340 HA ALA 50 HA ALA 50 -12.988 -11.268 -19.418 341 1HB ALA 50 1HB ALA 50 -10.691 -12.260 -20.201 342 2HB ALA 50 3HB ALA 50 -11.644 -13.721 -20.558 343 3HB ALA 50 2HB ALA 50 -11.593 -13.075 -18.900 344 H GLN 51 H GLN 51 -12.647 -12.814 -22.693 345 HA GLN 51 HA GLN 51 -11.388 -10.817 -23.961 346 1HB GLN 51 1HB GLN 51 -11.688 -12.395 -25.552 347 2HB GLN 51 2HB GLN 51 -13.061 -13.077 -24.702 348 1HG GLN 51 1HG GLN 51 -13.779 -12.300 -26.918 349 2HG GLN 51 2HG GLN 51 -14.548 -11.323 -25.683 350 1HE2 GLN 51 1HE2 GLN 51 -14.874 -9.613 -27.067 351 2HE2 GLN 51 2HE2 GLN 51 -13.608 -8.560 -27.605 352 H ALA 52 H ALA 52 -14.968 -11.120 -23.458 353 HA ALA 52 HA ALA 52 -15.586 -8.720 -24.792 354 1HB ALA 52 1HB ALA 52 -17.111 -10.691 -24.264 355 2HB ALA 52 3HB ALA 52 -17.793 -9.082 -23.927 356 3HB ALA 52 2HB ALA 52 -17.177 -10.085 -22.592 357 H ALA 53 H ALA 53 -14.273 -9.481 -21.628 358 HA ALA 53 HA ALA 53 -15.122 -7.025 -20.419 359 1HB ALA 53 2HB ALA 53 -12.950 -8.959 -19.531 360 2HB ALA 53 1HB ALA 53 -14.684 -9.219 -19.225 361 3HB ALA 53 3HB ALA 53 -13.859 -7.806 -18.524 362 H VAL 54 H VAL 54 -12.010 -8.392 -21.696 363 HA VAL 54 HA VAL 54 -10.551 -6.034 -21.249 364 HB VAL 54 HB VAL 54 -9.078 -7.679 -21.536 365 1HG1 VAL 54 1HG1 VAL 54 -11.226 -9.033 -23.166 366 2HG1 VAL 54 2HG1 VAL 54 -9.570 -9.682 -23.105 367 3HG1 VAL 54 3HG1 VAL 54 -10.518 -9.521 -21.607 368 1HG2 VAL 54 2HG2 VAL 54 -8.773 -6.135 -23.543 369 2HG2 VAL 54 3HG2 VAL 54 -8.024 -7.746 -23.658 370 3HG2 VAL 54 1HG2 VAL 54 -9.548 -7.409 -24.515 371 H VAL 55 H VAL 55 -12.407 -7.318 -24.062 372 HA VAL 55 HA VAL 55 -11.636 -5.411 -25.910 373 HB VAL 55 HB VAL 55 -13.108 -7.605 -25.994 374 1HG1 VAL 55 2HG1 VAL 55 -15.168 -5.383 -25.827 375 2HG1 VAL 55 3HG1 VAL 55 -15.497 -7.011 -26.467 376 3HG1 VAL 55 1HG1 VAL 55 -15.017 -6.804 -24.765 377 1HG2 VAL 55 3HG2 VAL 55 -13.019 -5.224 -27.812 378 2HG2 VAL 55 1HG2 VAL 55 -12.366 -6.864 -28.042 379 3HG2 VAL 55 2HG2 VAL 55 -14.113 -6.568 -28.214 380 H ARG 56 H ARG 56 -14.452 -5.408 -23.618 381 HA ARG 56 HA ARG 56 -15.343 -2.913 -24.401 382 1HB ARG 56 1HB ARG 56 -15.714 -4.643 -21.941 383 2HB ARG 56 2HB ARG 56 -16.340 -3.007 -21.918 384 1HG ARG 56 1HG ARG 56 -17.404 -3.654 -24.256 385 2HG ARG 56 2HG ARG 56 -17.130 -5.304 -23.733 386 1HD ARG 56 1HD ARG 56 -18.951 -5.230 -22.378 387 2HD ARG 56 2HD ARG 56 -18.315 -3.833 -21.532 388 HE ARG 56 HE ARG 56 -19.492 -3.229 -24.164 389 2HH1 ARG 56 1HH ARG 56 -22.202 -1.534 -22.804 390 1HH2 ARG 56 2HH2 ARG 56 -20.078 -3.479 -20.679 391 2HH2 ARG 56 1HH2 ARG 56 -21.478 -2.461 -20.716 392 H PHE 57 H PHE 57 -13.132 -3.994 -21.747 393 HA PHE 57 HA PHE 57 -12.820 -1.502 -20.545 394 1HB PHE 57 1HB PHE 57 -11.959 -3.298 -19.285 395 2HB PHE 57 2HB PHE 57 -11.468 -4.184 -20.715 396 HD1 PHE 57 1HD PHE 57 -9.268 -3.875 -21.676 397 HD2 PHE 57 2HD PHE 57 -10.473 -1.633 -18.281 398 HE1 PHE 57 1HE PHE 57 -6.884 -3.202 -21.274 399 HE2 PHE 57 2HE PHE 57 -8.089 -0.961 -17.878 400 HZ PHE 57 HZ PHE 57 -6.323 -1.753 -19.380 401 H GLN 58 H GLN 58 -11.189 -3.054 -23.340 402 HA GLN 58 HA GLN 58 -9.059 -1.297 -23.482 403 1HB GLN 58 1HB GLN 58 -10.478 -3.024 -25.536 404 2HB GLN 58 2HB GLN 58 -9.120 -2.016 -25.993 405 1HG GLN 58 1HG GLN 58 -8.451 -3.452 -23.557 406 2HG GLN 58 2HG GLN 58 -9.052 -4.593 -24.743 407 1HE2 GLN 58 1HE2 GLN 58 -6.684 -5.182 -24.328 408 2HE2 GLN 58 2HE2 GLN 58 -5.517 -4.550 -25.441 409 H GLU 59 H GLU 59 -12.180 -1.306 -25.358 410 HA GLU 59 HA GLU 59 -11.727 1.035 -26.690 411 1HB GLU 59 1HB GLU 59 -14.397 -0.073 -25.716 412 2HB GLU 59 2HB GLU 59 -14.199 1.110 -26.993 413 1HG GLU 59 1HG GLU 59 -12.478 -1.191 -27.505 414 2HG GLU 59 2HG GLU 59 -14.123 -1.730 -27.235 415 HE2 GLU 59 HE GLU 59 -13.632 -1.471 -30.464 416 H ALA 60 H ALA 60 -12.636 0.463 -23.325 417 HA ALA 60 HA ALA 60 -13.534 3.168 -22.914 418 1HB ALA 60 2HB ALA 60 -13.031 0.783 -21.095 419 2HB ALA 60 3HB ALA 60 -13.605 2.363 -20.509 420 3HB ALA 60 1HB ALA 60 -14.599 1.422 -21.646 421 H ALA 61 H ALA 61 -10.550 1.269 -22.732 422 HA ALA 61 HA ALA 61 -9.110 2.828 -20.953 423 1HB ALA 61 2HB ALA 61 -8.605 0.554 -22.169 424 2HB ALA 61 3HB ALA 61 -7.865 1.593 -23.410 425 3HB ALA 61 1HB ALA 61 -7.259 1.635 -21.737 426 H ASN 62 H ASN 62 -9.200 3.023 -24.587 427 HA ASN 62 HA ASN 62 -7.615 5.180 -24.871 428 1HB ASN 62 1HB ASN 62 -9.767 5.547 -26.726 429 2HB ASN 62 2HB ASN 62 -8.234 4.754 -27.027 430 1HD2 ASN 62 1HD2 ASN 62 -8.107 2.484 -25.973 431 2HD2 ASN 62 2HD2 ASN 62 -9.444 1.428 -26.284 432 H LYS 63 H LYS 63 -11.217 5.070 -24.362 433 HA LYS 63 HA LYS 63 -11.774 7.740 -24.503 434 1HB LYS 63 1HB LYS 63 -12.989 5.537 -22.822 435 2HB LYS 63 2HB LYS 63 -13.663 7.153 -22.895 436 1HG LYS 63 1HG LYS 63 -13.771 6.937 -25.422 437 2HG LYS 63 2HG LYS 63 -13.226 5.278 -25.268 438 1HD LYS 63 1HD LYS 63 -15.639 5.213 -25.419 439 2HD LYS 63 2HD LYS 63 -15.222 4.822 -23.762 440 1HE LYS 63 1HE LYS 63 -16.548 6.525 -23.067 441 2HE LYS 63 2HE LYS 63 -15.442 7.657 -23.819 442 H GLN 64 H GLN 64 -10.342 5.857 -21.803 443 HA GLN 64 HA GLN 64 -10.489 8.014 -20.000 444 1HB GLN 64 1HB GLN 64 -9.453 5.253 -20.032 445 2HB GLN 64 2HB GLN 64 -8.452 6.332 -19.082 446 1HG GLN 64 1HG GLN 64 -11.282 6.854 -18.557 447 2HG GLN 64 2HG GLN 64 -10.923 5.157 -18.311 448 1HE2 GLN 64 1HE2 GLN 64 -9.694 4.498 -16.637 449 2HE2 GLN 64 2HE2 GLN 64 -9.068 5.530 -15.395 450 H LYS 65 H LYS 65 -8.009 6.732 -22.267 451 HA LYS 65 HA LYS 65 -5.868 8.260 -21.384 452 1HB LYS 65 1HB LYS 65 -6.587 6.705 -23.789 453 2HB LYS 65 2HB LYS 65 -5.420 7.980 -24.072 454 1HG LYS 65 1HG LYS 65 -3.998 6.245 -23.424 455 2HG LYS 65 2HG LYS 65 -4.256 7.034 -21.881 456 1HD LYS 65 1HD LYS 65 -6.425 5.228 -22.125 457 2HD LYS 65 2HD LYS 65 -5.044 4.341 -22.740 458 1HE LYS 65 1HE LYS 65 -4.796 5.889 -20.143 459 2HE LYS 65 2HE LYS 65 -5.569 4.316 -20.144 460 H GLN 66 H GLN 66 -8.672 9.051 -23.446 461 HA GLN 66 HA GLN 66 -7.574 11.480 -24.349 462 1HB GLN 66 1HB GLN 66 -9.649 9.945 -25.164 463 2HB GLN 66 2HB GLN 66 -10.550 11.105 -24.208 464 1HG GLN 66 1HG GLN 66 -8.553 11.881 -26.387 465 2HG GLN 66 2HG GLN 66 -10.281 11.751 -26.648 466 1HE2 GLN 66 1HE2 GLN 66 -8.366 14.023 -26.758 467 2HE2 GLN 66 2HE2 GLN 66 -9.023 15.267 -25.746 468 H GLU 67 H GLU 67 -10.129 10.667 -21.889 469 HA GLU 67 HA GLU 67 -10.527 13.249 -21.045 470 1HB GLU 67 1HB GLU 67 -10.982 10.518 -19.877 471 2HB GLU 67 2HB GLU 67 -11.114 11.885 -18.788 472 1HG GLU 67 1HG GLU 67 -13.291 11.208 -19.934 473 2HG GLU 67 2HG GLU 67 -12.864 12.900 -20.098 474 HE2 GLU 67 HE GLU 67 -12.773 10.172 -22.916 475 H LEU 68 H LEU 68 -7.921 10.956 -20.357 476 HA LEU 68 HA LEU 68 -7.001 12.242 -18.005 477 1HB LEU 68 1HB LEU 68 -6.308 9.974 -19.660 478 2HB LEU 68 2HB LEU 68 -4.873 10.875 -19.214 479 HG LEU 68 HG LEU 68 -5.324 10.605 -16.869 480 1HD1 LEU 68 1HD1 LEU 68 -7.934 10.674 -17.406 481 2HD1 LEU 68 2HD1 LEU 68 -7.741 8.910 -17.266 482 3HD1 LEU 68 3HD1 LEU 68 -7.282 9.966 -15.909 483 1HD2 LEU 68 2HD2 LEU 68 -5.622 8.047 -18.456 484 2HD2 LEU 68 3HD2 LEU 68 -4.135 8.771 -17.796 485 3HD2 LEU 68 1HD2 LEU 68 -5.356 8.088 -16.696 486 H ASP 69 H ASP 69 -5.784 12.211 -21.433 487 HA ASP 69 HA ASP 69 -3.865 14.137 -20.984 488 1HB ASP 69 1HB ASP 69 -4.461 12.540 -23.059 489 2HB ASP 69 2HB ASP 69 -5.303 13.964 -23.637 490 HD2 ASP 69 HD ASP 69 -2.590 15.161 -25.061 491 H GLU 70 H GLU 70 -7.214 14.347 -22.411 492 HA GLU 70 HA GLU 70 -7.307 16.970 -22.980 493 1HB GLU 70 1HB GLU 70 -9.591 16.673 -23.187 494 2HB GLU 70 2HB GLU 70 -9.099 14.993 -23.111 495 1HG GLU 70 1HG GLU 70 -9.552 14.950 -20.663 496 2HG GLU 70 2HG GLU 70 -9.991 16.646 -20.701 497 HE2 GLU 70 HE GLU 70 -11.857 15.398 -19.826 498 H ILE 71 H ILE 71 -7.908 15.412 -19.770 499 HA ILE 71 HA ILE 71 -8.477 17.893 -18.500 500 HB ILE 71 HB ILE 71 -8.105 15.052 -17.669 501 1HG1 ILE 71 1HG1 ILE 71 -10.310 17.004 -16.984 502 2HG1 ILE 71 2HG1 ILE 71 -10.284 16.116 -18.495 503 1HG2 ILE 71 3HG2 ILE 71 -6.789 16.421 -16.050 504 2HG2 ILE 71 1HG2 ILE 71 -8.276 17.322 -15.672 505 3HG2 ILE 71 2HG2 ILE 71 -8.182 15.578 -15.331 506 1HD1 ILE 71 2HD1 ILE 71 -9.985 14.685 -15.828 507 2HD1 ILE 71 3HD1 ILE 71 -11.584 15.058 -16.517 508 3HD1 ILE 71 1HD1 ILE 71 -10.458 14.001 -17.402 509 H SER 72 H SER 72 -5.595 15.767 -18.874 510 HA SER 72 HA SER 72 -3.994 17.157 -17.098 511 1HB SER 72 1HB SER 72 -2.259 15.809 -17.885 512 2HB SER 72 2HB SER 72 -3.659 14.862 -18.348 513 HG SER 72 HG SER 72 -3.411 16.310 -20.449 514 H THR 73 H THR 73 -5.070 17.849 -20.386 515 HA THR 73 HA THR 73 -3.017 19.891 -20.744 516 HB THR 73 HB THR 73 -5.077 18.473 -22.458 517 HG1 THR 73 1HG THR 73 -3.117 17.760 -23.224 518 1HG2 THR 73 2HG2 THR 73 -4.310 21.290 -22.734 519 2HG2 THR 73 3HG2 THR 73 -3.665 20.326 -24.084 520 3HG2 THR 73 1HG2 THR 73 -5.413 20.331 -23.749 521 H ASN 74 H ASN 74 -6.442 19.512 -19.901 522 HA ASN 74 HA ASN 74 -7.416 21.938 -20.495 523 1HB ASN 74 1HB ASN 74 -7.936 19.871 -18.435 524 2HB ASN 74 2HB ASN 74 -8.418 21.470 -17.903 525 1HD2 ASN 74 1HD2 ASN 74 -9.032 18.828 -20.004 526 2HD2 ASN 74 2HD2 ASN 74 -10.477 19.409 -20.762 527 H ILE 75 H ILE 75 -5.097 20.990 -17.951 528 HA ILE 75 HA ILE 75 -5.297 23.404 -16.465 529 HB ILE 75 HB ILE 75 -2.961 21.513 -16.467 530 1HG1 ILE 75 1HG1 ILE 75 -4.874 20.060 -16.424 531 2HG1 ILE 75 2HG1 ILE 75 -4.192 20.141 -14.812 532 1HG2 ILE 75 1HG2 ILE 75 -4.111 23.556 -14.624 533 2HG2 ILE 75 2HG2 ILE 75 -3.355 22.112 -13.909 534 3HG2 ILE 75 3HG2 ILE 75 -2.415 23.163 -14.995 535 1HD1 ILE 75 2HD1 ILE 75 -6.453 21.995 -15.643 536 2HD1 ILE 75 3HD1 ILE 75 -6.771 20.352 -15.035 537 3HD1 ILE 75 1HD1 ILE 75 -5.942 21.540 -13.999 538 H ARG 76 H ARG 76 -3.050 22.120 -18.992 539 HA ARG 76 HA ARG 76 -1.278 24.175 -18.960 540 1HB ARG 76 1HB ARG 76 -2.222 22.201 -21.023 541 2HB ARG 76 2HB ARG 76 -1.282 23.554 -21.620 542 1HG ARG 76 1HG ARG 76 0.400 21.989 -21.129 543 2HG ARG 76 2HG ARG 76 0.390 22.963 -19.673 544 1HD ARG 76 1HD ARG 76 -1.392 21.203 -18.809 545 2HD ARG 76 2HD ARG 76 -0.765 20.188 -20.092 546 HE ARG 76 HE ARG 76 1.511 21.135 -18.768 547 2HH1 ARG 76 1HH ARG 76 1.762 18.871 -16.145 548 1HH2 ARG 76 2HH2 ARG 76 -1.366 19.289 -17.833 549 2HH2 ARG 76 1HH2 ARG 76 -0.557 18.434 -16.563 550 H GLN 77 H GLN 77 -4.436 23.874 -20.686 551 HA GLN 77 HA GLN 77 -4.111 26.337 -22.032 552 1HB GLN 77 1HB GLN 77 -6.660 24.736 -21.540 553 2HB GLN 77 2HB GLN 77 -6.445 25.986 -22.749 554 1HG GLN 77 1HG GLN 77 -4.299 24.119 -23.114 555 2HG GLN 77 2HG GLN 77 -5.757 23.169 -22.908 556 1HE2 GLN 77 1HE2 GLN 77 -3.943 25.215 -24.940 557 2HE2 GLN 77 2HE2 GLN 77 -5.018 25.298 -26.296 558 H ALA 78 H ALA 78 -5.084 25.371 -18.831 559 HA ALA 78 HA ALA 78 -6.889 27.431 -18.243 560 1HB ALA 78 1HB ALA 78 -4.986 26.173 -16.253 561 2HB ALA 78 2HB ALA 78 -6.674 26.685 -16.018 562 3HB ALA 78 3HB ALA 78 -6.310 25.233 -16.982 563 H GLY 79 H GLY 79 -3.404 27.339 -18.685 564 1HA GLY 79 2HA GLY 79 -3.276 30.156 -17.792 565 2HA GLY 79 1HA GLY 79 -2.364 29.473 -19.124 566 H VAL 80 H VAL 80 -2.081 26.876 -17.373 567 HA VAL 80 HA VAL 80 0.041 27.946 -15.642 568 HB VAL 80 HB VAL 80 -1.440 27.025 -14.159 569 1HG1 VAL 80 2HG1 VAL 80 -3.040 26.212 -15.866 570 2HG1 VAL 80 3HG1 VAL 80 -2.035 24.762 -16.096 571 3HG1 VAL 80 1HG1 VAL 80 -2.826 25.056 -14.530 572 1HG2 VAL 80 3HG2 VAL 80 0.904 25.793 -14.350 573 2HG2 VAL 80 1HG2 VAL 80 -0.338 25.257 -13.193 574 3HG2 VAL 80 2HG2 VAL 80 -0.128 24.396 -14.737 575 H GLN 81 H GLN 81 1.700 27.907 -17.204 576 HA GLN 81 HA GLN 81 2.531 25.211 -17.849 577 1HB GLN 81 1HB GLN 81 2.729 25.549 -20.151 578 2HB GLN 81 2HB GLN 81 1.253 26.428 -19.803 579 1HG GLN 81 1HG GLN 81 2.588 28.553 -19.611 580 2HG GLN 81 2HG GLN 81 4.041 27.662 -20.015 581 1HE2 GLN 81 1HE2 GLN 81 2.030 29.751 -21.258 582 2HE2 GLN 81 2HE2 GLN 81 1.932 29.272 -22.920 583 H TYR 82 H TYR 82 3.183 27.851 -16.158 584 HA TYR 82 HA TYR 82 6.055 27.558 -16.536 585 1HB TYR 82 1HB TYR 82 6.281 30.026 -16.679 586 2HB TYR 82 2HB TYR 82 5.154 29.521 -17.923 587 HD1 TYR 82 1HD TYR 82 2.593 29.526 -17.176 588 HD2 TYR 82 2HD TYR 82 5.691 31.801 -15.295 589 HE1 TYR 82 1HE TYR 82 0.858 31.135 -16.248 590 HE2 TYR 82 2HE TYR 82 3.944 33.403 -14.374 591 HH TYR 82 HH TYR 82 1.628 34.123 -15.055 592 H SER 83 H SER 83 5.994 26.427 -14.504 593 HA SER 83 HA SER 83 5.817 28.290 -12.303 594 1HB SER 83 1HB SER 83 3.781 27.413 -11.746 595 2HB SER 83 2HB SER 83 4.001 25.996 -12.754 596 HG SER 83 HG SER 83 5.083 26.435 -10.104 597 H ARG 84 H ARG 84 6.290 24.744 -13.019 598 HA ARG 84 HA ARG 84 8.402 24.655 -11.121 599 1HB ARG 84 1HB ARG 84 6.649 22.784 -12.323 600 2HB ARG 84 2HB ARG 84 8.229 22.344 -12.941 601 1HG ARG 84 1HG ARG 84 8.991 21.646 -10.887 602 2HG ARG 84 2HG ARG 84 8.212 22.964 -10.033 603 1HD ARG 84 1HD ARG 84 6.181 21.807 -9.799 604 2HD ARG 84 2HD ARG 84 6.443 20.831 -11.231 605 HE ARG 84 HE ARG 84 8.475 19.993 -9.567 606 2HH1 ARG 84 1HH ARG 84 6.881 17.855 -7.341 607 1HH2 ARG 84 2HH2 ARG 84 4.976 20.314 -9.111 608 2HH2 ARG 84 1HH2 ARG 84 4.883 19.028 -7.955 609 H ALA 85 H ALA 85 8.045 24.283 -14.718 610 HA ALA 85 HA ALA 85 10.902 24.180 -15.061 611 1HB ALA 85 3HB ALA 85 8.522 23.508 -16.547 612 2HB ALA 85 1HB ALA 85 9.542 24.587 -17.529 613 3HB ALA 85 2HB ALA 85 10.214 23.069 -16.886 614 H ASP 86 H ASP 86 10.552 26.439 -13.656 615 HA ASP 86 HA ASP 86 10.896 28.463 -15.713 616 1HB ASP 86 1HB ASP 86 8.662 28.395 -14.114 617 2HB ASP 86 2HB ASP 86 9.731 29.342 -13.100 618 HD2 ASP 86 HD ASP 86 10.994 30.817 -14.839 619 H GLU 87 H GLU 87 10.999 27.932 -12.098 620 HA GLU 87 HA GLU 87 13.506 29.382 -12.054 621 1HB GLU 87 1HB GLU 87 11.581 29.941 -10.473 622 2HB GLU 87 2HB GLU 87 11.853 28.397 -9.691 623 1HG GLU 87 1HG GLU 87 14.294 29.118 -9.346 624 2HG GLU 87 2HG GLU 87 13.830 30.711 -9.909 625 HE2 GLU 87 HE GLU 87 14.388 31.133 -7.267 626 H GLU 88 H GLU 88 12.031 26.288 -10.850 627 HA GLU 88 HA GLU 88 14.213 25.176 -9.741 628 1HB GLU 88 1HB GLU 88 11.698 24.326 -10.219 629 2HB GLU 88 2HB GLU 88 12.509 23.399 -11.466 630 1HG GLU 88 1HG GLU 88 13.639 23.418 -8.653 631 2HG GLU 88 2HG GLU 88 12.259 22.401 -9.019 632 HE2 GLU 88 HE GLU 88 14.889 20.806 -8.750 633 H GLN 89 H GLN 89 13.323 25.256 -13.239 634 HA GLN 89 HA GLN 89 15.254 23.564 -14.164 635 1HB GLN 89 1HB GLN 89 13.366 24.558 -15.492 636 2HB GLN 89 2HB GLN 89 14.216 26.089 -15.526 637 1HG GLN 89 1HG GLN 89 16.217 24.716 -16.533 638 2HG GLN 89 2HG GLN 89 15.025 23.467 -16.831 639 1HE2 GLN 89 1HE2 GLN 89 13.338 23.809 -18.268 640 2HE2 GLN 89 2HE2 GLN 89 13.350 25.070 -19.456 641 H GLN 90 H GLN 90 15.518 26.873 -12.942 642 HA GLN 90 HA GLN 90 18.089 27.272 -14.103 643 1HB GLN 90 1HB GLN 90 16.180 28.999 -13.311 644 2HB GLN 90 2HB GLN 90 17.092 28.953 -11.816 645 1HG GLN 90 1HG GLN 90 18.840 29.197 -14.184 646 2HG GLN 90 2HG GLN 90 17.691 30.515 -14.069 647 1HE2 GLN 90 1HE2 GLN 90 20.597 29.219 -12.978 648 2HE2 GLN 90 2HE2 GLN 90 20.930 30.287 -11.656 649 H GLN 91 H GLN 91 16.726 25.932 -11.138 650 HA GLN 91 HA GLN 91 19.346 26.004 -9.897 651 1HB GLN 91 1HB GLN 91 17.324 26.745 -8.593 652 2HB GLN 91 2HB GLN 91 16.668 25.126 -8.730 653 1HG GLN 91 1HG GLN 91 18.173 24.227 -7.213 654 2HG GLN 91 2HG GLN 91 19.472 25.300 -7.695 655 1HE2 GLN 91 1HE2 GLN 91 19.958 25.744 -5.549 656 2HE2 GLN 91 2HE2 GLN 91 19.010 26.812 -4.568 657 H ALA 92 H ALA 92 17.919 24.150 -12.148 658 HA ALA 92 HA ALA 92 18.509 21.581 -10.899 659 1HB ALA 92 1HB ALA 92 16.365 22.007 -12.170 660 2HB ALA 92 2HB ALA 92 17.346 22.189 -13.644 661 3HB ALA 92 3HB ALA 92 17.322 20.634 -12.777 662 H LEU 93 H LEU 93 20.683 23.472 -11.379 663 HA LEU 93 HA LEU 93 22.010 22.266 -13.689 664 1HB LEU 93 1HB LEU 93 21.855 24.713 -13.587 665 2HB LEU 93 2HB LEU 93 22.708 24.711 -12.056 666 HG LEU 93 HG LEU 93 24.586 23.471 -13.418 667 1HD1 LEU 93 2HD1 LEU 93 23.011 24.846 -15.610 668 2HD1 LEU 93 3HD1 LEU 93 24.694 24.289 -15.771 669 3HD1 LEU 93 1HD1 LEU 93 23.393 23.113 -15.469 670 1HD2 LEU 93 1HD2 LEU 93 24.131 26.104 -12.607 671 2HD2 LEU 93 2HD2 LEU 93 25.683 25.373 -13.083 672 3HD2 LEU 93 3HD2 LEU 93 24.697 26.234 -14.290 673 H SER 94 H SER 94 21.749 20.347 -11.880 674 HA SER 94 HA SER 94 24.235 20.434 -10.359 675 1HB SER 94 1HB SER 94 23.239 18.784 -8.848 676 2HB SER 94 2HB SER 94 22.175 20.169 -8.986 677 HG SER 94 HG SER 94 21.589 18.286 -10.928 678 H SER 95 H SER 95 22.589 19.092 -13.070 679 HA SER 95 HA SER 95 23.938 16.579 -12.983 680 1HB SER 95 1HB SER 95 22.079 17.959 -14.935 681 2HB SER 95 2HB SER 95 22.952 16.523 -15.433 682 HG SER 95 HG SER 95 20.672 16.446 -14.269 683 H GLN 96 H GLN 96 24.045 19.610 -14.982 684 HA GLN 96 HA GLN 96 26.467 18.654 -16.215 685 1HB GLN 96 1HB GLN 96 24.419 19.995 -17.298 686 2HB GLN 96 2HB GLN 96 25.318 21.392 -16.741 687 1HG GLN 96 1HG GLN 96 27.385 20.193 -17.892 688 2HG GLN 96 2HG GLN 96 26.158 19.286 -18.753 689 1HE2 GLN 96 1HE2 GLN 96 24.745 20.316 -20.158 690 2HE2 GLN 96 2HE2 GLN 96 25.040 21.894 -20.807 691 H MET 97 H MET 97 26.219 19.438 -13.266 692 HA MET 97 HA MET 97 28.682 20.728 -13.103 693 1HB MET 97 1HB MET 97 26.889 22.616 -13.690 694 2HB MET 97 2HB MET 97 26.412 22.446 -12.012 695 1HG MET 97 1HG MET 97 29.355 22.760 -12.596 696 2HG MET 97 2HG MET 97 28.338 24.176 -12.777 697 1HE MET 97 3HE MET 97 27.532 25.603 -10.932 698 2HE MET 97 1HE MET 97 28.388 25.520 -9.374 699 3HE MET 97 2HE MET 97 29.311 25.595 -10.894 700 H GLY 98 H GLY 98 29.113 18.966 -11.694 701 1HA GLY 98 2HA GLY 98 27.455 18.763 -9.276 702 2HA GLY 98 1HA GLY 98 29.163 19.115 -9.107 703 H PHE 99 H PHE 99 30.255 17.300 -8.499 704 HA PHE 99 HA PHE 99 29.675 14.863 -10.019 705 1HB PHE 99 1HB PHE 99 32.040 16.343 -9.265 706 2HB PHE 99 2HB PHE 99 32.079 14.864 -8.325 707 HD1 PHE 99 1HD PHE 99 32.850 16.334 -11.441 708 HD2 PHE 99 2HD PHE 99 31.719 12.651 -9.661 709 HE1 PHE 99 1HE PHE 99 33.760 15.095 -13.426 710 HE2 PHE 99 2HE PHE 99 32.630 11.413 -11.645 711 HZ PHE 99 HZ PHE 99 33.639 12.649 -13.504 712 H MET 601 H MET 601 3.752 -24.115 -17.252 713 HA MET 601 HA MET 601 5.773 -25.312 -16.952 714 1HB MET 601 1HB MET 601 5.703 -24.359 -14.420 715 2HB MET 601 2HB MET 601 4.962 -25.912 -14.089 716 1HG MET 601 1HG MET 601 7.578 -25.691 -15.638 717 2HG MET 601 2HG MET 601 7.550 -25.759 -13.887 718 1HE MET 601 2HE MET 601 8.218 -27.632 -12.932 719 2HE MET 601 3HE MET 601 6.549 -28.078 -12.505 720 3HE MET 601 1HE MET 601 7.651 -29.300 -13.183 721 H THR 602 H THR 602 2.464 -25.723 -15.798 722 HA THR 602 HA THR 602 2.448 -28.551 -15.724 723 HB THR 602 HB THR 602 0.333 -26.360 -15.956 724 HG1 THR 602 1HG THR 602 0.404 -26.702 -13.739 725 1HG2 THR 602 2HG2 THR 602 0.000 -29.183 -16.507 726 2HG2 THR 602 3HG2 THR 602 -0.707 -28.837 -14.910 727 3HG2 THR 602 1HG2 THR 602 -1.266 -27.943 -16.344 728 H GLU 603 H GLU 603 1.578 -26.153 -18.284 729 HA GLU 603 HA GLU 603 2.005 -28.313 -20.170 730 1HB GLU 603 1HB GLU 603 -0.430 -26.477 -20.151 731 2HB GLU 603 2HB GLU 603 -0.009 -27.536 -21.483 732 1HG GLU 603 1HG GLU 603 -0.953 -29.315 -20.441 733 2HG GLU 603 2HG GLU 603 0.049 -29.073 -19.023 734 HE2 GLU 603 HE GLU 603 -2.558 -29.783 -18.505 735 H GLN 604 H GLN 604 3.690 -27.616 -21.410 736 HA GLN 604 HA GLN 604 4.627 -25.084 -21.489 737 1HB GLN 604 1HB GLN 604 5.118 -27.570 -22.860 738 2HB GLN 604 2HB GLN 604 5.144 -26.287 -24.053 739 1HG GLN 604 1HG GLN 604 6.573 -25.153 -21.945 740 2HG GLN 604 2HG GLN 604 7.037 -26.839 -21.838 741 1HE2 GLN 604 1HE2 GLN 604 7.592 -23.905 -23.320 742 2HE2 GLN 604 2HE2 GLN 604 8.565 -24.406 -24.663 743 H GLN 605 H GLN 605 2.169 -26.628 -23.624 744 HA GLN 605 HA GLN 605 1.932 -24.929 -25.625 745 1HB GLN 605 1HB GLN 605 -0.307 -26.119 -23.936 746 2HB GLN 605 2HB GLN 605 -0.596 -25.325 -25.472 747 1HG GLN 605 1HG GLN 605 1.329 -26.991 -26.321 748 2HG GLN 605 2HG GLN 605 0.841 -27.923 -24.919 749 1HE2 GLN 605 1HE2 GLN 605 -0.094 -29.590 -25.961 750 2HE2 GLN 605 2HE2 GLN 605 -1.538 -29.486 -26.913 751 H TRP 606 H TRP 606 1.241 -24.215 -22.223 752 HA TRP 606 HA TRP 606 1.158 -21.422 -22.805 753 1HB TRP 606 1HB TRP 606 -1.354 -22.894 -22.521 754 2HB TRP 606 2HB TRP 606 -1.194 -21.584 -21.368 755 HD1 TRP 606 HD TRP 606 -1.569 -22.191 -25.141 756 HE1 TRP 606 1HE TRP 606 -2.140 -19.958 -26.426 757 HE3 TRP 606 3HE TRP 606 -0.822 -19.098 -21.174 758 HZ2 TRP 606 2HZ TRP 606 -2.214 -17.211 -25.658 759 HZ3 TRP 606 3HZ TRP 606 -1.165 -16.654 -21.527 760 HH2 TRP 606 HH TRP 606 -1.837 -15.700 -23.674 761 H ASN 607 H ASN 607 2.842 -21.143 -21.337 762 HA ASN 607 HA ASN 607 3.123 -22.581 -19.015 763 1HB ASN 607 1HB ASN 607 4.101 -19.813 -19.855 764 2HB ASN 607 2HB ASN 607 4.565 -20.513 -18.317 765 1HD2 ASN 607 1HD2 ASN 607 6.337 -21.659 -18.263 766 2HD2 ASN 607 2HD2 ASN 607 7.122 -22.445 -19.592 767 H PHE 608 H PHE 608 1.147 -22.625 -17.771 768 HA PHE 608 HA PHE 608 -0.475 -20.454 -17.272 769 1HB PHE 608 1HB PHE 608 -1.473 -21.979 -15.720 770 2HB PHE 608 2HB PHE 608 -0.624 -23.069 -16.798 771 HD1 PHE 608 1HD PHE 608 1.967 -23.416 -16.041 772 HD2 PHE 608 2HD PHE 608 -1.263 -22.422 -13.476 773 HE1 PHE 608 1HE PHE 608 3.224 -24.370 -14.089 774 HE2 PHE 608 2HE PHE 608 -0.007 -23.376 -11.524 775 HZ PHE 608 HZ PHE 608 2.222 -24.339 -11.854 776 H ALA 609 H ALA 609 2.711 -21.184 -16.041 777 HA ALA 609 HA ALA 609 2.493 -19.880 -13.552 778 1HB ALA 609 1HB ALA 609 4.728 -20.748 -15.386 779 2HB ALA 609 3HB ALA 609 4.308 -21.339 -13.761 780 3HB ALA 609 2HB ALA 609 5.083 -19.749 -13.956 781 H GLY 610 H GLY 610 2.348 -18.732 -16.781 782 1HA GLY 610 2HA GLY 610 3.045 -16.691 -17.687 783 2HA GLY 610 1HA GLY 610 3.448 -16.101 -16.087 784 H ILE 611 H ILE 611 0.556 -17.357 -17.907 785 HA ILE 611 HA ILE 611 -0.915 -15.039 -17.689 786 HB ILE 611 HB ILE 611 -1.466 -16.724 -19.270 787 1HG1 ILE 611 1HG1 ILE 611 -3.493 -15.907 -17.260 788 2HG1 ILE 611 2HG1 ILE 611 -3.413 -15.584 -18.980 789 1HG2 ILE 611 1HG2 ILE 611 -0.815 -18.571 -17.423 790 2HG2 ILE 611 2HG2 ILE 611 -2.590 -18.656 -17.321 791 3HG2 ILE 611 3HG2 ILE 611 -1.774 -18.927 -18.880 792 1HD1 ILE 611 2HD1 ILE 611 -3.838 -18.195 -19.211 793 2HD1 ILE 611 3HD1 ILE 611 -4.466 -18.030 -17.554 794 3HD1 ILE 611 1HD1 ILE 611 -5.199 -17.096 -18.881 795 H GLU 612 H GLU 612 -0.263 -17.580 -15.324 796 HA GLU 612 HA GLU 612 -2.435 -17.157 -13.675 797 1HB GLU 612 1HB GLU 612 -1.092 -19.095 -13.306 798 2HB GLU 612 2HB GLU 612 0.387 -18.163 -13.190 799 1HG GLU 612 1HG GLU 612 -0.370 -17.155 -11.060 800 2HG GLU 612 2HG GLU 612 -1.915 -17.971 -11.191 801 HE2 GLU 612 HE GLU 612 -0.926 -20.753 -11.704 802 H ALA 613 H ALA 613 0.681 -15.428 -14.021 803 HA ALA 613 HA ALA 613 0.155 -13.803 -11.693 804 1HB ALA 613 2HB ALA 613 2.443 -14.565 -12.316 805 2HB ALA 613 1HB ALA 613 2.313 -12.791 -12.252 806 3HB ALA 613 3HB ALA 613 2.324 -13.626 -13.824 807 H ALA 614 H ALA 614 -0.651 -13.870 -15.070 808 HA ALA 614 HA ALA 614 -0.712 -11.139 -15.628 809 1HB ALA 614 2HB ALA 614 -2.503 -13.366 -16.678 810 2HB ALA 614 3HB ALA 614 -2.184 -11.802 -17.466 811 3HB ALA 614 1HB ALA 614 -0.873 -12.993 -17.286 812 H ALA 615 H ALA 615 -3.222 -13.381 -14.282 813 HA ALA 615 HA ALA 615 -5.244 -11.474 -14.101 814 1HB ALA 615 3HB ALA 615 -6.405 -13.216 -13.222 815 2HB ALA 615 1HB ALA 615 -4.969 -14.174 -13.656 816 3HB ALA 615 2HB ALA 615 -5.158 -13.555 -11.997 817 H SER 616 H SER 616 -2.731 -12.542 -11.716 818 HA SER 616 HA SER 616 -3.566 -11.044 -9.612 819 1HB SER 616 1HB SER 616 -1.332 -12.616 -10.257 820 2HB SER 616 2HB SER 616 -0.634 -11.049 -9.900 821 HG SER 616 HG SER 616 -0.758 -12.031 -7.915 822 H ALA 617 H ALA 617 -1.764 -10.078 -12.544 823 HA ALA 617 HA ALA 617 -0.981 -7.536 -11.577 824 1HB ALA 617 2HB ALA 617 -0.703 -9.160 -13.947 825 2HB ALA 617 1HB ALA 617 0.260 -7.753 -13.436 826 3HB ALA 617 3HB ALA 617 -1.208 -7.518 -14.414 827 H ILE 618 H ILE 618 -3.768 -8.781 -13.513 828 HA ILE 618 HA ILE 618 -4.915 -6.348 -14.116 829 HB ILE 618 HB ILE 618 -6.187 -9.032 -13.577 830 1HG1 ILE 618 1HG1 ILE 618 -4.511 -9.119 -15.336 831 2HG1 ILE 618 2HG1 ILE 618 -6.119 -9.297 -16.009 832 1HG2 ILE 618 1HG2 ILE 618 -7.333 -6.564 -14.910 833 2HG2 ILE 618 2HG2 ILE 618 -8.070 -8.184 -14.948 834 3HG2 ILE 618 3HG2 ILE 618 -7.885 -7.327 -13.399 835 1HD1 ILE 618 1HD1 ILE 618 -5.956 -6.638 -16.269 836 2HD1 ILE 618 2HD1 ILE 618 -4.209 -6.978 -16.229 837 3HD1 ILE 618 3HD1 ILE 618 -5.232 -7.724 -17.479 838 H GLN 619 H GLN 619 -5.221 -8.400 -11.163 839 HA GLN 619 HA GLN 619 -7.189 -6.934 -9.945 840 1HB GLN 619 1HB GLN 619 -5.235 -8.973 -9.198 841 2HB GLN 619 2HB GLN 619 -5.457 -7.832 -7.886 842 1HG GLN 619 1HG GLN 619 -7.771 -9.185 -9.351 843 2HG GLN 619 2HG GLN 619 -7.069 -9.806 -7.871 844 1HE2 GLN 619 1HE2 GLN 619 -9.674 -8.392 -8.863 845 2HE2 GLN 619 2HE2 GLN 619 -10.044 -7.271 -7.595 846 H GLY 620 H GLY 620 -3.608 -6.729 -9.291 847 1HA GLY 620 2HA GLY 620 -2.318 -5.011 -8.635 848 2HA GLY 620 1HA GLY 620 -3.688 -4.467 -7.687 849 H ASN 621 H ASN 621 -3.724 -4.819 -11.259 850 HA ASN 621 HA ASN 621 -3.143 -2.104 -11.717 851 1HB ASN 621 1HB ASN 621 -4.259 -4.377 -13.412 852 2HB ASN 621 2HB ASN 621 -4.170 -2.753 -14.065 853 1HD2 ASN 621 1HD2 ASN 621 -2.007 -1.630 -13.649 854 2HD2 ASN 621 2HD2 ASN 621 -0.575 -2.545 -13.982 855 H VAL 622 H VAL 622 -6.048 -4.113 -11.192 856 HA VAL 622 HA VAL 622 -7.945 -2.309 -12.213 857 HB VAL 622 HB VAL 622 -8.003 -4.621 -10.290 858 1HG1 VAL 622 3HG1 VAL 622 -10.212 -2.686 -10.945 859 2HG1 VAL 622 1HG1 VAL 622 -10.586 -4.400 -10.645 860 3HG1 VAL 622 2HG1 VAL 622 -9.780 -3.432 -9.388 861 1HG2 VAL 622 2HG2 VAL 622 -7.878 -4.544 -13.016 862 2HG2 VAL 622 3HG2 VAL 622 -8.582 -5.879 -12.073 863 3HG2 VAL 622 1HG2 VAL 622 -9.637 -4.618 -12.753 864 H THR 623 H THR 623 -6.849 -2.991 -8.813 865 HA THR 623 HA THR 623 -8.330 -0.858 -7.712 866 HB THR 623 HB THR 623 -6.778 -1.359 -5.735 867 HG1 THR 623 1HG THR 623 -5.389 -3.302 -6.297 868 1HG2 THR 623 3HG2 THR 623 -8.867 -2.850 -6.496 869 2HG2 THR 623 1HG2 THR 623 -7.597 -4.015 -6.941 870 3HG2 THR 623 2HG2 THR 623 -7.743 -3.458 -5.257 871 H SER 624 H SER 624 -5.122 -1.075 -9.226 872 HA SER 624 HA SER 624 -4.022 1.201 -8.201 873 1HB SER 624 1HB SER 624 -3.670 -0.463 -10.635 874 2HB SER 624 2HB SER 624 -3.111 1.188 -10.818 875 HG SER 624 HG SER 624 -2.107 0.613 -8.512 876 H ILE 625 H ILE 625 -6.303 0.751 -10.960 877 HA ILE 625 HA ILE 625 -6.242 3.501 -11.693 878 HB ILE 625 HB ILE 625 -7.650 1.037 -12.525 879 1HG1 ILE 625 1HG1 ILE 625 -7.112 2.626 -14.729 880 2HG1 ILE 625 2HG1 ILE 625 -5.819 3.048 -13.623 881 1HG2 ILE 625 3HG2 ILE 625 -8.908 3.748 -12.639 882 2HG2 ILE 625 1HG2 ILE 625 -9.098 2.649 -14.027 883 3HG2 ILE 625 2HG2 ILE 625 -9.650 2.146 -12.411 884 1HD1 ILE 625 2HD1 ILE 625 -6.576 0.156 -14.214 885 2HD1 ILE 625 3HD1 ILE 625 -5.356 1.050 -15.154 886 3HD1 ILE 625 1HD1 ILE 625 -5.101 0.754 -13.417 887 H HIS 626 H HIS 626 -8.178 1.435 -9.517 888 HA HIS 626 HA HIS 626 -10.285 3.215 -9.150 889 1HB HIS 626 1HB HIS 626 -10.073 0.745 -8.496 890 2HB HIS 626 2HB HIS 626 -9.227 1.299 -7.066 891 HD1 HIS 626 1HD HIS 626 -11.329 0.159 -5.788 892 HD2 HIS 626 2HD HIS 626 -12.148 3.639 -7.981 893 HE1 HIS 626 1HE HIS 626 -13.588 1.009 -4.961 894 H SER 627 H SER 627 -7.141 2.800 -7.410 895 HA SER 627 HA SER 627 -7.754 4.915 -5.630 896 1HB SER 627 1HB SER 627 -5.394 3.132 -6.174 897 2HB SER 627 2HB SER 627 -5.092 4.624 -5.306 898 HG SER 627 HG SER 627 -6.818 2.438 -4.555 899 H LEU 628 H LEU 628 -5.923 4.487 -8.686 900 HA LEU 628 HA LEU 628 -4.539 6.882 -8.693 901 1HB LEU 628 1HB LEU 628 -5.417 4.877 -10.678 902 2HB LEU 628 2HB LEU 628 -5.051 6.466 -11.320 903 HG LEU 628 HG LEU 628 -3.068 5.186 -9.476 904 1HD1 LEU 628 3HD1 LEU 628 -3.980 3.972 -11.938 905 2HD1 LEU 628 1HD1 LEU 628 -2.268 4.444 -12.056 906 3HD1 LEU 628 2HD1 LEU 628 -2.809 3.377 -10.737 907 1HD2 LEU 628 2HD2 LEU 628 -2.855 7.535 -10.368 908 2HD2 LEU 628 3HD2 LEU 628 -1.472 6.461 -10.685 909 3HD2 LEU 628 1HD2 LEU 628 -2.636 6.821 -11.983 910 H LEU 629 H LEU 629 -7.864 6.103 -9.898 911 HA LEU 629 HA LEU 629 -8.372 8.720 -10.794 912 1HB LEU 629 1HB LEU 629 -9.770 6.183 -10.543 913 2HB LEU 629 2HB LEU 629 -10.817 7.542 -10.184 914 HG LEU 629 HG LEU 629 -9.316 8.143 -12.559 915 1HD1 LEU 629 3HD1 LEU 629 -10.665 5.435 -12.542 916 2HD1 LEU 629 1HD1 LEU 629 -10.292 6.350 -14.023 917 3HD1 LEU 629 2HD1 LEU 629 -8.975 5.819 -12.950 918 1HD2 LEU 629 2HD2 LEU 629 -11.636 8.912 -11.662 919 2HD2 LEU 629 3HD2 LEU 629 -11.378 8.743 -13.415 920 3HD2 LEU 629 1HD2 LEU 629 -12.244 7.474 -12.516 921 H ASP 630 H ASP 630 -8.680 7.059 -7.649 922 HA ASP 630 HA ASP 630 -10.321 8.937 -6.454 923 1HB ASP 630 1HB ASP 630 -9.770 6.675 -5.528 924 2HB ASP 630 2HB ASP 630 -8.128 7.204 -5.220 925 HD2 ASP 630 HD ASP 630 -7.952 8.181 -2.935 926 H GLU 631 H GLU 631 -6.796 8.730 -7.050 927 HA GLU 631 HA GLU 631 -6.173 10.868 -5.294 928 1HB GLU 631 1HB GLU 631 -4.671 9.175 -7.281 929 2HB GLU 631 2HB GLU 631 -3.944 10.688 -6.780 930 1HG GLU 631 1HG GLU 631 -4.773 8.360 -4.995 931 2HG GLU 631 2HG GLU 631 -3.150 8.958 -5.272 932 HE2 GLU 631 HE GLU 631 -2.888 11.216 -4.664 933 H GLY 632 H GLY 632 -6.824 10.446 -8.794 934 1HA GLY 632 2HA GLY 632 -6.923 11.935 -10.494 935 2HA GLY 632 1HA GLY 632 -6.026 13.092 -9.530 936 H LYS 633 H LYS 633 -9.106 11.458 -8.602 937 HA LYS 633 HA LYS 633 -10.862 13.426 -9.400 938 1HB LYS 633 1HB LYS 633 -11.226 11.031 -8.426 939 2HB LYS 633 2HB LYS 633 -11.268 11.840 -6.873 940 1HG LYS 633 1HG LYS 633 -13.549 11.718 -7.684 941 2HG LYS 633 2HG LYS 633 -13.051 13.395 -7.781 942 1HD LYS 633 1HD LYS 633 -12.261 12.341 -10.264 943 2HD LYS 633 2HD LYS 633 -13.783 11.532 -9.949 944 1HE LYS 633 1HE LYS 633 -14.375 14.144 -9.205 945 2HE LYS 633 2HE LYS 633 -13.253 14.400 -10.527 946 H GLN 634 H GLN 634 -8.735 13.219 -6.532 947 HA GLN 634 HA GLN 634 -9.951 15.385 -5.221 948 1HB GLN 634 1HB GLN 634 -7.274 13.977 -4.924 949 2HB GLN 634 2HB GLN 634 -7.694 15.355 -3.926 950 1HG GLN 634 1HG GLN 634 -9.902 14.054 -3.394 951 2HG GLN 634 2HG GLN 634 -9.089 12.656 -4.068 952 1HE2 GLN 634 1HE2 GLN 634 -9.805 14.171 -1.297 953 2HE2 GLN 634 2HE2 GLN 634 -8.500 13.678 -0.269 954 H SER 635 H SER 635 -7.807 15.111 -7.937 955 HA SER 635 HA SER 635 -6.723 17.746 -7.524 956 1HB SER 635 1HB SER 635 -5.887 15.394 -8.903 957 2HB SER 635 2HB SER 635 -6.145 16.609 -10.139 958 HG SER 635 HG SER 635 -3.949 16.521 -9.079 959 H LEU 636 H LEU 636 -9.269 16.047 -9.295 960 HA LEU 636 HA LEU 636 -9.684 17.768 -11.405 961 1HB LEU 636 1HB LEU 636 -11.126 15.675 -9.997 962 2HB LEU 636 2HB LEU 636 -12.208 16.921 -10.587 963 HG LEU 636 HG LEU 636 -11.805 14.936 -12.111 964 1HD1 LEU 636 2HD1 LEU 636 -11.304 17.744 -13.128 965 2HD1 LEU 636 3HD1 LEU 636 -11.678 16.348 -14.166 966 3HD1 LEU 636 1HD1 LEU 636 -12.867 16.908 -12.965 967 1HD2 LEU 636 1HD2 LEU 636 -9.343 14.825 -11.694 968 2HD2 LEU 636 2HD2 LEU 636 -9.801 14.811 -13.414 969 3HD2 LEU 636 3HD2 LEU 636 -9.161 16.299 -12.675 970 H THR 637 H THR 637 -10.774 17.980 -7.977 971 HA THR 637 HA THR 637 -12.327 20.322 -8.413 972 HB THR 637 HB THR 637 -13.025 19.275 -6.471 973 HG1 THR 637 1HG THR 637 -10.577 20.478 -5.418 974 1HG2 THR 637 2HG2 THR 637 -10.131 18.341 -6.265 975 2HG2 THR 637 3HG2 THR 637 -11.232 18.219 -4.871 976 3HG2 THR 637 1HG2 THR 637 -11.605 17.349 -6.378 977 H LYS 638 H LYS 638 -9.196 19.892 -6.621 978 HA LYS 638 HA LYS 638 -8.667 22.581 -6.390 979 1HB LYS 638 1HB LYS 638 -6.277 21.821 -6.125 980 2HB LYS 638 2HB LYS 638 -7.443 21.043 -5.075 981 1HG LYS 638 1HG LYS 638 -7.589 19.189 -6.907 982 2HG LYS 638 2HG LYS 638 -6.137 19.905 -7.577 983 1HD LYS 638 1HD LYS 638 -5.425 19.721 -4.920 984 2HD LYS 638 2HD LYS 638 -6.492 18.339 -5.060 985 1HE LYS 638 1HE LYS 638 -5.089 17.215 -6.538 986 2HE LYS 638 2HE LYS 638 -4.493 18.691 -7.271 987 H LEU 639 H LEU 639 -8.635 20.533 -9.213 988 HA LEU 639 HA LEU 639 -6.994 22.460 -10.664 989 1HB LEU 639 1HB LEU 639 -8.020 19.710 -11.369 990 2HB LEU 639 2HB LEU 639 -7.151 20.746 -12.484 991 HG LEU 639 HG LEU 639 -6.012 19.828 -9.833 992 1HD1 LEU 639 1HD1 LEU 639 -6.602 17.977 -11.518 993 2HD1 LEU 639 2HD1 LEU 639 -5.279 18.643 -12.505 994 3HD1 LEU 639 3HD1 LEU 639 -4.945 18.027 -10.869 995 1HD2 LEU 639 3HD2 LEU 639 -4.737 21.105 -12.267 996 2HD2 LEU 639 1HD2 LEU 639 -4.964 21.840 -10.662 997 3HD2 LEU 639 2HD2 LEU 639 -3.853 20.464 -10.861 998 H ALA 640 H ALA 640 -10.291 21.577 -9.991 999 HA ALA 640 HA ALA 640 -11.631 22.149 -12.278 1000 1HB ALA 640 1HB ALA 640 -13.502 22.660 -10.855 1001 2HB ALA 640 2HB ALA 640 -12.530 21.428 -10.016 1002 3HB ALA 640 3HB ALA 640 -12.431 23.133 -9.514 1003 H ALA 641 H ALA 641 -10.096 24.433 -9.962 1004 HA ALA 641 HA ALA 641 -11.156 26.786 -10.930 1005 1HB ALA 641 3HB ALA 641 -9.617 27.760 -9.543 1006 2HB ALA 641 1HB ALA 641 -9.432 26.087 -8.964 1007 3HB ALA 641 2HB ALA 641 -8.278 26.752 -10.144 1008 H ALA 642 H ALA 642 -8.647 24.634 -12.257 1009 HA ALA 642 HA ALA 642 -7.496 26.436 -14.047 1010 1HB ALA 642 1HB ALA 642 -6.837 24.014 -13.280 1011 2HB ALA 642 3HB ALA 642 -6.442 24.545 -14.932 1012 3HB ALA 642 2HB ALA 642 -7.853 23.498 -14.647 1013 H TRP 643 H TRP 643 -10.663 25.010 -13.917 1014 HA TRP 643 HA TRP 643 -11.074 25.399 -16.778 1015 1HB TRP 643 1HB TRP 643 -12.618 24.034 -14.592 1016 2HB TRP 643 2HB TRP 643 -13.399 24.482 -16.095 1017 HD1 TRP 643 HD TRP 643 -12.874 22.948 -18.226 1018 HE1 TRP 643 1HE TRP 643 -11.574 20.697 -18.680 1019 HE3 TRP 643 3HE TRP 643 -10.496 22.802 -13.734 1020 HZ2 TRP 643 2HZ TRP 643 -9.739 19.142 -17.143 1021 HZ3 TRP 643 3HZ TRP 643 -8.967 20.883 -13.291 1022 HH2 TRP 643 HH TRP 643 -8.572 19.094 -14.908 1023 H GLY 644 H GLY 644 -11.226 27.057 -13.775 1024 1HA GLY 644 2HA GLY 644 -13.287 28.911 -14.805 1025 2HA GLY 644 1HA GLY 644 -11.741 29.475 -14.206 1026 H GLY 645 H GLY 645 -12.663 26.657 -12.501 1027 1HA GLY 645 2HA GLY 645 -14.331 28.018 -10.545 1028 2HA GLY 645 1HA GLY 645 -12.715 27.602 -10.010 1029 H SER 646 H SER 646 -14.700 26.410 -8.615 1030 HA SER 646 HA SER 646 -14.739 23.717 -9.738 1031 1HB SER 646 1HB SER 646 -14.995 23.126 -7.166 1032 2HB SER 646 2HB SER 646 -13.413 23.442 -7.849 1033 HG SER 646 HG SER 646 -14.291 24.626 -5.760 1034 H GLY 647 H GLY 647 -16.796 24.682 -10.793 1035 1HA GLY 647 2HA GLY 647 -19.027 25.331 -9.157 1036 2HA GLY 647 1HA GLY 647 -19.076 23.642 -9.622 1037 H SER 648 H SER 648 -17.550 26.179 -11.636 1038 HA SER 648 HA SER 648 -19.686 26.910 -13.146 1039 1HB SER 648 1HB SER 648 -16.749 26.924 -13.417 1040 2HB SER 648 2HB SER 648 -17.560 26.836 -14.968 1041 HG SER 648 HG SER 648 -17.632 28.900 -12.996 1042 H GLU 649 H GLU 649 -20.602 26.162 -15.158 1043 HA GLU 649 HA GLU 649 -21.012 23.499 -15.354 1044 1HB GLU 649 1HB GLU 649 -21.806 23.989 -17.696 1045 2HB GLU 649 2HB GLU 649 -22.451 25.082 -16.487 1046 1HG GLU 649 1HG GLU 649 -20.108 26.382 -17.227 1047 2HG GLU 649 2HG GLU 649 -20.593 25.639 -18.739 1048 HE2 GLU 649 HE GLU 649 -22.405 28.042 -16.405 1049 H ALA 650 H ALA 650 -18.395 25.475 -16.795 1050 HA ALA 650 HA ALA 650 -17.413 23.738 -18.665 1051 1HB ALA 650 3HB ALA 650 -16.481 26.025 -17.096 1052 2HB ALA 650 2HB ALA 650 -16.124 25.583 -18.783 1053 3HB ALA 650 1HB ALA 650 -15.164 24.884 -17.457 1054 H TYR 651 H TYR 651 -15.959 24.072 -15.352 1055 HA TYR 651 HA TYR 651 -14.520 21.742 -15.423 1056 1HB TYR 651 1HB TYR 651 -14.152 23.287 -13.622 1057 2HB TYR 651 2HB TYR 651 -15.868 23.525 -13.358 1058 HD1 TYR 651 1HD TYR 651 -13.417 20.675 -13.190 1059 HD2 TYR 651 2HD TYR 651 -16.704 22.713 -11.361 1060 HE1 TYR 651 1HE TYR 651 -13.350 19.047 -11.238 1061 HE2 TYR 651 2HE TYR 651 -16.626 21.079 -9.415 1062 HH TYR 651 HH TYR 651 -15.819 19.143 -8.726 1063 H GLN 652 H GLN 652 -17.981 22.250 -14.645 1064 HA GLN 652 HA GLN 652 -18.444 19.822 -13.443 1065 1HB GLN 652 1HB GLN 652 -20.218 21.663 -15.087 1066 2HB GLN 652 2HB GLN 652 -20.847 20.208 -14.340 1067 1HG GLN 652 1HG GLN 652 -19.306 21.555 -12.332 1068 2HG GLN 652 2HG GLN 652 -20.285 22.780 -13.114 1069 1HE2 GLN 652 1HE2 GLN 652 -21.180 22.778 -10.881 1070 2HE2 GLN 652 2HE2 GLN 652 -22.522 21.740 -10.530 1071 H GLY 653 H GLY 653 -18.818 20.776 -16.932 1072 1HA GLY 653 2HA GLY 653 -18.769 19.553 -18.815 1073 2HA GLY 653 1HA GLY 653 -19.648 18.326 -17.925 1074 H VAL 654 H VAL 654 -16.479 19.361 -16.735 1075 HA VAL 654 HA VAL 654 -15.064 17.297 -18.144 1076 HB VAL 654 HB VAL 654 -14.369 19.352 -16.057 1077 1HG1 VAL 654 2HG1 VAL 654 -13.109 17.231 -15.614 1078 2HG1 VAL 654 3HG1 VAL 654 -12.430 17.348 -17.255 1079 3HG1 VAL 654 1HG1 VAL 654 -12.077 18.613 -16.053 1080 1HG2 VAL 654 3HG2 VAL 654 -14.522 19.432 -18.844 1081 2HG2 VAL 654 1HG2 VAL 654 -13.714 20.612 -17.785 1082 3HG2 VAL 654 2HG2 VAL 654 -12.783 19.274 -18.501 1083 H GLN 655 H GLN 655 -16.200 17.941 -14.770 1084 HA GLN 655 HA GLN 655 -15.099 15.787 -13.560 1085 1HB GLN 655 1HB GLN 655 -17.375 17.589 -13.077 1086 2HB GLN 655 2HB GLN 655 -17.637 16.002 -12.381 1087 1HG GLN 655 1HG GLN 655 -14.891 16.865 -11.886 1088 2HG GLN 655 2HG GLN 655 -16.012 18.097 -11.341 1089 1HE2 GLN 655 1HE2 GLN 655 -14.480 16.805 -9.540 1090 2HE2 GLN 655 2HE2 GLN 655 -15.417 15.738 -8.548 1091 H GLN 656 H GLN 656 -18.210 15.966 -15.398 1092 HA GLN 656 HA GLN 656 -18.938 13.332 -14.880 1093 1HB GLN 656 1HB GLN 656 -19.791 15.516 -16.715 1094 2HB GLN 656 2HB GLN 656 -20.167 13.899 -17.278 1095 1HG GLN 656 1HG GLN 656 -22.001 14.023 -15.933 1096 2HG GLN 656 2HG GLN 656 -20.897 13.744 -14.601 1097 1HE2 GLN 656 1HE2 GLN 656 -21.384 16.538 -16.750 1098 2HE2 GLN 656 2HE2 GLN 656 -21.740 17.704 -15.520 1099 H LYS 657 H LYS 657 -16.893 14.871 -17.382 1100 HA LYS 657 HA LYS 657 -16.754 12.607 -19.061 1101 1HB LYS 657 1HB LYS 657 -15.086 15.110 -18.765 1102 2HB LYS 657 2HB LYS 657 -14.686 13.860 -19.926 1103 1HG LYS 657 1HG LYS 657 -16.879 14.084 -21.013 1104 2HG LYS 657 2HG LYS 657 -17.430 15.191 -19.772 1105 1HD LYS 657 1HD LYS 657 -15.245 16.572 -20.521 1106 2HD LYS 657 2HD LYS 657 -15.462 15.671 -22.008 1107 1HE LYS 657 1HE LYS 657 -17.967 16.444 -21.871 1108 2HE LYS 657 2HE LYS 657 -17.399 17.613 -20.695 1109 H TRP 658 H TRP 658 -15.029 13.675 -16.133 1110 HA TRP 658 HA TRP 658 -12.900 11.817 -16.417 1111 1HB TRP 658 1HB TRP 658 -12.573 13.806 -15.135 1112 2HB TRP 658 2HB TRP 658 -13.936 13.443 -14.095 1113 HD1 TRP 658 HD TRP 658 -13.437 11.901 -11.983 1114 HE1 TRP 658 1HE TRP 658 -11.329 10.730 -10.911 1115 HE3 TRP 658 3HE TRP 658 -10.348 12.650 -15.952 1116 HZ2 TRP 658 2HZ TRP 658 -8.666 10.259 -11.822 1117 HZ3 TRP 658 3HZ TRP 658 -8.009 11.804 -15.779 1118 HH2 TRP 658 HH TRP 658 -7.155 10.644 -13.804 1119 H ASP 659 H ASP 659 -15.866 11.985 -14.309 1120 HA ASP 659 HA ASP 659 -15.528 9.451 -13.263 1121 1HB ASP 659 1HB ASP 659 -17.243 11.546 -12.833 1122 2HB ASP 659 2HB ASP 659 -18.320 10.457 -13.684 1123 HD2 ASP 659 HD ASP 659 -19.213 10.698 -11.240 1124 H ALA 660 H ALA 660 -16.940 10.701 -16.285 1125 HA ALA 660 HA ALA 660 -18.601 8.632 -17.012 1126 1HB ALA 660 3HB ALA 660 -18.698 10.510 -18.379 1127 2HB ALA 660 1HB ALA 660 -16.927 10.667 -18.471 1128 3HB ALA 660 2HB ALA 660 -17.758 9.396 -19.400 1129 H THR 661 H THR 661 -15.580 8.964 -18.892 1130 HA THR 661 HA THR 661 -15.336 6.283 -19.443 1131 HB THR 661 HB THR 661 -13.057 6.926 -20.169 1132 HG1 THR 661 1HG THR 661 -12.735 8.149 -18.080 1133 1HG2 THR 661 2HG2 THR 661 -15.214 8.057 -21.265 1134 2HG2 THR 661 3HG2 THR 661 -14.605 9.519 -20.453 1135 3HG2 THR 661 1HG2 THR 661 -13.594 8.683 -21.656 1136 H ALA 662 H ALA 662 -14.581 7.988 -16.469 1137 HA ALA 662 HA ALA 662 -12.648 6.339 -15.408 1138 1HB ALA 662 3HB ALA 662 -13.077 8.233 -14.149 1139 2HB ALA 662 2HB ALA 662 -13.971 7.020 -13.200 1140 3HB ALA 662 1HB ALA 662 -14.842 8.086 -14.329 1141 H THR 663 H THR 663 -15.991 6.149 -14.093 1142 HA THR 663 HA THR 663 -15.837 3.591 -13.189 1143 HB THR 663 HB THR 663 -17.714 4.885 -12.526 1144 HG1 THR 663 1HG THR 663 -19.314 3.403 -13.139 1145 1HG2 THR 663 3HG2 THR 663 -17.624 5.834 -15.290 1146 2HG2 THR 663 1HG2 THR 663 -19.266 5.276 -14.889 1147 3HG2 THR 663 2HG2 THR 663 -18.489 6.537 -13.902 1148 H GLU 664 H GLU 664 -16.251 4.669 -16.540 1149 HA GLU 664 HA GLU 664 -17.259 2.305 -17.548 1150 1HB GLU 664 1HB GLU 664 -17.237 4.390 -18.835 1151 2HB GLU 664 2HB GLU 664 -15.485 4.422 -18.837 1152 1HG GLU 664 1HG GLU 664 -16.148 3.545 -20.982 1153 2HG GLU 664 2HG GLU 664 -15.517 2.189 -20.069 1154 HE2 GLU 664 HE GLU 664 -18.514 3.834 -20.511 1155 H LEU 665 H LEU 665 -13.839 3.463 -17.195 1156 HA LEU 665 HA LEU 665 -12.813 0.972 -18.172 1157 1HB LEU 665 1HB LEU 665 -11.797 3.272 -18.472 1158 2HB LEU 665 2HB LEU 665 -11.324 3.198 -16.786 1159 HG LEU 665 HG LEU 665 -9.457 2.600 -18.194 1160 1HD1 LEU 665 1HD1 LEU 665 -10.075 1.326 -15.979 1161 2HD1 LEU 665 2HD1 LEU 665 -10.259 -0.060 -17.080 1162 3HD1 LEU 665 3HD1 LEU 665 -8.704 0.801 -16.986 1163 1HD2 LEU 665 3HD2 LEU 665 -10.796 1.827 -20.142 1164 2HD2 LEU 665 1HD2 LEU 665 -9.449 0.741 -19.721 1165 3HD2 LEU 665 2HD2 LEU 665 -11.116 0.306 -19.273 1166 H ASN 666 H ASN 666 -13.555 2.495 -15.037 1167 HA ASN 666 HA ASN 666 -12.051 0.814 -13.456 1168 1HB ASN 666 1HB ASN 666 -13.899 2.910 -13.075 1169 2HB ASN 666 2HB ASN 666 -14.676 1.547 -12.295 1170 1HD2 ASN 666 1HD2 ASN 666 -11.799 3.547 -12.431 1171 2HD2 ASN 666 2HD2 ASN 666 -11.188 3.204 -10.847 1172 H ASN 667 H ASN 667 -15.494 0.653 -14.610 1173 HA ASN 667 HA ASN 667 -16.130 -1.683 -13.269 1174 1HB ASN 667 1HB ASN 667 -17.237 -0.528 -15.883 1175 2HB ASN 667 2HB ASN 667 -18.001 -1.830 -14.994 1176 1HD2 ASN 667 1HD2 ASN 667 -18.705 1.035 -15.666 1177 2HD2 ASN 667 2HD2 ASN 667 -19.213 1.750 -14.172 1178 H ALA 668 H ALA 668 -15.120 -1.019 -16.706 1179 HA ALA 668 HA ALA 668 -15.182 -3.576 -17.682 1180 1HB ALA 668 1HB ALA 668 -14.578 -1.177 -18.697 1181 2HB ALA 668 2HB ALA 668 -12.916 -1.768 -18.456 1182 3HB ALA 668 3HB ALA 668 -14.046 -2.684 -19.482 1183 H LEU 669 H LEU 669 -12.709 -1.952 -15.647 1184 HA LEU 669 HA LEU 669 -10.789 -4.000 -15.893 1185 1HB LEU 669 1HB LEU 669 -11.170 -1.519 -14.407 1186 2HB LEU 669 2HB LEU 669 -10.349 -2.745 -13.462 1187 HG LEU 669 HG LEU 669 -9.436 -2.039 -16.251 1188 1HD1 LEU 669 1HD1 LEU 669 -9.599 -0.018 -14.661 1189 2HD1 LEU 669 2HD1 LEU 669 -8.249 -0.780 -13.785 1190 3HD1 LEU 669 3HD1 LEU 669 -8.055 -0.320 -15.494 1191 1HD2 LEU 669 2HD2 LEU 669 -8.705 -4.122 -14.756 1192 2HD2 LEU 669 3HD2 LEU 669 -7.568 -3.258 -15.819 1193 3HD2 LEU 669 1HD2 LEU 669 -7.598 -2.907 -14.074 1194 H GLN 670 H GLN 670 -13.438 -3.319 -13.536 1195 HA GLN 670 HA GLN 670 -12.785 -5.401 -11.826 1196 1HB GLN 670 1HB GLN 670 -15.134 -3.625 -12.301 1197 2HB GLN 670 2HB GLN 670 -15.494 -5.132 -11.482 1198 1HG GLN 670 1HG GLN 670 -13.103 -4.143 -10.275 1199 2HG GLN 670 2HG GLN 670 -14.162 -2.757 -10.441 1200 1HE2 GLN 670 1HE2 GLN 670 -13.540 -3.556 -7.979 1201 2HE2 GLN 670 2HE2 GLN 670 -14.873 -4.316 -7.174 1202 H ASN 671 H ASN 671 -15.202 -5.203 -14.532 1203 HA ASN 671 HA ASN 671 -16.115 -7.782 -14.274 1204 1HB ASN 671 1HB ASN 671 -16.682 -5.631 -15.912 1205 2HB ASN 671 2HB ASN 671 -15.887 -6.692 -17.058 1206 1HD2 ASN 671 1HD2 ASN 671 -17.075 -8.127 -18.051 1207 2HD2 ASN 671 2HD2 ASN 671 -18.606 -8.758 -17.543 1208 H LEU 672 H LEU 672 -13.176 -6.392 -15.702 1209 HA LEU 672 HA LEU 672 -12.540 -8.667 -17.302 1210 1HB LEU 672 1HB LEU 672 -11.768 -6.544 -18.007 1211 2HB LEU 672 2HB LEU 672 -11.046 -6.196 -16.448 1212 HG LEU 672 HG LEU 672 -9.698 -8.477 -17.183 1213 1HD1 LEU 672 3HD1 LEU 672 -10.669 -7.122 -19.640 1214 2HD1 LEU 672 1HD1 LEU 672 -8.955 -7.598 -19.608 1215 3HD1 LEU 672 2HD1 LEU 672 -10.223 -8.822 -19.357 1216 1HD2 LEU 672 3HD2 LEU 672 -9.150 -5.750 -16.698 1217 2HD2 LEU 672 1HD2 LEU 672 -8.014 -7.120 -16.698 1218 3HD2 LEU 672 2HD2 LEU 672 -8.285 -6.188 -18.191 1219 H ALA 673 H ALA 673 -11.386 -7.326 -14.137 1220 HA ALA 673 HA ALA 673 -9.643 -9.501 -13.664 1221 1HB ALA 673 1HB ALA 673 -10.161 -6.974 -12.576 1222 2HB ALA 673 2HB ALA 673 -10.618 -8.108 -11.282 1223 3HB ALA 673 3HB ALA 673 -8.980 -8.163 -11.976 1224 H ARG 674 H ARG 674 -13.089 -9.077 -13.490 1225 HA ARG 674 HA ARG 674 -13.545 -10.876 -11.392 1226 1HB ARG 674 1HB ARG 674 -15.205 -9.591 -13.565 1227 2HB ARG 674 2HB ARG 674 -15.895 -10.968 -12.728 1228 1HG ARG 674 1HG ARG 674 -14.759 -9.302 -10.701 1229 2HG ARG 674 2HG ARG 674 -15.601 -8.224 -11.796 1230 1HD ARG 674 1HD ARG 674 -16.820 -10.715 -10.506 1231 2HD ARG 674 2HD ARG 674 -17.096 -9.069 -9.973 1232 HE ARG 674 HE ARG 674 -17.779 -8.982 -12.657 1233 2HH1 ARG 674 1HH ARG 674 -20.986 -10.315 -12.681 1234 1HH2 ARG 674 2HH2 ARG 674 -18.791 -11.024 -9.944 1235 2HH2 ARG 674 1HH2 ARG 674 -20.375 -11.307 -10.587 1236 H THR 675 H THR 675 -13.077 -11.145 -14.920 1237 HA THR 675 HA THR 675 -13.619 -14.032 -14.746 1238 HB THR 675 HB THR 675 -13.486 -12.159 -17.168 1239 HG1 THR 675 1HG THR 675 -15.246 -11.979 -15.409 1240 1HG2 THR 675 3HG2 THR 675 -13.254 -14.882 -17.242 1241 2HG2 THR 675 1HG2 THR 675 -15.024 -14.739 -17.121 1242 3HG2 THR 675 2HG2 THR 675 -14.159 -13.965 -18.471 1243 H ILE 676 H ILE 676 -11.114 -11.748 -14.672 1244 HA ILE 676 HA ILE 676 -9.261 -13.544 -16.033 1245 HB ILE 676 HB ILE 676 -9.194 -10.675 -15.176 1246 1HG1 ILE 676 1HG1 ILE 676 -8.833 -12.185 -17.766 1247 2HG1 ILE 676 2HG1 ILE 676 -10.053 -10.995 -17.359 1248 1HG2 ILE 676 2HG2 ILE 676 -6.934 -12.521 -15.151 1249 2HG2 ILE 676 3HG2 ILE 676 -6.691 -11.148 -16.258 1250 3HG2 ILE 676 1HG2 ILE 676 -7.065 -10.853 -14.542 1251 1HD1 ILE 676 1HD1 ILE 676 -7.903 -9.432 -16.960 1252 2HD1 ILE 676 2HD1 ILE 676 -7.168 -10.585 -18.100 1253 3HD1 ILE 676 3HD1 ILE 676 -8.606 -9.653 -18.580 1254 H SER 677 H SER 677 -9.622 -11.773 -12.881 1255 HA SER 677 HA SER 677 -7.539 -12.797 -11.566 1256 1HB SER 677 1HB SER 677 -9.143 -11.153 -10.630 1257 2HB SER 677 2HB SER 677 -10.361 -12.403 -10.475 1258 HG SER 677 HG SER 677 -8.858 -11.766 -8.547 1259 H GLU 678 H GLU 678 -10.497 -14.477 -12.568 1260 HA GLU 678 HA GLU 678 -10.305 -16.625 -10.811 1261 1HB GLU 678 1HB GLU 678 -11.656 -17.778 -12.766 1262 2HB GLU 678 2HB GLU 678 -12.385 -16.474 -11.850 1263 1HG GLU 678 1HG GLU 678 -12.371 -15.034 -13.637 1264 2HG GLU 678 2HG GLU 678 -10.771 -15.529 -14.154 1265 HE2 GLU 678 HE GLU 678 -14.075 -16.293 -14.301 1266 H ALA 679 H ALA 679 -8.621 -15.789 -13.810 1267 HA ALA 679 HA ALA 679 -7.812 -18.150 -14.817 1268 1HB ALA 679 1HB ALA 679 -6.061 -15.709 -14.315 1269 2HB ALA 679 2HB ALA 679 -5.794 -16.962 -15.551 1270 3HB ALA 679 3HB ALA 679 -7.212 -15.891 -15.661 1271 H GLY 680 H GLY 680 -6.997 -16.759 -11.668 1272 1HA GLY 680 2HA GLY 680 -6.039 -17.738 -9.872 1273 2HA GLY 680 1HA GLY 680 -4.672 -17.940 -10.949 1274 H GLN 681 H GLN 681 -7.660 -19.492 -9.702 1275 HA GLN 681 HA GLN 681 -6.516 -22.036 -10.559 1276 1HB GLN 681 1HB GLN 681 -7.753 -21.218 -7.919 1277 2HB GLN 681 2HB GLN 681 -7.816 -22.895 -8.426 1278 1HG GLN 681 1HG GLN 681 -5.389 -23.037 -8.559 1279 2HG GLN 681 2HG GLN 681 -5.215 -21.304 -8.366 1280 1HE2 GLN 681 1HE2 GLN 681 -5.445 -20.344 -6.382 1281 2HE2 GLN 681 2HE2 GLN 681 -5.492 -21.217 -4.887 1282 H ALA 682 H ALA 682 -9.432 -20.045 -9.951 1283 HA ALA 682 HA ALA 682 -11.472 -21.729 -10.338 1284 1HB ALA 682 3HB ALA 682 -10.937 -18.924 -11.329 1285 2HB ALA 682 1HB ALA 682 -12.479 -19.734 -11.696 1286 3HB ALA 682 2HB ALA 682 -11.995 -19.466 -10.004 1287 H MET 683 H MET 683 -9.986 -19.964 -13.151 1288 HA MET 683 HA MET 683 -11.138 -21.205 -15.155 1289 1HB MET 683 1HB MET 683 -9.316 -19.476 -15.321 1290 2HB MET 683 2HB MET 683 -8.124 -20.686 -14.888 1291 1HG MET 683 1HG MET 683 -8.101 -20.433 -17.316 1292 2HG MET 683 2HG MET 683 -8.764 -22.012 -16.940 1293 1HE MET 683 3HE MET 683 -10.529 -22.888 -18.000 1294 2HE MET 683 1HE MET 683 -11.733 -22.066 -19.021 1295 3HE MET 683 2HE MET 683 -10.018 -22.071 -19.497 1296 H ALA 684 H ALA 684 -8.787 -22.685 -12.943 1297 HA ALA 684 HA ALA 684 -8.543 -25.036 -14.626 1298 1HB ALA 684 1HB ALA 684 -6.882 -25.729 -13.020 1299 2HB ALA 684 2HB ALA 684 -6.616 -24.001 -13.355 1300 3HB ALA 684 3HB ALA 684 -7.422 -24.503 -11.849 1301 H SER 685 H SER 685 -9.846 -24.056 -11.389 1302 HA SER 685 HA SER 685 -10.771 -26.552 -10.695 1303 1HB SER 685 1HB SER 685 -11.624 -23.737 -9.949 1304 2HB SER 685 2HB SER 685 -12.456 -25.128 -9.282 1305 HG SER 685 HG SER 685 -9.793 -24.218 -8.836 1306 H THR 686 H THR 686 -13.114 -23.880 -11.317 1307 HA THR 686 HA THR 686 -14.313 -25.114 -13.570 1308 HB THR 686 HB THR 686 -14.955 -26.704 -11.665 1309 HG1 THR 686 1HG THR 686 -17.058 -25.022 -12.834 1310 1HG2 THR 686 1HG2 THR 686 -16.299 -24.132 -10.739 1311 2HG2 THR 686 2HG2 THR 686 -17.029 -25.717 -10.388 1312 3HG2 THR 686 3HG2 THR 686 -15.409 -25.325 -9.763 1313 H GLU 687 H GLU 687 -16.210 -23.916 -14.338 1314 HA GLU 687 HA GLU 687 -16.164 -21.232 -13.194 1315 1HB GLU 687 1HB GLU 687 -15.763 -22.166 -15.900 1316 2HB GLU 687 2HB GLU 687 -17.215 -21.186 -15.864 1317 1HG GLU 687 1HG GLU 687 -14.808 -20.146 -14.380 1318 2HG GLU 687 2HG GLU 687 -14.755 -20.101 -16.132 1319 HE2 GLU 687 HE GLU 687 -16.768 -17.350 -14.264 1320 H GLY 688 H GLY 688 -18.235 -20.007 -13.286 1321 1HA GLY 688 2HA GLY 688 -20.641 -21.591 -13.750 1322 2HA GLY 688 1HA GLY 688 -20.535 -19.867 -13.457 1323 H ASN 689 H ASN 689 -18.670 -22.047 -11.390 1324 HA ASN 689 HA ASN 689 -20.768 -22.104 -9.427 1325 1HB ASN 689 1HB ASN 689 -19.232 -24.092 -9.904 1326 2HB ASN 689 2HB ASN 689 -17.898 -23.163 -9.249 1327 1HD2 ASN 689 1HD2 ASN 689 -17.393 -23.920 -7.344 1328 2HD2 ASN 689 2HD2 ASN 689 -18.474 -24.313 -6.049 1329 H VAL 690 H VAL 690 -17.351 -20.936 -9.858 1330 HA VAL 690 HA VAL 690 -17.431 -19.509 -7.360 1331 HB VAL 690 HB VAL 690 -15.161 -18.916 -7.890 1332 1HG1 VAL 690 1HG1 VAL 690 -16.064 -21.474 -7.453 1333 2HG1 VAL 690 2HG1 VAL 690 -15.027 -21.685 -8.884 1334 3HG1 VAL 690 3HG1 VAL 690 -14.360 -20.962 -7.400 1335 1HG2 VAL 690 3HG2 VAL 690 -16.013 -19.520 -10.646 1336 2HG2 VAL 690 1HG2 VAL 690 -14.744 -18.425 -10.048 1337 3HG2 VAL 690 2HG2 VAL 690 -14.411 -20.165 -10.215 1338 H THR 691 H THR 691 -18.741 -17.740 -7.273 1339 HA THR 691 HA THR 691 -18.283 -15.692 -9.308 1340 HB THR 691 HB THR 691 -20.953 -16.969 -8.549 1341 HG1 THR 691 1HG THR 691 -19.850 -17.846 -10.389 1342 1HG2 THR 691 1HG2 THR 691 -20.335 -14.287 -9.869 1343 2HG2 THR 691 2HG2 THR 691 -21.837 -15.178 -10.215 1344 3HG2 THR 691 3HG2 THR 691 -21.494 -14.619 -8.560 1345 H GLY 692 H GLY 692 -19.981 -16.534 -6.219 1346 1HA GLY 692 2HA GLY 692 -20.212 -15.367 -4.313 1347 2HA GLY 692 1HA GLY 692 -20.176 -13.904 -5.276 1348 H MET 693 H MET 693 -17.722 -16.500 -4.568 1349 HA MET 693 HA MET 693 -16.210 -15.078 -2.823 1350 1HB MET 693 1HB MET 693 -15.986 -17.468 -4.470 1351 2HB MET 693 2HB MET 693 -14.452 -16.622 -4.530 1352 1HG MET 693 1HG MET 693 -14.031 -17.732 -2.564 1353 2HG MET 693 2HG MET 693 -14.976 -16.445 -1.842 1354 1HE MET 693 1HE MET 693 -15.792 -17.285 -0.008 1355 2HE MET 693 2HE MET 693 -17.049 -18.527 0.210 1356 3HE MET 693 3HE MET 693 -15.337 -19.002 0.106 1357 H PHE 694 H PHE 694 -15.865 -15.239 -6.433 1358 HA PHE 694 HA PHE 694 -13.794 -13.234 -6.341 1359 1HB PHE 694 1HB PHE 694 -15.219 -15.013 -8.355 1360 2HB PHE 694 2HB PHE 694 -14.380 -13.607 -8.979 1361 HD1 PHE 694 1HD PHE 694 -14.012 -16.924 -7.566 1362 HD2 PHE 694 2HD PHE 694 -11.924 -13.412 -8.712 1363 HE1 PHE 694 1HE PHE 694 -11.852 -18.201 -7.541 1364 HE2 PHE 694 2HE PHE 694 -9.763 -14.689 -8.687 1365 HZ PHE 694 HZ PHE 694 -9.753 -17.068 -8.102 1366 H ALA 695 H ALA 695 -14.887 -11.366 -5.503 1367 HA ALA 695 HA ALA 695 -16.118 -9.528 -5.591 1368 1HB ALA 695 1HB ALA 695 -14.735 -9.052 -7.527 1369 2HB ALA 695 3HB ALA 695 -16.395 -8.513 -7.876 1370 3HB ALA 695 2HB ALA 695 -15.788 -10.033 -8.575 No H/Q in entry = 1370
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