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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 | bmrb_id | cing | stage | position | program | type |
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654768 |
7b7o ![]() ![]() |
34582 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 H ALA 1 -2.223 -18.210 -8.158 2 HA ALA 1 HA ALA 1 -3.101 -15.952 -9.611 3 HB1 ALA 1 HB1 ALA 1 -3.824 -14.458 -8.016 4 HB2 ALA 1 HB2 ALA 1 -4.524 -15.965 -7.423 5 HB3 ALA 1 HB3 ALA 1 -3.050 -15.330 -6.692 6 H LEU 2 H LEU 2 -0.758 -17.558 -9.378 7 HA LEU 2 HA LEU 2 1.213 -15.909 -8.017 8 HB2 LEU 2 HB2 LEU 2 1.149 -18.603 -9.227 9 HB3 LEU 2 HB3 LEU 2 2.690 -17.753 -9.297 10 HG LEU 2 HG LEU 2 2.490 -19.294 -7.370 11 HD11 LEU 2 HD11 LEU 2 3.710 -16.931 -7.466 12 HD12 LEU 2 HD12 LEU 2 3.723 -17.947 -6.025 13 HD13 LEU 2 HD13 LEU 2 2.589 -16.601 -6.144 14 HD21 LEU 2 HD21 LEU 2 0.883 -19.137 -5.768 15 HD22 LEU 2 HD22 LEU 2 -0.046 -18.540 -7.143 16 HD23 LEU 2 HD23 LEU 2 0.664 -17.402 -5.997 17 H PHE 3 H PHE 3 1.940 -14.154 -9.011 18 HA PHE 3 HA PHE 3 2.531 -14.324 -11.890 19 HB2 PHE 3 HB2 PHE 3 1.368 -11.948 -10.420 20 HB3 PHE 3 HB3 PHE 3 1.875 -11.948 -12.106 21 HD1 PHE 3 HD1 PHE 3 -0.877 -12.126 -10.048 22 HD2 PHE 3 HD2 PHE 3 0.794 -14.021 -13.473 23 HE1 PHE 3 HE1 PHE 3 -3.118 -12.890 -10.714 24 HE2 PHE 3 HE2 PHE 3 -1.445 -14.788 -14.145 25 HZ PHE 3 HZ PHE 3 -3.405 -14.223 -12.766 26 H GLY 4 H GLY 4 4.198 -14.670 -9.455 27 HA2 GLY 4 HA2 GLY 4 6.400 -14.207 -8.947 28 HA3 GLY 4 HA3 GLY 4 6.439 -13.128 -10.334 29 H LEU 5 H LEU 5 3.987 -12.645 -7.951 30 HA LEU 5 HA LEU 5 5.391 -10.218 -7.063 31 HB2 LEU 5 HB2 LEU 5 2.447 -10.867 -7.059 32 HB3 LEU 5 HB3 LEU 5 3.158 -9.370 -6.459 33 HG LEU 5 HG LEU 5 3.216 -10.318 -9.324 34 HD11 LEU 5 HD11 LEU 5 1.707 -7.982 -8.186 35 HD12 LEU 5 HD12 LEU 5 0.988 -9.580 -8.378 36 HD13 LEU 5 HD13 LEU 5 1.570 -8.699 -9.791 37 HD21 LEU 5 HD21 LEU 5 4.888 -8.880 -9.579 38 HD22 LEU 5 HD22 LEU 5 4.765 -8.358 -7.899 39 HD23 LEU 5 HD23 LEU 5 3.776 -7.585 -9.137 40 H GLY 6 H GLY 6 5.790 -9.861 -4.942 41 HA2 GLY 6 HA2 GLY 6 4.695 -10.438 -2.651 42 HA3 GLY 6 HA3 GLY 6 5.161 -12.069 -3.111 43 H VAL 7 H VAL 7 7.587 -10.775 -4.477 44 HA VAL 7 HA VAL 7 9.487 -11.339 -2.543 45 HB VAL 7 HB VAL 7 9.536 -9.838 -5.109 46 HG11 VAL 7 HG11 VAL 7 12.052 -9.499 -4.672 47 HG12 VAL 7 HG12 VAL 7 10.916 -8.342 -3.978 48 HG13 VAL 7 HG13 VAL 7 11.618 -9.605 -2.967 49 HG21 VAL 7 HG21 VAL 7 10.618 -11.659 -5.867 50 HG22 VAL 7 HG22 VAL 7 11.617 -11.797 -4.420 51 HG23 VAL 7 HG23 VAL 7 9.968 -12.424 -4.417 52 HA PRO 8 HA PRO 8 9.856 -6.611 -1.606 53 HB2 PRO 8 HB2 PRO 8 7.909 -4.994 -2.590 54 HB3 PRO 8 HB3 PRO 8 9.388 -5.370 -3.482 55 HG2 PRO 8 HG2 PRO 8 6.657 -6.567 -3.753 56 HG3 PRO 8 HG3 PRO 8 7.795 -6.077 -5.022 57 HD2 PRO 8 HD2 PRO 8 7.490 -8.656 -4.256 58 HD3 PRO 8 HD3 PRO 8 9.042 -8.006 -4.825 59 H GLU 9 H GLU 9 6.871 -8.340 -1.620 60 HA GLU 9 HA GLU 9 5.584 -6.776 0.417 61 HB2 GLU 9 HB2 GLU 9 4.539 -8.353 -1.397 62 HB3 GLU 9 HB3 GLU 9 4.828 -9.608 -0.199 63 HG2 GLU 9 HG2 GLU 9 2.853 -9.079 0.652 64 HG3 GLU 9 HG3 GLU 9 3.609 -7.604 1.250 65 H LEU 10 H LEU 10 7.731 -9.506 0.318 66 HA LEU 10 HA LEU 10 7.245 -10.325 3.032 67 HB2 LEU 10 HB2 LEU 10 8.039 -11.826 1.177 68 HB3 LEU 10 HB3 LEU 10 9.601 -11.017 1.289 69 HG LEU 10 HG LEU 10 8.689 -12.051 3.853 70 HD11 LEU 10 HD11 LEU 10 7.762 -13.931 3.009 71 HD12 LEU 10 HD12 LEU 10 9.449 -14.432 2.902 72 HD13 LEU 10 HD13 LEU 10 8.625 -13.802 1.475 73 HD21 LEU 10 HD21 LEU 10 10.931 -11.346 3.621 74 HD22 LEU 10 HD22 LEU 10 11.155 -12.287 2.146 75 HD23 LEU 10 HD23 LEU 10 10.984 -13.107 3.699 76 H ALA 11 H ALA 11 9.338 -8.092 1.409 77 HA ALA 11 HA ALA 11 11.329 -7.860 3.413 78 HB1 ALA 11 HB1 ALA 11 11.845 -7.079 1.231 79 HB2 ALA 11 HB2 ALA 11 10.454 -5.996 1.217 80 HB3 ALA 11 HB3 ALA 11 11.818 -5.666 2.286 81 H VAL 12 H VAL 12 8.133 -6.562 3.067 82 HA VAL 12 HA VAL 12 8.484 -4.444 4.984 83 HB VAL 12 HB VAL 12 5.945 -5.622 3.845 84 HG11 VAL 12 HG11 VAL 12 6.487 -3.417 5.752 85 HG12 VAL 12 HG12 VAL 12 5.226 -3.163 4.546 86 HG13 VAL 12 HG13 VAL 12 5.120 -4.526 5.661 87 HG21 VAL 12 HG21 VAL 12 5.983 -3.468 2.508 88 HG22 VAL 12 HG22 VAL 12 7.665 -3.298 3.012 89 HG23 VAL 12 HG23 VAL 12 7.169 -4.691 2.051 90 H ILE 13 H ILE 13 6.465 -7.390 4.989 91 HA ILE 13 HA ILE 13 5.759 -7.317 7.677 92 HB ILE 13 HB ILE 13 4.660 -8.802 6.084 93 HG12 ILE 13 HG12 ILE 13 5.982 -10.311 8.349 94 HG13 ILE 13 HG13 ILE 13 4.531 -9.325 8.485 95 HG21 ILE 13 HG21 ILE 13 7.043 -10.621 6.199 96 HG22 ILE 13 HG22 ILE 13 5.662 -10.679 5.106 97 HG23 ILE 13 HG23 ILE 13 6.864 -9.400 4.942 98 HD11 ILE 13 HD11 ILE 13 4.733 -12.062 7.863 99 HD12 ILE 13 HD12 ILE 13 3.282 -11.062 7.942 100 HD13 ILE 13 HD13 ILE 13 4.148 -11.241 6.416 101 H ALA 14 H ALA 14 8.730 -8.272 6.179 102 HA ALA 14 HA ALA 14 9.821 -9.963 8.097 103 HB1 ALA 14 HB1 ALA 14 12.028 -9.168 7.259 104 HB2 ALA 14 HB2 ALA 14 10.912 -9.666 5.987 105 HB3 ALA 14 HB3 ALA 14 11.175 -7.952 6.308 106 H GLY 15 H GLY 15 10.276 -6.429 7.824 107 HA2 GLY 15 HA2 GLY 15 11.570 -6.248 10.369 108 HA3 GLY 15 HA3 GLY 15 11.031 -4.901 9.377 109 H VAL 16 H VAL 16 8.282 -5.702 9.223 110 HA VAL 16 HA VAL 16 7.212 -4.374 11.407 111 HB VAL 16 HB VAL 16 5.831 -6.472 9.727 112 HG11 VAL 16 HG11 VAL 16 4.761 -4.284 11.500 113 HG12 VAL 16 HG12 VAL 16 3.784 -5.172 10.330 114 HG13 VAL 16 HG13 VAL 16 4.533 -6.023 11.682 115 HG21 VAL 16 HG21 VAL 16 5.832 -5.034 8.034 116 HG22 VAL 16 HG22 VAL 16 5.178 -3.758 9.061 117 HG23 VAL 16 HG23 VAL 16 6.921 -4.002 8.960 118 H ALA 17 H ALA 17 7.918 -7.787 10.986 119 HA ALA 17 HA ALA 17 6.664 -8.485 13.514 120 HB1 ALA 17 HB1 ALA 17 6.575 -10.564 12.713 121 HB2 ALA 17 HB2 ALA 17 7.084 -9.872 11.172 122 HB3 ALA 17 HB3 ALA 17 8.282 -10.557 12.271 123 H ALA 18 H ALA 18 9.797 -7.735 12.255 124 HA ALA 18 HA ALA 18 11.343 -8.976 14.297 125 HB1 ALA 18 HB1 ALA 18 11.865 -7.634 11.902 126 HB2 ALA 18 HB2 ALA 18 12.650 -6.679 13.161 127 HB3 ALA 18 HB3 ALA 18 13.035 -8.392 12.983 128 H LEU 19 H LEU 19 9.570 -6.020 14.088 129 HA LEU 19 HA LEU 19 10.948 -4.552 16.080 130 HB2 LEU 19 HB2 LEU 19 8.093 -4.369 15.133 131 HB3 LEU 19 HB3 LEU 19 8.883 -3.192 16.181 132 HG LEU 19 HG LEU 19 10.047 -3.792 13.494 133 HD11 LEU 19 HD11 LEU 19 7.968 -1.667 13.853 134 HD12 LEU 19 HD12 LEU 19 7.524 -3.303 13.368 135 HD13 LEU 19 HD13 LEU 19 8.618 -2.352 12.363 136 HD21 LEU 19 HD21 LEU 19 11.165 -1.827 13.768 137 HD22 LEU 19 HD22 LEU 19 10.969 -2.278 15.462 138 HD23 LEU 19 HD23 LEU 19 9.879 -1.099 14.732 139 H LEU 20 H LEU 20 8.205 -6.773 16.174 140 HA LEU 20 HA LEU 20 7.969 -6.461 19.061 141 HB2 LEU 20 HB2 LEU 20 5.989 -7.773 18.902 142 HB3 LEU 20 HB3 LEU 20 5.962 -6.585 17.600 143 HG LEU 20 HG LEU 20 6.980 -8.617 16.230 144 HD11 LEU 20 HD11 LEU 20 6.512 -9.846 18.660 145 HD12 LEU 20 HD12 LEU 20 6.769 -10.649 17.111 146 HD13 LEU 20 HD13 LEU 20 5.130 -10.322 17.672 147 HD21 LEU 20 HD21 LEU 20 4.923 -7.393 15.712 148 HD22 LEU 20 HD22 LEU 20 4.053 -8.348 16.913 149 HD23 LEU 20 HD23 LEU 20 4.722 -9.130 15.479 150 H PHE 21 H PHE 21 9.056 -8.785 16.675 151 HA PHE 21 HA PHE 21 9.396 -10.936 18.533 152 HB2 PHE 21 HB2 PHE 21 9.079 -11.149 16.015 153 HB3 PHE 21 HB3 PHE 21 10.761 -10.655 15.855 154 HD1 PHE 21 HD1 PHE 21 12.499 -12.198 16.119 155 HD2 PHE 21 HD2 PHE 21 8.551 -13.238 17.322 156 HE1 PHE 21 HE1 PHE 21 13.214 -14.530 16.440 157 HE2 PHE 21 HE2 PHE 21 9.260 -15.571 17.646 158 HZ PHE 21 HZ PHE 21 11.595 -16.220 17.206 159 H GLY 22 H GLY 22 11.292 -8.222 17.525 160 HA2 GLY 22 HA2 GLY 22 13.641 -9.327 18.928 161 HA3 GLY 22 HA3 GLY 22 13.712 -8.083 17.688 162 HA PRO 23 HA PRO 23 14.062 -5.871 21.690 163 HB2 PRO 23 HB2 PRO 23 15.771 -3.989 20.738 164 HB3 PRO 23 HB3 PRO 23 16.308 -5.568 21.320 165 HG2 PRO 23 HG2 PRO 23 15.854 -4.638 18.511 166 HG3 PRO 23 HG3 PRO 23 17.185 -5.608 19.167 167 HD2 PRO 23 HD2 PRO 23 15.111 -6.706 17.816 168 HD3 PRO 23 HD3 PRO 23 15.952 -7.555 19.128 169 H LYS 24 H LYS 24 14.066 -3.289 21.888 170 HA LYS 24 HA LYS 24 12.869 -1.365 21.680 171 HB2 LYS 24 HB2 LYS 24 12.742 -0.481 19.597 172 HB3 LYS 24 HB3 LYS 24 13.699 -1.893 19.166 173 HG2 LYS 24 HG2 LYS 24 12.125 -2.362 17.677 174 HG3 LYS 24 HG3 LYS 24 11.085 -2.794 19.037 175 HD2 LYS 24 HD2 LYS 24 9.788 -1.256 17.888 176 HD3 LYS 24 HD3 LYS 24 10.564 -0.251 19.114 177 HE2 LYS 24 HE2 LYS 24 12.306 -0.328 16.900 178 HE3 LYS 24 3HE LYS 24 10.687 -0.049 16.260 179 HZ1 LYS 24 1HZ LYS 24 12.014 1.547 18.383 180 HZ2 LYS 24 2HZ LYS 24 10.449 1.808 17.799 181 HZ3 LYS 24 3HZ LYS 24 11.780 2.031 16.780 182 H LYS 25 H LYS 25 11.603 -4.232 21.970 183 HA LYS 25 HA LYS 25 8.839 -3.652 21.294 184 HB2 LYS 25 HB2 LYS 25 9.829 -5.931 21.010 185 HB3 LYS 25 HB3 LYS 25 9.975 -6.039 22.760 186 HG2 LYS 25 HG2 LYS 25 7.367 -5.420 22.547 187 HG3 LYS 25 HG3 LYS 25 7.605 -6.297 21.034 188 HD2 LYS 25 HD2 LYS 25 7.982 -8.274 22.085 189 HD3 LYS 25 HD3 LYS 25 8.765 -7.512 23.471 190 HE2 LYS 25 HE2 LYS 25 6.643 -6.858 24.381 191 HE3 LYS 25 3HE LYS 25 5.802 -7.398 22.930 192 HZ1 LYS 25 1HZ LYS 25 7.254 -9.128 24.858 193 HZ2 LYS 25 2HZ LYS 25 6.518 -9.669 23.434 194 HZ3 LYS 25 3HZ LYS 25 5.575 -9.020 24.680 195 H LEU 26 H LEU 26 10.943 -3.524 24.037 196 HA LEU 26 HA LEU 26 10.639 -2.932 26.213 197 HB2 LEU 26 HB2 LEU 26 8.161 -1.562 25.186 198 HB3 LEU 26 HB3 LEU 26 9.062 -1.173 26.650 199 HG LEU 26 HG LEU 26 10.786 -0.977 24.361 200 HD11 LEU 26 HD11 LEU 26 9.718 0.823 23.172 201 HD12 LEU 26 HD12 LEU 26 8.319 0.751 24.242 202 HD13 LEU 26 HD13 LEU 26 8.665 -0.592 23.150 203 HD21 LEU 26 HD21 LEU 26 11.374 1.051 25.326 204 HD22 LEU 26 HD22 LEU 26 10.845 0.094 26.711 205 HD23 LEU 26 HD23 LEU 26 9.769 1.306 26.011 206 HA PRO 27 HA PRO 27 7.502 -6.300 26.840 207 HB2 PRO 27 HB2 PRO 27 9.138 -7.863 28.339 208 HB3 PRO 27 HB3 PRO 27 9.093 -7.935 26.574 209 HG2 PRO 27 HG2 PRO 27 11.034 -6.523 28.364 210 HG3 PRO 27 HG3 PRO 27 11.350 -7.479 26.904 211 HD2 PRO 27 HD2 PRO 27 11.305 -4.771 26.891 212 HD3 PRO 27 HD3 PRO 27 10.796 -5.742 25.494 213 H GLU 28 H GLU 28 9.488 -4.307 28.852 214 HA GLU 28 HA GLU 28 8.668 -5.033 31.402 215 HB2 GLU 28 HB2 GLU 28 9.304 -2.802 32.101 216 HB3 GLU 28 HB3 GLU 28 10.459 -3.402 30.918 217 HG2 GLU 28 HG2 GLU 28 10.181 -1.476 29.859 218 HG3 GLU 28 HG3 GLU 28 8.596 -2.079 29.379 219 H ILE 29 H ILE 29 6.975 -3.282 28.920 220 HA ILE 29 HA ILE 29 4.963 -2.158 30.594 221 HB ILE 29 HB ILE 29 3.761 -1.644 28.569 222 HG12 ILE 29 HG12 ILE 29 5.169 -2.493 26.409 223 HG13 ILE 29 HG13 ILE 29 5.395 -3.861 27.494 224 HG21 ILE 29 HG21 ILE 29 6.653 -1.308 27.849 225 HG22 ILE 29 HG22 ILE 29 5.307 -0.203 27.571 226 HG23 ILE 29 HG23 ILE 29 5.929 -0.441 29.204 227 HD11 ILE 29 HD11 ILE 29 2.790 -3.628 27.777 228 HD12 ILE 29 HD12 ILE 29 2.927 -2.853 26.198 229 HD13 ILE 29 HD13 ILE 29 3.499 -4.505 26.422 230 H GLY 30 H GLY 30 5.383 -5.231 28.993 231 HA2 GLY 30 HA2 GLY 30 2.651 -6.062 29.235 232 HA3 GLY 30 HA3 GLY 30 4.021 -7.088 28.838 233 H LYS 31 H LYS 31 5.132 -5.727 31.484 234 HA LYS 31 HA LYS 31 4.301 -7.945 33.164 235 HB2 LYS 31 HB2 LYS 31 6.468 -5.890 33.262 236 HB3 LYS 31 HB3 LYS 31 5.982 -6.673 34.761 237 HG2 LYS 31 HG2 LYS 31 6.505 -8.844 33.840 238 HG3 LYS 31 HG3 LYS 31 6.891 -8.117 32.279 239 HD2 LYS 31 HD2 LYS 31 8.532 -6.687 33.836 240 HD3 LYS 31 HD3 LYS 31 8.452 -8.167 34.795 241 HE2 LYS 31 HE2 LYS 31 8.828 -8.621 31.929 242 HE3 LYS 31 3HE LYS 31 10.143 -7.727 32.688 243 HZ1 LYS 31 1HZ LYS 31 10.649 -10.023 32.840 244 HZ2 LYS 31 2HZ LYS 31 9.118 -10.404 33.448 245 HZ3 LYS 31 3HZ LYS 31 10.208 -9.522 34.394 246 H SER 32 H SER 32 4.293 -4.392 33.309 247 HA SER 32 HA SER 32 2.732 -4.377 35.734 248 HB2 SER 32 HB2 SER 32 4.398 -2.541 34.426 249 HB3 SER 32 HB3 SER 32 2.785 -1.836 34.342 250 HG SER 32 HG SER 32 3.344 -1.202 36.292 251 H ILE 33 H ILE 33 2.184 -3.413 32.352 252 HA ILE 33 HA ILE 33 -0.585 -2.847 32.756 253 HB ILE 33 HB ILE 33 0.771 -3.420 30.124 254 HG12 ILE 33 HG12 ILE 33 0.534 -0.793 31.606 255 HG13 ILE 33 HG13 ILE 33 2.021 -1.703 31.363 256 HG21 ILE 33 HG21 ILE 33 -1.662 -3.375 30.042 257 HG22 ILE 33 HG22 ILE 33 -1.670 -1.795 30.825 258 HG23 ILE 33 HG23 ILE 33 -0.983 -1.975 29.211 259 HD11 ILE 33 HD11 ILE 33 2.178 -0.123 29.718 260 HD12 ILE 33 HD12 ILE 33 1.413 -1.448 28.839 261 HD13 ILE 33 HD13 ILE 33 0.440 -0.098 29.423 262 H GLY 34 H GLY 34 1.232 -5.704 32.104 263 HA2 GLY 34 HA2 GLY 34 -0.640 -7.284 30.770 264 HA3 GLY 34 HA3 GLY 34 0.606 -7.895 31.848 265 H LYS 35 H LYS 35 -0.638 -6.166 34.030 266 HA LYS 35 HA LYS 35 -2.093 -8.150 35.325 267 HB2 LYS 35 HB2 LYS 35 -1.777 -5.205 35.705 268 HB3 LYS 35 HB3 LYS 35 -3.031 -6.037 36.617 269 HG2 LYS 35 HG2 LYS 35 -1.454 -7.416 37.711 270 HG3 LYS 35 HG3 LYS 35 -0.162 -6.927 36.613 271 HD2 LYS 35 HD2 LYS 35 0.264 -5.043 37.764 272 HD3 LYS 35 HD3 LYS 35 -1.448 -4.705 38.028 273 HE2 LYS 35 HE2 LYS 35 -1.433 -6.524 39.761 274 HE3 LYS 35 3HE LYS 35 0.320 -6.583 39.584 275 HZ1 LYS 35 1HZ LYS 35 0.537 -4.413 40.408 276 HZ2 LYS 35 2HZ LYS 35 -0.578 -5.156 41.440 277 HZ3 LYS 35 3HZ LYS 35 -1.114 -4.081 40.250 278 H THR 36 H THR 36 -3.365 -5.202 33.766 279 HA THR 36 HA THR 36 -6.080 -6.087 33.984 280 HB THR 36 HB THR 36 -6.039 -4.090 32.044 281 HG1 THR 36 HG1 THR 36 -4.239 -3.029 32.324 282 HG21 THR 36 HG21 THR 36 -6.230 -3.684 35.028 283 HG22 THR 36 HG22 THR 36 -7.531 -4.342 34.036 284 HG23 THR 36 HG23 THR 36 -6.961 -2.695 33.765 285 H VAL 37 H VAL 37 -3.776 -5.757 31.297 286 HA VAL 37 HA VAL 37 -5.382 -6.540 29.195 287 HB VAL 37 HB VAL 37 -2.465 -7.221 29.591 288 HG11 VAL 37 HG11 VAL 37 -2.488 -7.196 27.053 289 HG12 VAL 37 HG12 VAL 37 -3.249 -8.583 27.833 290 HG13 VAL 37 HG13 VAL 37 -4.245 -7.288 27.169 291 HG21 VAL 37 HG21 VAL 37 -3.126 -5.052 27.770 292 HG22 VAL 37 HG22 VAL 37 -3.639 -4.728 29.426 293 HG23 VAL 37 HG23 VAL 37 -1.950 -5.107 29.085 294 H LYS 38 H LYS 38 -3.326 -8.655 31.197 295 HA LYS 38 HA LYS 38 -4.284 -11.059 30.021 296 HB2 LYS 38 HB2 LYS 38 -2.093 -10.643 31.326 297 HB3 LYS 38 HB3 LYS 38 -3.071 -10.886 32.767 298 HG2 LYS 38 HG2 LYS 38 -3.131 -13.100 32.492 299 HG3 LYS 38 HG3 LYS 38 -3.422 -12.971 30.756 300 HD2 LYS 38 HD2 LYS 38 -1.211 -13.074 30.241 301 HD3 LYS 38 HD3 LYS 38 -0.720 -12.233 31.713 302 HE2 LYS 38 HE2 LYS 38 -1.685 -14.520 32.765 303 HE3 LYS 38 3HE LYS 38 -1.112 -15.113 31.207 304 HZ1 LYS 38 1HZ LYS 38 0.913 -13.525 32.096 305 HZ2 LYS 38 2HZ LYS 38 0.876 -15.214 32.166 306 HZ3 LYS 38 3HZ LYS 38 0.386 -14.301 33.504 307 H SER 39 H SER 39 -5.296 -9.099 32.728 308 HA SER 39 HA SER 39 -6.861 -10.903 34.140 309 HB2 SER 39 HB2 SER 39 -6.703 -7.982 33.883 310 HB3 SER 39 HB3 SER 39 -8.301 -8.571 34.341 311 HG SER 39 HG SER 39 -7.545 -8.971 36.250 312 H PHE 40 H PHE 40 -7.722 -8.906 31.341 313 HA PHE 40 HA PHE 40 -10.429 -9.759 31.234 314 HB2 PHE 40 HB2 PHE 40 -9.685 -7.663 30.198 315 HB3 PHE 40 HB3 PHE 40 -8.686 -8.568 29.065 316 HD1 PHE 40 HD1 PHE 40 -12.076 -7.554 29.945 317 HD2 PHE 40 HD2 PHE 40 -9.688 -9.811 27.238 318 HE1 PHE 40 HE1 PHE 40 -13.976 -7.692 28.388 319 HE2 PHE 40 HE2 PHE 40 -11.584 -9.951 25.676 320 HZ PHE 40 HZ PHE 40 -13.731 -8.891 26.250 321 H GLN 41 H GLN 41 -7.463 -10.836 29.652 322 HA GLN 41 HA GLN 41 -8.514 -12.584 27.780 323 HB2 GLN 41 HB2 GLN 41 -5.967 -12.760 29.390 324 HB3 GLN 41 HB3 GLN 41 -6.345 -13.848 28.061 325 HG2 GLN 41 HG2 GLN 41 -6.501 -10.941 27.525 326 HG3 GLN 41 HG3 GLN 41 -4.901 -11.646 27.745 327 HE21 GLN 41 HE21 GLN 41 -6.603 -10.589 25.404 328 HE22 GLN 41 HE22 GLN 41 -6.380 -11.792 24.185 329 H GLN 42 H GLN 42 -7.994 -13.043 31.227 330 HA GLN 42 HA GLN 42 -8.440 -15.817 31.326 331 HB2 GLN 42 HB2 GLN 42 -7.622 -14.062 33.143 332 HB3 GLN 42 HB3 GLN 42 -9.323 -14.092 33.591 333 HG2 GLN 42 HG2 GLN 42 -9.190 -16.525 33.875 334 HG3 GLN 42 HG3 GLN 42 -7.476 -16.465 33.471 335 HE21 GLN 42 HE21 GLN 42 -6.279 -16.688 35.207 336 HE22 GLN 42 HE22 GLN 42 -6.592 -16.002 36.762 337 H ALA 43 H ALA 43 -10.617 -13.101 31.156 338 HA ALA 43 HA ALA 43 -12.943 -14.756 31.728 339 HB1 ALA 43 HB1 ALA 43 -13.659 -12.819 32.550 340 HB2 ALA 43 HB2 ALA 43 -12.349 -11.930 31.772 341 HB3 ALA 43 HB3 ALA 43 -13.837 -12.262 30.886 342 H ALA 44 H ALA 44 -11.213 -13.464 29.023 343 HA ALA 44 HA ALA 44 -13.126 -13.358 27.039 344 HB1 ALA 44 HB1 ALA 44 -11.377 -13.006 25.706 345 HB2 ALA 44 HB2 ALA 44 -10.370 -13.200 27.143 346 HB3 ALA 44 HB3 ALA 44 -10.673 -14.579 26.085 347 H LYS 45 H LYS 45 -11.589 -16.161 28.476 348 HA LYS 45 HA LYS 45 -12.213 -18.123 26.622 349 HB2 LYS 45 HB2 LYS 45 -11.085 -18.093 29.116 350 HB3 LYS 45 HB3 LYS 45 -12.600 -18.932 29.424 351 HG2 LYS 45 HG2 LYS 45 -12.070 -20.663 27.929 352 HG3 LYS 45 HG3 LYS 45 -10.753 -19.740 27.202 353 HD2 LYS 45 HD2 LYS 45 -9.478 -19.894 29.266 354 HD3 LYS 45 HD3 LYS 45 -10.810 -20.752 30.046 355 HE2 LYS 45 HE2 LYS 45 -9.841 -21.916 27.518 356 HE3 LYS 45 3HE LYS 45 -8.705 -21.966 28.864 357 HZ1 LYS 45 1HZ LYS 45 -10.366 -23.082 30.199 358 HZ2 LYS 45 2HZ LYS 45 -10.097 -23.949 28.772 359 HZ3 LYS 45 3HZ LYS 45 -11.488 -23.002 28.935 360 H GLU 46 H GLU 46 -14.280 -16.437 28.849 361 HA GLU 46 HA GLU 46 -16.485 -18.292 28.447 362 HB2 GLU 46 HB2 GLU 46 -15.765 -16.502 30.484 363 HB3 GLU 46 HB3 GLU 46 -17.221 -15.827 29.764 364 HG2 GLU 46 HG2 GLU 46 -18.535 -17.508 30.501 365 HG3 GLU 46 HG3 GLU 46 -17.264 -18.719 30.348 366 H PHE 47 H PHE 47 -15.333 -15.256 27.244 367 HA PHE 47 HA PHE 47 -17.622 -14.068 26.264 368 HB2 PHE 47 HB2 PHE 47 -14.960 -13.533 26.079 369 HB3 PHE 47 HB3 PHE 47 -15.320 -14.002 24.421 370 HD1 PHE 47 HD1 PHE 47 -16.940 -12.720 23.093 371 HD2 PHE 47 HD2 PHE 47 -15.765 -11.488 26.994 372 HE1 PHE 47 HE1 PHE 47 -17.842 -10.474 22.652 373 HE2 PHE 47 HE2 PHE 47 -16.666 -9.241 26.559 374 HZ PHE 47 HZ PHE 47 -17.706 -8.731 24.386 375 H GLU 48 H GLU 48 -15.601 -16.533 24.695 376 HA GLU 48 HA GLU 48 -16.985 -16.707 22.284 377 HB2 GLU 48 HB2 GLU 48 -14.767 -17.827 23.046 378 HB3 GLU 48 HB3 GLU 48 -15.804 -19.132 23.603 379 HG2 GLU 48 HG2 GLU 48 -16.722 -18.742 21.070 380 HG3 GLU 48 HG3 GLU 48 -15.005 -18.385 20.893 381 H SER 49 H SER 49 -17.774 -17.937 25.435 382 HA SER 49 HA SER 49 -19.803 -19.754 24.478 383 HB2 SER 49 HB2 SER 49 -19.583 -18.814 27.324 384 HB3 SER 49 HB3 SER 49 -20.104 -20.384 26.712 385 HG SER 49 HG SER 49 -18.040 -20.611 27.514 386 H GLU 50 H GLU 50 -19.606 -16.447 25.496 387 HA GLU 50 HA GLU 50 -21.135 -14.768 25.628 388 HB2 GLU 50 HB2 GLU 50 -22.466 -16.655 23.704 389 HB3 GLU 50 HB3 GLU 50 -23.265 -15.171 24.206 390 HG2 GLU 50 HG2 GLU 50 -20.666 -14.429 23.477 391 HG3 GLU 50 HG3 GLU 50 -21.213 -15.563 22.244 392 H LEU 51 H LEU 51 -21.127 -16.226 27.858 393 HA LEU 51 HA LEU 51 -23.978 -16.515 28.540 394 HB2 LEU 51 HB2 LEU 51 -22.741 -18.661 28.535 395 HB3 LEU 51 HB3 LEU 51 -21.662 -18.006 29.764 396 HG LEU 51 HG LEU 51 -24.177 -17.684 30.869 397 HD11 LEU 51 HD11 LEU 51 -25.520 -19.457 30.426 398 HD12 LEU 51 HD12 LEU 51 -24.175 -20.520 30.015 399 HD13 LEU 51 HD13 LEU 51 -24.740 -19.322 28.850 400 HD21 LEU 51 HD21 LEU 51 -21.973 -18.472 31.855 401 HD22 LEU 51 HD22 LEU 51 -22.423 -20.087 31.306 402 HD23 LEU 51 HD23 LEU 51 -23.436 -19.238 32.475 403 H LYS 52 H LYS 52 -20.795 -15.441 29.559 404 HA LYS 52 HA LYS 52 -20.149 -13.827 31.032 405 HB2 LYS 52 HB2 LYS 52 -22.844 -13.122 30.354 406 HB3 LYS 52 HB3 LYS 52 -22.579 -12.798 32.062 407 HG2 LYS 52 HG2 LYS 52 -20.313 -11.778 30.913 408 HG3 LYS 52 HG3 LYS 52 -21.554 -11.416 29.711 409 HD2 LYS 52 HD2 LYS 52 -21.909 -10.801 32.634 410 HD3 LYS 52 HD3 LYS 52 -21.154 -9.665 31.513 411 HE2 LYS 52 HE2 LYS 52 -23.273 -10.008 30.087 412 HE3 LYS 52 3HE LYS 52 -23.975 -10.686 31.556 413 HZ1 LYS 52 1HZ LYS 52 -22.649 -8.173 31.980 414 HZ2 LYS 52 2HZ LYS 52 -24.193 -8.674 32.455 415 HZ3 LYS 52 3HZ LYS 52 -23.945 -8.061 30.898 416 H THR 53 H THR 53 -23.264 -14.701 32.502 417 HA THR 53 HA THR 53 -21.771 -15.730 34.827 418 HB THR 53 HB THR 53 -22.972 -13.730 35.448 419 HG1 THR 53 HG1 THR 53 -24.560 -14.821 36.948 420 HG21 THR 53 HG21 THR 53 -25.426 -13.593 35.255 421 HG22 THR 53 HG22 THR 53 -25.429 -15.117 34.367 422 HG23 THR 53 HG23 THR 53 -24.643 -13.696 33.678 Start of MODEL 2 1 H1 ALA 1 H ALA 1 1.807 -0.001 0.855 2 HA ALA 1 HA ALA 1 2.901 0.709 -1.137 3 HB1 ALA 1 HB1 ALA 1 3.454 -1.572 -0.738 4 HB2 ALA 1 HB2 ALA 1 1.927 -2.126 -1.426 5 HB3 ALA 1 HB3 ALA 1 3.152 -1.399 -2.467 6 H LEU 2 H LEU 2 -0.180 -0.910 -1.892 7 HA LEU 2 HA LEU 2 -1.719 -0.573 -3.531 8 HB2 LEU 2 HB2 LEU 2 -0.491 2.165 -3.785 9 HB3 LEU 2 HB3 LEU 2 -2.110 1.674 -4.279 10 HG LEU 2 HG LEU 2 -1.247 1.585 -1.404 11 HD11 LEU 2 HD11 LEU 2 -2.628 3.907 -2.728 12 HD12 LEU 2 HD12 LEU 2 -0.900 3.870 -2.378 13 HD13 LEU 2 HD13 LEU 2 -2.068 3.786 -1.059 14 HD21 LEU 2 HD21 LEU 2 -3.993 2.058 -2.506 15 HD22 LEU 2 HD22 LEU 2 -3.519 1.445 -0.921 16 HD23 LEU 2 HD23 LEU 2 -3.342 0.426 -2.351 17 H PHE 3 H PHE 3 -1.771 0.654 -5.927 18 HA PHE 3 HA PHE 3 -1.099 0.476 -8.092 19 HB2 PHE 3 HB2 PHE 3 1.190 1.280 -6.652 20 HB3 PHE 3 HB3 PHE 3 1.725 0.025 -7.764 21 HD1 PHE 3 HD1 PHE 3 2.525 0.772 -9.770 22 HD2 PHE 3 HD2 PHE 3 -0.575 2.968 -7.850 23 HE1 PHE 3 HE1 PHE 3 2.555 2.411 -11.604 24 HE2 PHE 3 HE2 PHE 3 -0.551 4.610 -9.682 25 HZ PHE 3 HZ PHE 3 1.015 4.332 -11.563 26 H GLY 4 H GLY 4 -1.659 -1.914 -6.415 27 HA2 GLY 4 HA2 GLY 4 -1.586 -4.205 -6.580 28 HA3 GLY 4 HA3 GLY 4 -1.324 -3.915 -8.293 29 H LEU 5 H LEU 5 0.939 -2.798 -5.887 30 HA LEU 5 HA LEU 5 2.865 -4.800 -6.863 31 HB2 LEU 5 HB2 LEU 5 3.204 -1.967 -5.934 32 HB3 LEU 5 HB3 LEU 5 4.563 -3.088 -5.988 33 HG LEU 5 HG LEU 5 2.886 -2.413 -8.398 34 HD11 LEU 5 HD11 LEU 5 5.390 -1.112 -7.355 35 HD12 LEU 5 HD12 LEU 5 3.846 -0.351 -7.737 36 HD13 LEU 5 HD13 LEU 5 4.859 -0.987 -9.032 37 HD21 LEU 5 HD21 LEU 5 5.657 -3.579 -8.174 38 HD22 LEU 5 HD22 LEU 5 4.704 -3.366 -9.642 39 HD23 LEU 5 HD23 LEU 5 4.191 -4.528 -8.418 40 H GLY 6 H GLY 6 2.850 -6.423 -5.414 41 HA2 GLY 6 HA2 GLY 6 2.884 -5.744 -2.551 42 HA3 GLY 6 HA3 GLY 6 2.464 -7.313 -3.222 43 H VAL 7 H VAL 7 5.205 -5.737 -4.565 44 HA VAL 7 HA VAL 7 6.960 -7.837 -3.963 45 HB VAL 7 HB VAL 7 7.280 -5.093 -5.063 46 HG11 VAL 7 HG11 VAL 7 9.141 -4.965 -3.672 47 HG12 VAL 7 HG12 VAL 7 9.489 -6.689 -3.817 48 HG13 VAL 7 HG13 VAL 7 9.801 -5.609 -5.175 49 HG21 VAL 7 HG21 VAL 7 8.080 -7.863 -5.942 50 HG22 VAL 7 HG22 VAL 7 6.767 -6.875 -6.582 51 HG23 VAL 7 HG23 VAL 7 8.443 -6.393 -6.848 52 HA PRO 8 HA PRO 8 8.864 -4.976 -0.561 53 HB2 PRO 8 HB2 PRO 8 7.452 -2.764 0.132 54 HB3 PRO 8 HB3 PRO 8 8.666 -2.765 -1.152 55 HG2 PRO 8 HG2 PRO 8 5.686 -2.952 -1.362 56 HG3 PRO 8 HG3 PRO 8 6.819 -2.002 -2.341 57 HD2 PRO 8 HD2 PRO 8 5.780 -4.354 -3.188 58 HD3 PRO 8 HD3 PRO 8 7.408 -3.811 -3.642 59 H GLU 9 H GLU 9 5.501 -5.688 -0.822 60 HA GLU 9 HA GLU 9 4.769 -5.460 1.899 61 HB2 GLU 9 HB2 GLU 9 3.363 -5.855 -0.340 62 HB3 GLU 9 HB3 GLU 9 3.469 -7.525 0.199 63 HG2 GLU 9 HG2 GLU 9 2.654 -6.558 2.472 64 HG3 GLU 9 HG3 GLU 9 2.107 -5.205 1.482 65 H LEU 10 H LEU 10 6.482 -7.877 0.104 66 HA LEU 10 HA LEU 10 6.170 -9.903 2.156 67 HB2 LEU 10 HB2 LEU 10 7.249 -9.768 -0.575 68 HB3 LEU 10 HB3 LEU 10 8.106 -10.858 0.513 69 HG LEU 10 HG LEU 10 6.415 -12.028 -0.812 70 HD11 LEU 10 HD11 LEU 10 6.517 -13.331 0.995 71 HD12 LEU 10 HD12 LEU 10 4.983 -12.597 1.461 72 HD13 LEU 10 HD13 LEU 10 6.497 -11.954 2.098 73 HD21 LEU 10 HD21 LEU 10 4.346 -10.426 0.672 74 HD22 LEU 10 HD22 LEU 10 4.097 -11.578 -0.640 75 HD23 LEU 10 HD23 LEU 10 4.882 -10.031 -0.961 76 H ALA 11 H ALA 11 8.426 -7.444 1.234 77 HA ALA 11 HA ALA 11 10.564 -8.530 2.876 78 HB1 ALA 11 HB1 ALA 11 10.994 -5.821 1.968 79 HB2 ALA 11 HB2 ALA 11 11.907 -7.288 1.612 80 HB3 ALA 11 HB3 ALA 11 10.492 -6.874 0.644 81 H VAL 12 H VAL 12 7.994 -6.222 3.103 82 HA VAL 12 HA VAL 12 9.091 -4.823 5.373 83 HB VAL 12 HB VAL 12 7.554 -3.722 3.758 84 HG11 VAL 12 HG11 VAL 12 5.304 -4.255 3.563 85 HG12 VAL 12 HG12 VAL 12 6.073 -5.841 3.660 86 HG13 VAL 12 HG13 VAL 12 5.282 -5.154 5.079 87 HG21 VAL 12 HG21 VAL 12 7.860 -3.175 6.312 88 HG22 VAL 12 HG22 VAL 12 6.658 -2.324 5.342 89 HG23 VAL 12 HG23 VAL 12 6.164 -3.652 6.392 90 H ILE 13 H ILE 13 6.920 -7.500 4.807 91 HA ILE 13 HA ILE 13 5.632 -7.653 7.269 92 HB ILE 13 HB ILE 13 5.092 -9.054 5.279 93 HG12 ILE 13 HG12 ILE 13 5.600 -10.890 7.597 94 HG13 ILE 13 HG13 ILE 13 4.481 -9.543 7.773 95 HG21 ILE 13 HG21 ILE 13 6.482 -10.588 4.422 96 HG22 ILE 13 HG22 ILE 13 7.734 -9.724 5.312 97 HG23 ILE 13 HG23 ILE 13 6.987 -11.160 6.013 98 HD11 ILE 13 HD11 ILE 13 3.769 -10.814 5.389 99 HD12 ILE 13 HD12 ILE 13 4.073 -12.100 6.557 100 HD13 ILE 13 HD13 ILE 13 2.903 -10.833 6.925 101 H ALA 14 H ALA 14 8.903 -8.399 6.403 102 HA ALA 14 HA ALA 14 9.452 -9.994 8.735 103 HB1 ALA 14 HB1 ALA 14 10.994 -9.006 6.410 104 HB2 ALA 14 HB2 ALA 14 11.900 -9.364 7.881 105 HB3 ALA 14 HB3 ALA 14 10.919 -10.618 7.123 106 H GLY 15 H GLY 15 10.272 -6.695 7.672 107 HA2 GLY 15 HA2 GLY 15 11.661 -5.989 10.040 108 HA3 GLY 15 HA3 GLY 15 11.017 -4.868 8.849 109 H VAL 16 H VAL 16 8.309 -5.444 9.003 110 HA VAL 16 HA VAL 16 7.469 -3.845 11.113 111 HB VAL 16 HB VAL 16 6.102 -4.289 9.112 112 HG11 VAL 16 HG11 VAL 16 6.630 -6.781 9.145 113 HG12 VAL 16 HG12 VAL 16 5.343 -6.922 10.345 114 HG13 VAL 16 HG13 VAL 16 4.981 -6.317 8.728 115 HG21 VAL 16 HG21 VAL 16 5.127 -3.436 11.256 116 HG22 VAL 16 HG22 VAL 16 3.977 -4.253 10.198 117 HG23 VAL 16 HG23 VAL 16 4.621 -5.087 11.611 118 H ALA 17 H ALA 17 7.918 -7.315 10.953 119 HA ALA 17 HA ALA 17 6.687 -7.744 13.546 120 HB1 ALA 17 HB1 ALA 17 8.204 -9.753 11.896 121 HB2 ALA 17 HB2 ALA 17 7.024 -10.063 13.171 122 HB3 ALA 17 HB3 ALA 17 6.502 -9.371 11.636 123 H ALA 18 H ALA 18 9.908 -7.675 12.114 124 HA ALA 18 HA ALA 18 11.396 -8.681 14.236 125 HB1 ALA 18 HB1 ALA 18 11.970 -6.859 11.962 126 HB2 ALA 18 HB2 ALA 18 13.157 -6.962 13.263 127 HB3 ALA 18 HB3 ALA 18 12.690 -8.415 12.379 128 H LEU 19 H LEU 19 9.882 -5.572 13.827 129 HA LEU 19 HA LEU 19 11.339 -4.233 15.886 130 HB2 LEU 19 HB2 LEU 19 9.141 -3.637 14.067 131 HB3 LEU 19 HB3 LEU 19 8.942 -2.900 15.655 132 HG LEU 19 HG LEU 19 11.334 -2.532 13.852 133 HD11 LEU 19 HD11 LEU 19 9.593 -1.388 12.799 134 HD12 LEU 19 HD12 LEU 19 10.386 -0.158 13.782 135 HD13 LEU 19 HD13 LEU 19 8.874 -0.883 14.329 136 HD21 LEU 19 HD21 LEU 19 12.340 -1.862 15.721 137 HD22 LEU 19 HD22 LEU 19 10.842 -1.955 16.648 138 HD23 LEU 19 HD23 LEU 19 11.223 -0.497 15.731 139 H LEU 20 H LEU 20 8.293 -5.996 15.729 140 HA LEU 20 HA LEU 20 7.451 -5.351 18.370 141 HB2 LEU 20 HB2 LEU 20 6.654 -7.761 16.753 142 HB3 LEU 20 HB3 LEU 20 5.754 -7.002 18.064 143 HG LEU 20 HG LEU 20 6.326 -5.465 15.562 144 HD11 LEU 20 HD11 LEU 20 4.738 -6.482 14.319 145 HD12 LEU 20 HD12 LEU 20 3.764 -6.923 15.721 146 HD13 LEU 20 HD13 LEU 20 5.187 -7.877 15.301 147 HD21 LEU 20 HD21 LEU 20 4.345 -5.378 17.803 148 HD22 LEU 20 HD22 LEU 20 3.970 -4.632 16.249 149 HD23 LEU 20 HD23 LEU 20 5.376 -4.095 17.169 150 H PHE 21 H PHE 21 8.661 -8.420 17.003 151 HA PHE 21 HA PHE 21 9.047 -9.633 19.534 152 HB2 PHE 21 HB2 PHE 21 9.540 -10.317 16.728 153 HB3 PHE 21 HB3 PHE 21 10.729 -10.997 17.834 154 HD1 PHE 21 HD1 PHE 21 10.101 -12.653 19.473 155 HD2 PHE 21 HD2 PHE 21 7.220 -10.992 16.818 156 HE1 PHE 21 HE1 PHE 21 8.530 -14.455 20.056 157 HE2 PHE 21 HE2 PHE 21 5.643 -12.790 17.397 158 HZ PHE 21 HZ PHE 21 6.297 -14.524 19.019 159 H GLY 22 H GLY 22 11.353 -8.251 17.193 160 HA2 GLY 22 HA2 GLY 22 13.511 -7.507 17.454 161 HA3 GLY 22 HA3 GLY 22 12.977 -6.977 19.043 162 HA PRO 23 HA PRO 23 14.841 -11.432 19.539 163 HB2 PRO 23 HB2 PRO 23 16.355 -12.302 17.460 164 HB3 PRO 23 HB3 PRO 23 14.623 -12.632 17.591 165 HG2 PRO 23 HG2 PRO 23 16.036 -10.535 15.988 166 HG3 PRO 23 HG3 PRO 23 14.679 -11.576 15.520 167 HD2 PRO 23 HD2 PRO 23 14.343 -8.999 16.279 168 HD3 PRO 23 HD3 PRO 23 13.129 -10.254 16.598 169 H LYS 24 H LYS 24 16.817 -9.397 17.373 170 HA LYS 24 HA LYS 24 18.570 -8.533 19.394 171 HB2 LYS 24 HB2 LYS 24 19.351 -10.843 19.404 172 HB3 LYS 24 HB3 LYS 24 19.614 -10.784 17.666 173 HG2 LYS 24 HG2 LYS 24 21.030 -8.652 18.985 174 HG3 LYS 24 HG3 LYS 24 21.456 -10.220 19.674 175 HD2 LYS 24 HD2 LYS 24 21.315 -10.190 16.748 176 HD3 LYS 24 HD3 LYS 24 22.561 -9.137 17.422 177 HE2 LYS 24 HE2 LYS 24 23.079 -11.254 18.897 178 HE3 LYS 24 3HE LYS 24 22.283 -12.101 17.572 179 HZ1 LYS 24 1HZ LYS 24 24.170 -10.207 16.602 180 HZ2 LYS 24 2HZ LYS 24 24.075 -11.870 16.309 181 HZ3 LYS 24 3HZ LYS 24 24.907 -11.297 17.666 182 H LYS 25 H LYS 25 17.937 -6.648 18.177 183 HA LYS 25 HA LYS 25 19.226 -6.369 15.556 184 HB2 LYS 25 HB2 LYS 25 17.010 -4.894 16.942 185 HB3 LYS 25 HB3 LYS 25 17.882 -4.141 15.613 186 HG2 LYS 25 HG2 LYS 25 16.656 -6.858 15.320 187 HG3 LYS 25 HG3 LYS 25 15.704 -5.388 15.097 188 HD2 LYS 25 HD2 LYS 25 16.549 -5.076 13.060 189 HD3 LYS 25 HD3 LYS 25 18.201 -5.215 13.666 190 HE2 LYS 25 HE2 LYS 25 18.282 -7.502 13.282 191 HE3 LYS 25 3HE LYS 25 16.526 -7.663 13.275 192 HZ1 LYS 25 1HZ LYS 25 18.320 -6.780 11.132 193 HZ2 LYS 25 2HZ LYS 25 16.757 -6.135 11.184 194 HZ3 LYS 25 3HZ LYS 25 16.978 -7.807 11.059 195 H LEU 26 H LEU 26 19.307 -5.205 18.833 196 HA LEU 26 HA LEU 26 21.909 -4.193 18.629 197 HB2 LEU 26 HB2 LEU 26 21.386 -1.768 18.954 198 HB3 LEU 26 HB3 LEU 26 21.071 -2.398 17.338 199 HG LEU 26 HG LEU 26 18.779 -2.350 19.210 200 HD11 LEU 26 HD11 LEU 26 19.302 0.211 17.845 201 HD12 LEU 26 HD12 LEU 26 20.281 -0.127 19.272 202 HD13 LEU 26 HD13 LEU 26 18.521 -0.117 19.392 203 HD21 LEU 26 HD21 LEU 26 19.292 -2.518 16.397 204 HD22 LEU 26 HD22 LEU 26 18.233 -1.147 16.728 205 HD23 LEU 26 HD23 LEU 26 17.780 -2.764 17.272 206 HA PRO 27 HA PRO 27 20.069 -4.931 22.854 207 HB2 PRO 27 HB2 PRO 27 21.872 -6.825 23.584 208 HB3 PRO 27 HB3 PRO 27 20.380 -7.203 22.717 209 HG2 PRO 27 HG2 PRO 27 23.161 -6.892 21.654 210 HG3 PRO 27 HG3 PRO 27 21.941 -8.115 21.254 211 HD2 PRO 27 HD2 PRO 27 22.431 -5.974 19.671 212 HD3 PRO 27 HD3 PRO 27 20.821 -6.708 19.813 213 H GLU 28 H GLU 28 23.022 -3.923 21.493 214 HA GLU 28 HA GLU 28 24.705 -3.612 23.669 215 HB2 GLU 28 HB2 GLU 28 25.659 -1.663 22.397 216 HB3 GLU 28 HB3 GLU 28 25.542 -3.160 21.483 217 HG2 GLU 28 HG2 GLU 28 24.245 -2.220 19.955 218 HG3 GLU 28 HG3 GLU 28 23.154 -1.575 21.181 219 H ILE 29 H ILE 29 21.893 -1.763 22.747 220 HA ILE 29 HA ILE 29 22.362 0.487 24.407 221 HB ILE 29 HB ILE 29 20.046 1.060 24.058 222 HG12 ILE 29 HG12 ILE 29 19.740 -1.728 22.920 223 HG13 ILE 29 HG13 ILE 29 19.064 -1.157 24.442 224 HG21 ILE 29 HG21 ILE 29 20.925 -0.189 21.477 225 HG22 ILE 29 HG22 ILE 29 20.078 1.335 21.737 226 HG23 ILE 29 HG23 ILE 29 21.779 1.186 22.176 227 HD11 ILE 29 HD11 ILE 29 17.228 -0.710 23.280 228 HD12 ILE 29 HD12 ILE 29 18.115 0.659 22.608 229 HD13 ILE 29 HD13 ILE 29 18.066 -0.874 21.737 230 H GLY 30 H GLY 30 20.969 -2.670 24.959 231 HA2 GLY 30 HA2 GLY 30 19.575 -2.164 27.338 232 HA3 GLY 30 HA3 GLY 30 20.259 -3.715 26.874 233 H LYS 31 H LYS 31 22.965 -2.320 26.732 234 HA LYS 31 HA LYS 31 23.673 -2.843 29.488 235 HB2 LYS 31 HB2 LYS 31 25.077 -2.632 26.919 236 HB3 LYS 31 HB3 LYS 31 25.970 -1.955 28.274 237 HG2 LYS 31 HG2 LYS 31 25.211 -4.278 29.368 238 HG3 LYS 31 HG3 LYS 31 25.272 -4.756 27.670 239 HD2 LYS 31 HD2 LYS 31 27.442 -5.164 28.259 240 HD3 LYS 31 HD3 LYS 31 27.586 -3.475 27.769 241 HE2 LYS 31 HE2 LYS 31 26.914 -4.100 30.604 242 HE3 LYS 31 3HE LYS 31 28.575 -4.324 30.057 243 HZ1 LYS 31 1HZ LYS 31 28.544 -2.154 30.813 244 HZ2 LYS 31 2HZ LYS 31 27.000 -1.836 30.202 245 HZ3 LYS 31 3HZ LYS 31 28.318 -1.954 29.148 246 H SER 32 H SER 32 23.256 -0.096 27.388 247 HA SER 32 HA SER 32 24.522 1.741 29.239 248 HB2 SER 32 HB2 SER 32 22.926 3.013 27.180 249 HB3 SER 32 HB3 SER 32 24.666 3.093 27.454 250 HG SER 32 HG SER 32 24.594 2.072 25.574 251 H ILE 33 H ILE 33 21.317 0.656 28.397 252 HA ILE 33 HA ILE 33 20.081 2.706 30.075 253 HB ILE 33 HB ILE 33 18.720 0.533 28.482 254 HG12 ILE 33 HG12 ILE 33 19.250 3.417 27.734 255 HG13 ILE 33 HG13 ILE 33 20.035 2.013 27.019 256 HG21 ILE 33 HG21 ILE 33 17.165 2.894 28.860 257 HG22 ILE 33 HG22 ILE 33 16.835 1.251 29.405 258 HG23 ILE 33 HG23 ILE 33 17.769 2.347 30.423 259 HD11 ILE 33 HD11 ILE 33 17.329 3.103 26.584 260 HD12 ILE 33 HD12 ILE 33 18.447 2.342 25.452 261 HD13 ILE 33 HD13 ILE 33 17.498 1.349 26.558 262 H GLY 34 H GLY 34 20.731 -0.736 29.993 263 HA2 GLY 34 HA2 GLY 34 19.025 -1.671 31.963 264 HA3 GLY 34 HA3 GLY 34 20.622 -2.329 31.643 265 H LYS 35 H LYS 35 22.221 -0.183 32.367 266 HA LYS 35 HA LYS 35 22.495 -0.540 35.112 267 HB2 LYS 35 HB2 LYS 35 24.039 1.381 35.037 268 HB3 LYS 35 HB3 LYS 35 24.328 0.249 33.723 269 HG2 LYS 35 HG2 LYS 35 23.031 1.732 32.222 270 HG3 LYS 35 HG3 LYS 35 22.897 2.891 33.546 271 HD2 LYS 35 HD2 LYS 35 25.619 2.227 33.365 272 HD3 LYS 35 HD3 LYS 35 25.064 2.470 31.707 273 HE2 LYS 35 HE2 LYS 35 25.852 4.565 32.605 274 HE3 LYS 35 3HE LYS 35 24.105 4.643 32.386 275 HZ1 LYS 35 1HZ LYS 35 25.326 3.937 34.986 276 HZ2 LYS 35 2HZ LYS 35 23.745 4.451 34.676 277 HZ3 LYS 35 3HZ LYS 35 25.030 5.543 34.544 278 H THR 36 H THR 36 20.531 1.697 33.321 279 HA THR 36 HA THR 36 19.962 3.337 35.650 280 HB THR 36 HB THR 36 18.334 3.613 33.179 281 HG1 THR 36 HG1 THR 36 20.045 3.780 31.957 282 HG21 THR 36 HG21 THR 36 19.811 5.843 34.468 283 HG22 THR 36 HG22 THR 36 18.513 5.087 35.393 284 HG23 THR 36 HG23 THR 36 18.174 5.798 33.815 285 H VAL 37 H VAL 37 17.924 1.540 33.332 286 HA VAL 37 HA VAL 37 15.572 1.567 34.773 287 HB VAL 37 HB VAL 37 16.542 -0.722 33.057 288 HG11 VAL 37 HG11 VAL 37 13.860 0.092 34.110 289 HG12 VAL 37 HG12 VAL 37 13.999 -0.829 32.611 290 HG13 VAL 37 HG13 VAL 37 14.627 -1.496 34.119 291 HG21 VAL 37 HG21 VAL 37 16.425 0.634 31.303 292 HG22 VAL 37 HG22 VAL 37 14.740 0.988 31.684 293 HG23 VAL 37 HG23 VAL 37 16.026 1.985 32.364 294 H LYS 38 H LYS 38 17.943 -1.101 34.714 295 HA LYS 38 HA LYS 38 16.791 -2.704 36.648 296 HB2 LYS 38 HB2 LYS 38 18.816 -3.179 35.157 297 HB3 LYS 38 HB3 LYS 38 19.772 -2.355 36.381 298 HG2 LYS 38 HG2 LYS 38 19.914 -4.696 36.784 299 HG3 LYS 38 HG3 LYS 38 18.913 -3.988 38.054 300 HD2 LYS 38 HD2 LYS 38 17.293 -5.420 37.540 301 HD3 LYS 38 HD3 LYS 38 17.186 -4.698 35.933 302 HE2 LYS 38 HE2 LYS 38 19.215 -6.806 36.624 303 HE3 LYS 38 3HE LYS 38 17.597 -7.208 36.052 304 HZ1 LYS 38 1HZ LYS 38 18.301 -5.481 34.192 305 HZ2 LYS 38 2HZ LYS 38 18.660 -7.130 34.074 306 HZ3 LYS 38 3HZ LYS 38 19.843 -6.043 34.604 307 H SER 39 H SER 39 18.877 0.103 37.042 308 HA SER 39 HA SER 39 19.298 -0.198 39.831 309 HB2 SER 39 HB2 SER 39 20.837 1.199 38.707 310 HB3 SER 39 HB3 SER 39 19.555 2.133 37.936 311 HG SER 39 HG SER 39 20.784 2.871 40.019 312 H PHE 40 H PHE 40 16.786 1.287 37.906 313 HA PHE 40 HA PHE 40 15.577 2.830 39.931 314 HB2 PHE 40 HB2 PHE 40 15.166 2.945 37.413 315 HB3 PHE 40 HB3 PHE 40 14.105 1.556 37.627 316 HD1 PHE 40 HD1 PHE 40 14.624 5.091 38.546 317 HD2 PHE 40 HD2 PHE 40 11.922 1.803 38.488 318 HE1 PHE 40 HE1 PHE 40 12.777 6.603 39.145 319 HE2 PHE 40 HE2 PHE 40 10.071 3.309 39.086 320 HZ PHE 40 HZ PHE 40 10.497 5.713 39.414 321 H GLN 41 H GLN 41 15.243 -0.535 38.987 322 HA GLN 41 HA GLN 41 12.948 -1.085 40.567 323 HB2 GLN 41 HB2 GLN 41 15.081 -2.919 39.464 324 HB3 GLN 41 HB3 GLN 41 13.600 -3.472 40.236 325 HG2 GLN 41 HG2 GLN 41 13.060 -1.573 38.124 326 HG3 GLN 41 HG3 GLN 41 13.983 -2.959 37.545 327 HE21 GLN 41 HE21 GLN 41 13.116 -5.086 37.980 328 HE22 GLN 41 HE22 GLN 41 11.405 -5.301 38.077 329 H GLN 42 H GLN 42 16.419 -1.295 41.141 330 HA GLN 42 HA GLN 42 16.245 -2.619 43.641 331 HB2 GLN 42 HB2 GLN 42 18.307 -1.571 41.949 332 HB3 GLN 42 HB3 GLN 42 18.580 -1.015 43.595 333 HG2 GLN 42 HG2 GLN 42 18.164 -3.889 42.807 334 HG3 GLN 42 HG3 GLN 42 19.734 -3.129 43.057 335 HE21 GLN 42 HE21 GLN 42 18.750 -5.372 44.466 336 HE22 GLN 42 HE22 GLN 42 18.601 -4.929 46.129 337 H ALA 43 H ALA 43 16.071 0.729 42.663 338 HA ALA 43 HA ALA 43 16.325 1.766 45.338 339 HB1 ALA 43 HB1 ALA 43 16.591 2.836 42.805 340 HB2 ALA 43 HB2 ALA 43 15.112 3.575 43.421 341 HB3 ALA 43 HB3 ALA 43 16.618 3.729 44.326 342 H ALA 44 H ALA 44 13.748 0.746 43.238 343 HA ALA 44 HA ALA 44 11.564 2.076 44.294 344 HB1 ALA 44 HB1 ALA 44 10.408 0.758 42.921 345 HB2 ALA 44 HB2 ALA 44 11.952 0.029 42.478 346 HB3 ALA 44 HB3 ALA 44 10.960 -0.706 43.737 347 H LYS 45 H LYS 45 13.140 -0.876 45.454 348 HA LYS 45 HA LYS 45 11.351 -1.585 47.456 349 HB2 LYS 45 HB2 LYS 45 13.568 -2.713 46.576 350 HB3 LYS 45 HB3 LYS 45 14.288 -1.866 47.938 351 HG2 LYS 45 HG2 LYS 45 13.657 -3.519 49.261 352 HG3 LYS 45 HG3 LYS 45 11.971 -3.130 48.913 353 HD2 LYS 45 HD2 LYS 45 12.504 -4.516 46.711 354 HD3 LYS 45 HD3 LYS 45 13.715 -5.246 47.767 355 HE2 LYS 45 HE2 LYS 45 11.116 -4.987 49.047 356 HE3 LYS 45 3HE LYS 45 11.055 -5.966 47.582 357 HZ1 LYS 45 1HZ LYS 45 11.571 -7.141 49.757 358 HZ2 LYS 45 2HZ LYS 45 13.101 -6.427 49.664 359 HZ3 LYS 45 3HZ LYS 45 12.584 -7.479 48.445 360 H GLU 46 H GLU 46 13.954 0.791 47.488 361 HA GLU 46 HA GLU 46 13.675 1.362 50.290 362 HB2 GLU 46 HB2 GLU 46 15.578 1.906 48.299 363 HB3 GLU 46 HB3 GLU 46 14.957 3.475 48.794 364 HG2 GLU 46 HG2 GLU 46 15.944 3.377 50.800 365 HG3 GLU 46 HG3 GLU 46 15.587 1.663 51.007 366 H PHE 47 H PHE 47 12.297 2.536 47.329 367 HA PHE 47 HA PHE 47 11.429 5.067 48.124 368 HB2 PHE 47 HB2 PHE 47 11.059 3.365 45.898 369 HB3 PHE 47 HB3 PHE 47 9.452 3.827 46.449 370 HD1 PHE 47 HD1 PHE 47 8.627 6.021 46.134 371 HD2 PHE 47 HD2 PHE 47 12.691 5.114 45.251 372 HE1 PHE 47 HE1 PHE 47 8.862 8.193 45.002 373 HE2 PHE 47 HE2 PHE 47 12.933 7.284 44.119 374 HZ PHE 47 HZ PHE 47 11.018 8.827 43.993 375 H GLU 48 H GLU 48 10.141 1.888 48.791 376 HA GLU 48 HA GLU 48 7.561 2.479 49.585 377 HB2 GLU 48 HB2 GLU 48 8.842 0.209 49.465 378 HB3 GLU 48 HB3 GLU 48 9.222 0.534 51.151 379 HG2 GLU 48 HG2 GLU 48 6.581 0.953 51.213 380 HG3 GLU 48 HG3 GLU 48 6.662 -0.209 49.891 381 H SER 49 H SER 49 10.581 2.951 51.307 382 HA SER 49 HA SER 49 9.194 3.814 53.717 383 HB2 SER 49 HB2 SER 49 11.248 2.424 53.885 384 HB3 SER 49 HB3 SER 49 12.165 3.732 53.138 385 HG SER 49 HG SER 49 12.384 4.399 55.118 386 H GLU 50 H GLU 50 10.814 5.148 50.951 387 HA GLU 50 HA GLU 50 11.460 7.693 51.883 388 HB2 GLU 50 HB2 GLU 50 10.709 6.638 49.172 389 HB3 GLU 50 HB3 GLU 50 11.021 8.351 49.414 390 HG2 GLU 50 HG2 GLU 50 13.075 6.570 50.505 391 HG3 GLU 50 HG3 GLU 50 12.895 6.510 48.752 392 H LEU 51 H LEU 51 8.388 6.328 50.944 393 HA LEU 51 HA LEU 51 6.921 8.685 50.573 394 HB2 LEU 51 HB2 LEU 51 6.346 6.113 50.271 395 HB3 LEU 51 HB3 LEU 51 5.620 6.345 51.861 396 HG LEU 51 HG LEU 51 4.417 8.354 50.689 397 HD11 LEU 51 HD11 LEU 51 5.873 7.753 48.578 398 HD12 LEU 51 HD12 LEU 51 4.214 8.328 48.415 399 HD13 LEU 51 HD13 LEU 51 4.566 6.605 48.289 400 HD21 LEU 51 HD21 LEU 51 3.645 5.910 51.483 401 HD22 LEU 51 HD22 LEU 51 3.318 5.777 49.755 402 HD23 LEU 51 HD23 LEU 51 2.563 7.062 50.700 403 H LYS 52 H LYS 52 7.860 6.965 53.475 404 HA LYS 52 HA LYS 52 6.242 8.708 55.159 405 HB2 LYS 52 HB2 LYS 52 8.062 6.389 55.827 406 HB3 LYS 52 HB3 LYS 52 7.154 7.310 57.019 407 HG2 LYS 52 HG2 LYS 52 5.230 6.265 56.548 408 HG3 LYS 52 HG3 LYS 52 5.542 6.256 54.810 409 HD2 LYS 52 HD2 LYS 52 6.504 4.212 54.863 410 HD3 LYS 52 HD3 LYS 52 7.278 4.504 56.423 411 HE2 LYS 52 HE2 LYS 52 5.744 3.157 57.313 412 HE3 LYS 52 3HE LYS 52 4.567 4.434 57.007 413 HZ1 LYS 52 1HZ LYS 52 3.816 2.351 56.081 414 HZ2 LYS 52 2HZ LYS 52 5.234 2.195 55.173 415 HZ3 LYS 52 3HZ LYS 52 4.143 3.441 54.829 416 H THR 53 H THR 53 7.030 10.290 56.465 417 HA THR 53 HA THR 53 9.923 10.837 56.291 418 HB THR 53 HB THR 53 9.354 13.251 56.533 419 HG1 THR 53 HG1 THR 53 7.143 12.671 57.369 420 HG21 THR 53 HG21 THR 53 8.992 13.589 54.266 421 HG22 THR 53 HG22 THR 53 7.891 12.218 54.134 422 HG23 THR 53 HG23 THR 53 9.624 11.943 54.300 Start of MODEL 3 1 H1 ALA 1 H ALA 1 -3.043 -9.100 2.410 2 HA ALA 1 HA ALA 1 -2.975 -11.280 1.726 3 HB1 ALA 1 HB1 ALA 1 -0.303 -11.938 1.327 4 HB2 ALA 1 HB2 ALA 1 -1.471 -11.451 0.098 5 HB3 ALA 1 HB3 ALA 1 -0.426 -10.245 0.850 6 H LEU 2 H LEU 2 -2.301 -13.410 2.519 7 HA LEU 2 HA LEU 2 -0.969 -13.328 5.136 8 HB2 LEU 2 HB2 LEU 2 -3.705 -13.666 4.772 9 HB3 LEU 2 HB3 LEU 2 -3.089 -15.297 5.030 10 HG LEU 2 HG LEU 2 -1.887 -13.873 7.049 11 HD11 LEU 2 HD11 LEU 2 -3.097 -12.130 7.716 12 HD12 LEU 2 HD12 LEU 2 -4.612 -13.012 7.528 13 HD13 LEU 2 HD13 LEU 2 -3.889 -12.195 6.142 14 HD21 LEU 2 HD21 LEU 2 -2.729 -15.964 7.555 15 HD22 LEU 2 HD22 LEU 2 -4.314 -15.609 6.867 16 HD23 LEU 2 HD23 LEU 2 -3.844 -14.900 8.413 17 H PHE 3 H PHE 3 -1.063 -15.926 5.847 18 HA PHE 3 HA PHE 3 -0.033 -17.931 5.542 19 HB2 PHE 3 HB2 PHE 3 -0.708 -17.584 2.616 20 HB3 PHE 3 HB3 PHE 3 -0.391 -19.096 3.463 21 HD1 PHE 3 HD1 PHE 3 -1.992 -19.549 5.514 22 HD2 PHE 3 HD2 PHE 3 -2.890 -16.984 2.238 23 HE1 PHE 3 HE1 PHE 3 -4.394 -19.790 5.989 24 HE2 PHE 3 HE2 PHE 3 -5.293 -17.219 2.708 25 HZ PHE 3 HZ PHE 3 -6.048 -18.623 4.586 26 H GLY 4 H GLY 4 1.451 -15.379 5.223 27 HA2 GLY 4 HA2 GLY 4 3.593 -14.712 4.741 28 HA3 GLY 4 HA3 GLY 4 3.980 -16.423 4.626 29 H LEU 5 H LEU 5 1.671 -14.721 2.587 30 HA LEU 5 HA LEU 5 3.183 -15.555 0.245 31 HB2 LEU 5 HB2 LEU 5 0.454 -14.328 0.580 32 HB3 LEU 5 HB3 LEU 5 1.177 -14.684 -0.988 33 HG LEU 5 HG LEU 5 0.740 -16.818 1.084 34 HD11 LEU 5 HD11 LEU 5 -1.201 -15.594 -0.821 35 HD12 LEU 5 HD12 LEU 5 -1.447 -16.162 0.831 36 HD13 LEU 5 HD13 LEU 5 -1.283 -17.323 -0.486 37 HD21 LEU 5 HD21 LEU 5 1.270 -16.767 -1.875 38 HD22 LEU 5 HD22 LEU 5 0.647 -18.196 -1.048 39 HD23 LEU 5 HD23 LEU 5 2.220 -17.533 -0.602 40 H GLY 6 H GLY 6 2.873 -13.814 -1.657 41 HA2 GLY 6 HA2 GLY 6 3.376 -11.714 -2.481 42 HA3 GLY 6 HA3 GLY 6 3.212 -11.079 -0.851 43 H VAL 7 H VAL 7 5.366 -11.947 -3.317 44 HA VAL 7 HA VAL 7 7.696 -12.508 -1.837 45 HB VAL 7 HB VAL 7 7.691 -11.123 -4.509 46 HG11 VAL 7 HG11 VAL 7 9.746 -11.941 -2.904 47 HG12 VAL 7 HG12 VAL 7 9.549 -13.319 -3.988 48 HG13 VAL 7 HG13 VAL 7 9.848 -11.711 -4.649 49 HG21 VAL 7 HG21 VAL 7 6.913 -13.920 -3.817 50 HG22 VAL 7 HG22 VAL 7 6.212 -12.821 -5.005 51 HG23 VAL 7 HG23 VAL 7 7.758 -13.602 -5.332 52 HA PRO 8 HA PRO 8 8.634 -7.771 -2.316 53 HB2 PRO 8 HB2 PRO 8 6.507 -6.177 -2.869 54 HB3 PRO 8 HB3 PRO 8 7.518 -6.897 -4.126 55 HG2 PRO 8 HG2 PRO 8 4.859 -7.798 -3.087 56 HG3 PRO 8 HG3 PRO 8 5.437 -7.716 -4.762 57 HD2 PRO 8 HD2 PRO 8 5.373 -10.028 -3.353 58 HD3 PRO 8 HD3 PRO 8 6.605 -9.696 -4.587 59 H GLU 9 H GLU 9 5.661 -8.958 -0.924 60 HA GLU 9 HA GLU 9 5.525 -6.914 1.107 61 HB2 GLU 9 HB2 GLU 9 3.813 -8.992 0.113 62 HB3 GLU 9 HB3 GLU 9 3.958 -9.145 1.858 63 HG2 GLU 9 HG2 GLU 9 3.507 -6.553 1.783 64 HG3 GLU 9 HG3 GLU 9 2.768 -6.962 0.236 65 H LEU 10 H LEU 10 6.910 -10.078 0.750 66 HA LEU 10 HA LEU 10 7.191 -10.803 3.441 67 HB2 LEU 10 HB2 LEU 10 7.590 -12.449 1.799 68 HB3 LEU 10 HB3 LEU 10 8.792 -11.449 0.982 69 HG LEU 10 HG LEU 10 9.529 -12.103 3.726 70 HD11 LEU 10 HD11 LEU 10 9.148 -14.333 1.737 71 HD12 LEU 10 HD12 LEU 10 8.347 -14.157 3.297 72 HD13 LEU 10 HD13 LEU 10 10.083 -14.457 3.227 73 HD21 LEU 10 HD21 LEU 10 11.648 -12.419 2.777 74 HD22 LEU 10 HD22 LEU 10 10.925 -11.117 1.833 75 HD23 LEU 10 HD23 LEU 10 10.979 -12.756 1.180 76 H ALA 11 H ALA 11 8.912 -8.510 1.494 77 HA ALA 11 HA ALA 11 11.176 -8.303 3.260 78 HB1 ALA 11 HB1 ALA 11 10.550 -7.445 0.644 79 HB2 ALA 11 HB2 ALA 11 10.921 -6.005 1.592 80 HB3 ALA 11 HB3 ALA 11 12.090 -7.322 1.494 81 H VAL 12 H VAL 12 8.079 -6.750 2.891 82 HA VAL 12 HA VAL 12 8.733 -4.531 4.619 83 HB VAL 12 HB VAL 12 6.049 -5.441 3.573 84 HG11 VAL 12 HG11 VAL 12 6.876 -2.858 4.893 85 HG12 VAL 12 HG12 VAL 12 5.300 -3.175 4.166 86 HG13 VAL 12 HG13 VAL 12 5.821 -4.092 5.580 87 HG21 VAL 12 HG21 VAL 12 6.326 -3.528 2.003 88 HG22 VAL 12 HG22 VAL 12 7.990 -3.364 2.565 89 HG23 VAL 12 HG23 VAL 12 7.478 -4.837 1.742 90 H ILE 13 H ILE 13 6.625 -7.393 4.832 91 HA ILE 13 HA ILE 13 5.722 -7.008 7.440 92 HB ILE 13 HB ILE 13 4.768 -8.684 5.911 93 HG12 ILE 13 HG12 ILE 13 5.802 -9.888 8.488 94 HG13 ILE 13 HG13 ILE 13 4.394 -8.841 8.352 95 HG21 ILE 13 HG21 ILE 13 6.828 -10.695 6.546 96 HG22 ILE 13 HG22 ILE 13 5.885 -10.458 5.075 97 HG23 ILE 13 HG23 ILE 13 7.295 -9.445 5.392 98 HD11 ILE 13 HD11 ILE 13 3.250 -10.489 7.021 99 HD12 ILE 13 HD12 ILE 13 4.681 -11.521 7.017 100 HD13 ILE 13 HD13 ILE 13 3.815 -11.221 8.523 101 H ALA 14 H ALA 14 8.786 -8.117 6.263 102 HA ALA 14 HA ALA 14 9.761 -9.579 8.401 103 HB1 ALA 14 HB1 ALA 14 11.171 -7.720 6.502 104 HB2 ALA 14 HB2 ALA 14 12.020 -8.730 7.675 105 HB3 ALA 14 HB3 ALA 14 11.042 -9.477 6.411 106 H GLY 15 H GLY 15 10.266 -6.082 7.854 107 HA2 GLY 15 HA2 GLY 15 11.449 -5.549 10.332 108 HA3 GLY 15 HA3 GLY 15 10.629 -4.362 9.328 109 H VAL 16 H VAL 16 8.107 -5.974 9.483 110 HA VAL 16 HA VAL 16 7.061 -4.701 11.835 111 HB VAL 16 HB VAL 16 5.648 -6.651 10.014 112 HG11 VAL 16 HG11 VAL 16 4.601 -4.504 11.858 113 HG12 VAL 16 HG12 VAL 16 3.623 -5.523 10.801 114 HG13 VAL 16 HG13 VAL 16 4.520 -6.243 12.138 115 HG21 VAL 16 HG21 VAL 16 6.339 -3.783 9.679 116 HG22 VAL 16 HG22 VAL 16 6.186 -5.060 8.471 117 HG23 VAL 16 HG23 VAL 16 4.741 -4.311 9.150 118 H ALA 17 H ALA 17 7.988 -7.944 10.908 119 HA ALA 17 HA ALA 17 6.812 -9.163 13.249 120 HB1 ALA 17 HB1 ALA 17 6.831 -10.532 11.327 121 HB2 ALA 17 HB2 ALA 17 8.541 -10.219 11.027 122 HB3 ALA 17 HB3 ALA 17 8.053 -11.203 12.408 123 H ALA 18 H ALA 18 9.857 -7.797 12.330 124 HA ALA 18 HA ALA 18 11.483 -9.096 14.260 125 HB1 ALA 18 HB1 ALA 18 12.732 -6.704 13.795 126 HB2 ALA 18 HB2 ALA 18 12.928 -8.167 12.828 127 HB3 ALA 18 HB3 ALA 18 11.777 -6.927 12.328 128 H LEU 19 H LEU 19 9.412 -6.283 14.333 129 HA LEU 19 HA LEU 19 10.425 -5.223 16.785 130 HB2 LEU 19 HB2 LEU 19 8.209 -4.650 14.938 131 HB3 LEU 19 HB3 LEU 19 7.915 -4.216 16.621 132 HG LEU 19 HG LEU 19 10.309 -3.267 15.058 133 HD11 LEU 19 HD11 LEU 19 7.903 -1.587 15.638 134 HD12 LEU 19 HD12 LEU 19 7.983 -2.573 14.179 135 HD13 LEU 19 HD13 LEU 19 9.194 -1.323 14.466 136 HD21 LEU 19 HD21 LEU 19 9.834 -1.437 16.980 137 HD22 LEU 19 HD22 LEU 19 10.929 -2.806 17.175 138 HD23 LEU 19 HD23 LEU 19 9.279 -2.900 17.793 139 H LEU 20 H LEU 20 8.090 -7.640 15.930 140 HA LEU 20 HA LEU 20 6.956 -7.715 18.610 141 HB2 LEU 20 HB2 LEU 20 6.405 -9.507 16.251 142 HB3 LEU 20 HB3 LEU 20 5.467 -9.410 17.740 143 HG LEU 20 HG LEU 20 5.738 -7.168 15.739 144 HD11 LEU 20 HD11 LEU 20 4.195 -9.543 15.595 145 HD12 LEU 20 HD12 LEU 20 4.178 -8.151 14.514 146 HD13 LEU 20 HD13 LEU 20 3.101 -8.196 15.910 147 HD21 LEU 20 HD21 LEU 20 4.094 -6.038 16.989 148 HD22 LEU 20 HD22 LEU 20 5.263 -6.626 18.173 149 HD23 LEU 20 HD23 LEU 20 3.728 -7.469 17.954 150 H PHE 21 H PHE 21 8.878 -9.775 16.457 151 HA PHE 21 HA PHE 21 9.164 -11.888 18.348 152 HB2 PHE 21 HB2 PHE 21 9.418 -12.032 15.806 153 HB3 PHE 21 HB3 PHE 21 11.023 -11.344 16.036 154 HD1 PHE 21 HD1 PHE 21 12.823 -12.663 16.814 155 HD2 PHE 21 HD2 PHE 21 8.871 -14.241 16.791 156 HE1 PHE 21 HE1 PHE 21 13.721 -14.910 17.262 157 HE2 PHE 21 HE2 PHE 21 9.762 -16.490 17.241 158 HZ PHE 21 HZ PHE 21 12.190 -16.826 17.478 159 H GLY 22 H GLY 22 11.099 -9.075 17.463 160 HA2 GLY 22 HA2 GLY 22 12.816 -8.027 18.573 161 HA3 GLY 22 HA3 GLY 22 12.376 -8.971 19.989 162 HA PRO 23 HA PRO 23 15.576 -11.584 17.440 163 HB2 PRO 23 HB2 PRO 23 16.956 -10.218 15.542 164 HB3 PRO 23 HB3 PRO 23 15.449 -11.077 15.203 165 HG2 PRO 23 HG2 PRO 23 15.895 -8.160 15.702 166 HG3 PRO 23 HG3 PRO 23 14.869 -8.942 14.487 167 HD2 PRO 23 HD2 PRO 23 13.876 -7.912 16.785 168 HD3 PRO 23 HD3 PRO 23 13.167 -9.332 15.990 169 H LYS 24 H LYS 24 18.127 -11.219 16.995 170 HA LYS 24 HA LYS 24 19.099 -10.009 19.429 171 HB2 LYS 24 HB2 LYS 24 19.932 -12.202 18.566 172 HB3 LYS 24 HB3 LYS 24 20.668 -11.346 17.218 173 HG2 LYS 24 HG2 LYS 24 21.920 -9.994 18.977 174 HG3 LYS 24 HG3 LYS 24 21.390 -11.225 20.126 175 HD2 LYS 24 HD2 LYS 24 22.858 -11.875 17.578 176 HD3 LYS 24 HD3 LYS 24 23.678 -11.573 19.113 177 HE2 LYS 24 HE2 LYS 24 23.479 -13.837 19.248 178 HE3 LYS 24 3HE LYS 24 21.938 -13.380 19.968 179 HZ1 LYS 24 1HZ LYS 24 20.927 -14.532 18.392 180 HZ2 LYS 24 2HZ LYS 24 22.403 -14.909 17.658 181 HZ3 LYS 24 3HZ LYS 24 21.570 -13.506 17.210 182 H LYS 25 H LYS 25 20.182 -9.741 16.038 183 HA LYS 25 HA LYS 25 20.703 -6.883 16.535 184 HB2 LYS 25 HB2 LYS 25 22.637 -8.786 16.074 185 HB3 LYS 25 HB3 LYS 25 22.361 -8.132 14.464 186 HG2 LYS 25 HG2 LYS 25 22.867 -5.908 15.226 187 HG3 LYS 25 HG3 LYS 25 22.998 -6.471 16.894 188 HD2 LYS 25 HD2 LYS 25 25.214 -6.274 16.100 189 HD3 LYS 25 HD3 LYS 25 24.851 -8.001 16.088 190 HE2 LYS 25 HE2 LYS 25 24.358 -7.872 13.691 191 HE3 LYS 25 3HE LYS 25 24.732 -6.149 13.708 192 HZ1 LYS 25 1HZ LYS 25 26.574 -7.578 12.916 193 HZ2 LYS 25 2HZ LYS 25 26.668 -8.269 14.457 194 HZ3 LYS 25 3HZ LYS 25 26.990 -6.623 14.249 195 H LEU 26 H LEU 26 18.342 -8.162 15.403 196 HA LEU 26 HA LEU 26 16.915 -7.998 13.634 197 HB2 LEU 26 HB2 LEU 26 18.500 -5.583 12.820 198 HB3 LEU 26 HB3 LEU 26 16.779 -5.886 12.601 199 HG LEU 26 HG LEU 26 16.989 -5.906 15.317 200 HD11 LEU 26 HD11 LEU 26 19.192 -4.249 14.209 201 HD12 LEU 26 HD12 LEU 26 19.118 -5.184 15.701 202 HD13 LEU 26 HD13 LEU 26 18.291 -3.630 15.594 203 HD21 LEU 26 HD21 LEU 26 16.379 -3.702 13.369 204 HD22 LEU 26 HD22 LEU 26 16.184 -3.496 15.109 205 HD23 LEU 26 HD23 LEU 26 15.255 -4.731 14.259 206 HA PRO 27 HA PRO 27 20.016 -9.851 10.714 207 HB2 PRO 27 HB2 PRO 27 18.712 -12.220 10.465 208 HB3 PRO 27 HB3 PRO 27 19.883 -11.897 11.750 209 HG2 PRO 27 HG2 PRO 27 16.891 -11.802 11.844 210 HG3 PRO 27 HG3 PRO 27 18.027 -12.476 13.028 211 HD2 PRO 27 HD2 PRO 27 16.873 -10.046 13.337 212 HD3 PRO 27 HD3 PRO 27 18.504 -10.411 13.934 213 H GLU 28 H GLU 28 16.631 -9.224 10.736 214 HA GLU 28 HA GLU 28 15.785 -10.107 8.259 215 HB2 GLU 28 HB2 GLU 28 14.153 -8.235 8.330 216 HB3 GLU 28 HB3 GLU 28 14.231 -9.146 9.833 217 HG2 GLU 28 HG2 GLU 28 14.468 -7.210 10.878 218 HG3 GLU 28 HG3 GLU 28 16.080 -7.112 10.173 219 H ILE 29 H ILE 29 17.799 -7.366 9.062 220 HA ILE 29 HA ILE 29 17.633 -5.907 6.694 221 HB ILE 29 HB ILE 29 19.765 -4.930 7.263 222 HG12 ILE 29 HG12 ILE 29 20.031 -7.184 9.264 223 HG13 ILE 29 HG13 ILE 29 20.978 -6.998 7.792 224 HG21 ILE 29 HG21 ILE 29 18.177 -5.528 9.756 225 HG22 ILE 29 HG22 ILE 29 19.298 -4.185 9.537 226 HG23 ILE 29 HG23 ILE 29 17.816 -4.262 8.584 227 HD11 ILE 29 HD11 ILE 29 21.453 -4.630 8.988 228 HD12 ILE 29 HD12 ILE 29 21.244 -5.674 10.394 229 HD13 ILE 29 HD13 ILE 29 22.463 -6.062 9.180 230 H GLY 30 H GLY 30 19.345 -8.859 7.429 231 HA2 GLY 30 HA2 GLY 30 21.045 -8.792 5.123 232 HA3 GLY 30 HA3 GLY 30 20.760 -10.176 6.167 233 H LYS 31 H LYS 31 17.783 -9.760 5.697 234 HA LYS 31 HA LYS 31 17.600 -11.544 3.455 235 HB2 LYS 31 HB2 LYS 31 15.760 -10.473 5.511 236 HB3 LYS 31 HB3 LYS 31 15.024 -10.917 3.977 237 HG2 LYS 31 HG2 LYS 31 15.937 -13.166 4.177 238 HG3 LYS 31 HG3 LYS 31 16.706 -12.724 5.702 239 HD2 LYS 31 HD2 LYS 31 13.805 -12.208 5.511 240 HD3 LYS 31 HD3 LYS 31 14.292 -13.905 5.534 241 HE2 LYS 31 HE2 LYS 31 15.779 -12.473 7.509 242 HE3 LYS 31 3HE LYS 31 14.065 -12.116 7.710 243 HZ1 LYS 31 1HZ LYS 31 13.627 -14.194 8.377 244 HZ2 LYS 31 2HZ LYS 31 15.283 -14.277 8.714 245 HZ3 LYS 31 3HZ LYS 31 14.683 -14.906 7.263 246 H SER 32 H SER 32 16.786 -8.170 4.095 247 HA SER 32 HA SER 32 15.490 -7.697 1.616 248 HB2 SER 32 HB2 SER 32 16.818 -5.760 3.527 249 HB3 SER 32 HB3 SER 32 15.777 -5.298 2.181 250 HG SER 32 HG SER 32 14.526 -5.380 4.021 251 H ILE 33 H ILE 33 18.776 -6.971 2.773 252 HA ILE 33 HA ILE 33 19.637 -6.010 0.211 253 HB ILE 33 HB ILE 33 21.359 -6.826 2.552 254 HG12 ILE 33 HG12 ILE 33 19.703 -5.162 3.253 255 HG13 ILE 33 HG13 ILE 33 21.313 -4.451 3.195 256 HG21 ILE 33 HG21 ILE 33 21.879 -5.664 -0.072 257 HG22 ILE 33 HG22 ILE 33 22.584 -4.745 1.258 258 HG23 ILE 33 HG23 ILE 33 22.981 -6.451 1.058 259 HD11 ILE 33 HD11 ILE 33 18.942 -3.596 1.902 260 HD12 ILE 33 HD12 ILE 33 20.544 -2.856 1.880 261 HD13 ILE 33 HD13 ILE 33 20.112 -4.061 0.667 262 H GLY 34 H GLY 34 19.727 -9.061 1.922 263 HA2 GLY 34 HA2 GLY 34 21.703 -10.434 0.567 264 HA3 GLY 34 HA3 GLY 34 20.237 -11.178 1.189 265 H LYS 35 H LYS 35 18.272 -10.185 -0.363 266 HA LYS 35 HA LYS 35 18.421 -11.717 -2.686 267 HB2 LYS 35 HB2 LYS 35 16.336 -10.863 -1.533 268 HB3 LYS 35 HB3 LYS 35 16.633 -9.313 -2.310 269 HG2 LYS 35 HG2 LYS 35 15.356 -10.088 -3.959 270 HG3 LYS 35 HG3 LYS 35 16.756 -11.063 -4.414 271 HD2 LYS 35 HD2 LYS 35 15.564 -12.543 -2.412 272 HD3 LYS 35 HD3 LYS 35 14.192 -11.878 -3.301 273 HE2 LYS 35 HE2 LYS 35 15.093 -12.764 -5.381 274 HE3 LYS 35 3HE LYS 35 16.506 -13.380 -4.526 275 HZ1 LYS 35 1HZ LYS 35 13.821 -14.454 -4.678 276 HZ2 LYS 35 2HZ LYS 35 14.516 -14.499 -3.136 277 HZ3 LYS 35 3HZ LYS 35 15.295 -15.250 -4.436 278 H THR 36 H THR 36 19.583 -8.546 -2.039 279 HA THR 36 HA THR 36 19.785 -7.833 -4.854 280 HB THR 36 HB THR 36 20.823 -6.311 -2.457 281 HG1 THR 36 HG1 THR 36 18.874 -5.377 -2.330 282 HG21 THR 36 HG21 THR 36 20.237 -4.483 -4.383 283 HG22 THR 36 HG22 THR 36 20.797 -5.842 -5.359 284 HG23 THR 36 HG23 THR 36 21.840 -5.163 -4.109 285 H VAL 37 H VAL 37 22.095 -7.969 -2.131 286 HA VAL 37 HA VAL 37 24.422 -7.878 -3.645 287 HB VAL 37 HB VAL 37 25.549 -8.941 -1.709 288 HG11 VAL 37 HG11 VAL 37 23.572 -6.745 -1.117 289 HG12 VAL 37 HG12 VAL 37 24.899 -7.196 -0.044 290 HG13 VAL 37 HG13 VAL 37 25.240 -6.569 -1.657 291 HG21 VAL 37 HG21 VAL 37 23.946 -9.222 0.327 292 HG22 VAL 37 HG22 VAL 37 22.716 -9.465 -0.914 293 HG23 VAL 37 HG23 VAL 37 24.118 -10.533 -0.840 294 H LYS 38 H LYS 38 22.457 -10.650 -2.689 295 HA LYS 38 HA LYS 38 24.257 -12.601 -3.750 296 HB2 LYS 38 HB2 LYS 38 22.520 -12.978 -1.936 297 HB3 LYS 38 HB3 LYS 38 21.312 -12.974 -3.214 298 HG2 LYS 38 HG2 LYS 38 21.655 -15.183 -3.235 299 HG3 LYS 38 HG3 LYS 38 23.087 -14.778 -4.184 300 HD2 LYS 38 HD2 LYS 38 24.319 -14.600 -1.968 301 HD3 LYS 38 HD3 LYS 38 22.906 -15.367 -1.238 302 HE2 LYS 38 HE2 LYS 38 23.300 -17.379 -2.267 303 HE3 LYS 38 3HE LYS 38 24.142 -16.641 -3.629 304 HZ1 LYS 38 1HZ LYS 38 25.171 -17.335 -0.967 305 HZ2 LYS 38 2HZ LYS 38 25.883 -16.056 -1.812 306 HZ3 LYS 38 3HZ LYS 38 25.859 -17.606 -2.488 307 H SER 39 H SER 39 21.803 -10.588 -5.071 308 HA SER 39 HA SER 39 21.246 -12.218 -7.368 309 HB2 SER 39 HB2 SER 39 19.461 -10.814 -6.914 310 HB3 SER 39 HB3 SER 39 20.502 -9.460 -6.474 311 HG SER 39 HG SER 39 20.223 -8.792 -8.435 312 H PHE 40 H PHE 40 23.526 -9.725 -6.538 313 HA PHE 40 HA PHE 40 24.349 -9.309 -9.287 314 HB2 PHE 40 HB2 PHE 40 24.318 -7.543 -7.390 315 HB3 PHE 40 HB3 PHE 40 25.828 -8.289 -6.876 316 HD1 PHE 40 HD1 PHE 40 24.165 -6.483 -9.624 317 HD2 PHE 40 HD2 PHE 40 27.852 -7.885 -8.028 318 HE1 PHE 40 HE1 PHE 40 25.390 -5.114 -11.262 319 HE2 PHE 40 HE2 PHE 40 29.083 -6.519 -9.661 320 HZ PHE 40 HZ PHE 40 27.853 -5.130 -11.281 321 H GLN 41 H GLN 41 25.285 -11.203 -6.541 322 HA GLN 41 HA GLN 41 27.948 -11.734 -7.055 323 HB2 GLN 41 HB2 GLN 41 25.761 -13.089 -5.633 324 HB3 GLN 41 HB3 GLN 41 27.045 -14.161 -6.176 325 HG2 GLN 41 HG2 GLN 41 27.909 -11.686 -4.831 326 HG3 GLN 41 HG3 GLN 41 27.071 -12.871 -3.828 327 HE21 GLN 41 HE21 GLN 41 29.271 -13.307 -6.563 328 HE22 GLN 41 HE22 GLN 41 30.450 -14.224 -5.695 329 H GLN 42 H GLN 42 25.080 -13.036 -8.599 330 HA GLN 42 HA GLN 42 26.160 -15.208 -9.943 331 HB2 GLN 42 HB2 GLN 42 24.298 -15.081 -11.419 332 HB3 GLN 42 HB3 GLN 42 23.735 -14.530 -9.847 333 HG2 GLN 42 HG2 GLN 42 22.814 -12.917 -11.137 334 HG3 GLN 42 HG3 GLN 42 24.384 -12.170 -10.852 335 HE21 GLN 42 HE21 GLN 42 24.117 -10.963 -12.766 336 HE22 GLN 42 HE22 GLN 42 24.370 -11.680 -14.318 337 H ALA 43 H ALA 43 26.397 -11.790 -10.646 338 HA ALA 43 HA ALA 43 27.670 -12.275 -13.217 339 HB1 ALA 43 HB1 ALA 43 27.921 -9.590 -12.741 340 HB2 ALA 43 HB2 ALA 43 26.583 -10.359 -13.597 341 HB3 ALA 43 HB3 ALA 43 26.437 -9.994 -11.878 342 H ALA 44 H ALA 44 28.507 -10.908 -10.048 343 HA ALA 44 HA ALA 44 31.153 -10.213 -10.600 344 HB1 ALA 44 HB1 ALA 44 31.055 -11.081 -7.922 345 HB2 ALA 44 HB2 ALA 44 30.936 -9.432 -8.536 346 HB3 ALA 44 HB3 ALA 44 29.476 -10.392 -8.295 347 H LYS 45 H LYS 45 29.703 -13.305 -9.918 348 HA LYS 45 HA LYS 45 32.056 -14.711 -9.221 349 HB2 LYS 45 HB2 LYS 45 29.301 -15.443 -10.074 350 HB3 LYS 45 HB3 LYS 45 30.544 -16.679 -10.218 351 HG2 LYS 45 HG2 LYS 45 31.072 -16.406 -7.836 352 HG3 LYS 45 HG3 LYS 45 29.784 -15.206 -7.703 353 HD2 LYS 45 HD2 LYS 45 28.358 -17.172 -8.772 354 HD3 LYS 45 HD3 LYS 45 29.616 -18.158 -8.024 355 HE2 LYS 45 HE2 LYS 45 28.776 -17.833 -5.983 356 HE3 LYS 45 3HE LYS 45 28.657 -16.092 -6.233 357 HZ1 LYS 45 1HZ LYS 45 26.546 -16.339 -7.239 358 HZ2 LYS 45 2HZ LYS 45 26.505 -17.258 -5.820 359 HZ3 LYS 45 3HZ LYS 45 26.687 -18.023 -7.318 360 H GLU 46 H GLU 46 30.642 -13.784 -12.266 361 HA GLU 46 HA GLU 46 32.353 -15.542 -13.808 362 HB2 GLU 46 HB2 GLU 46 30.005 -14.919 -14.488 363 HB3 GLU 46 HB3 GLU 46 30.602 -13.299 -14.819 364 HG2 GLU 46 HG2 GLU 46 30.668 -14.258 -16.900 365 HG3 GLU 46 HG3 GLU 46 32.317 -14.519 -16.335 366 H PHE 47 H PHE 47 32.340 -12.269 -12.669 367 HA PHE 47 HA PHE 47 34.019 -10.992 -14.450 368 HB2 PHE 47 HB2 PHE 47 33.083 -10.545 -11.778 369 HB3 PHE 47 HB3 PHE 47 34.798 -10.155 -11.856 370 HD1 PHE 47 HD1 PHE 47 35.593 -8.294 -13.138 371 HD2 PHE 47 HD2 PHE 47 31.463 -9.320 -13.125 372 HE1 PHE 47 HE1 PHE 47 35.055 -6.124 -14.165 373 HE2 PHE 47 HE2 PHE 47 30.917 -7.151 -14.153 374 HZ PHE 47 HZ PHE 47 32.714 -5.551 -14.674 375 H GLU 48 H GLU 48 34.785 -13.372 -12.018 376 HA GLU 48 HA GLU 48 37.509 -13.009 -11.706 377 HB2 GLU 48 HB2 GLU 48 37.622 -15.263 -10.963 378 HB3 GLU 48 HB3 GLU 48 36.036 -14.663 -10.497 379 HG2 GLU 48 HG2 GLU 48 35.081 -15.766 -12.496 380 HG3 GLU 48 HG3 GLU 48 36.671 -16.448 -12.834 381 H SER 49 H SER 49 35.743 -14.346 -14.397 382 HA SER 49 HA SER 49 38.133 -15.366 -15.685 383 HB2 SER 49 HB2 SER 49 36.705 -16.280 -17.322 384 HB3 SER 49 HB3 SER 49 35.778 -16.403 -15.826 385 HG SER 49 HG SER 49 34.508 -15.554 -17.510 386 H GLU 50 H GLU 50 36.056 -12.563 -15.825 387 HA GLU 50 HA GLU 50 36.811 -11.539 -18.317 388 HB2 GLU 50 HB2 GLU 50 35.813 -10.255 -15.789 389 HB3 GLU 50 HB3 GLU 50 36.241 -9.283 -17.191 390 HG2 GLU 50 HG2 GLU 50 34.636 -11.094 -18.358 391 HG3 GLU 50 HG3 GLU 50 33.932 -11.053 -16.742 392 H LEU 51 H LEU 51 37.941 -10.327 -15.158 393 HA LEU 51 HA LEU 51 40.686 -10.341 -15.998 394 HB2 LEU 51 HB2 LEU 51 39.388 -8.217 -16.927 395 HB3 LEU 51 HB3 LEU 51 39.722 -7.620 -15.303 396 HG LEU 51 HG LEU 51 42.183 -8.484 -16.039 397 HD11 LEU 51 HD11 LEU 51 42.500 -7.540 -18.357 398 HD12 LEU 51 HD12 LEU 51 40.747 -7.608 -18.532 399 HD13 LEU 51 HD13 LEU 51 41.664 -9.090 -18.264 400 HD21 LEU 51 HD21 LEU 51 42.260 -6.397 -15.199 401 HD22 LEU 51 HD22 LEU 51 40.764 -5.905 -15.994 402 HD23 LEU 51 HD23 LEU 51 42.278 -5.928 -16.900 403 H LYS 52 H LYS 52 38.911 -11.260 -13.798 404 HA LYS 52 HA LYS 52 38.930 -11.480 -11.532 405 HB2 LYS 52 HB2 LYS 52 41.757 -10.443 -11.806 406 HB3 LYS 52 HB3 LYS 52 41.109 -11.343 -10.441 407 HG2 LYS 52 HG2 LYS 52 40.637 -13.208 -12.117 408 HG3 LYS 52 HG3 LYS 52 41.695 -12.317 -13.214 409 HD2 LYS 52 HD2 LYS 52 43.567 -12.667 -11.900 410 HD3 LYS 52 HD3 LYS 52 42.616 -12.944 -10.439 411 HE2 LYS 52 HE2 LYS 52 41.860 -14.935 -12.279 412 HE3 LYS 52 3HE LYS 52 43.619 -14.841 -12.342 413 HZ1 LYS 52 1HZ LYS 52 42.971 -14.738 -9.671 414 HZ2 LYS 52 2HZ LYS 52 43.632 -16.053 -10.502 415 HZ3 LYS 52 3HZ LYS 52 41.956 -15.928 -10.315 416 H THR 53 H THR 53 37.518 -9.376 -12.024 417 HA THR 53 HA THR 53 36.709 -7.429 -11.161 418 HB THR 53 HB THR 53 38.792 -7.565 -8.994 419 HG1 THR 53 HG1 THR 53 37.921 -9.618 -9.017 420 HG21 THR 53 HG21 THR 53 35.894 -6.789 -8.785 421 HG22 THR 53 HG22 THR 53 37.139 -5.632 -9.254 422 HG23 THR 53 HG23 THR 53 37.214 -6.418 -7.677 Start of MODEL 4 1 H1 ALA 1 H ALA 1 11.061 -24.382 -0.689 2 HA ALA 1 HA ALA 1 13.088 -22.526 0.210 3 HB1 ALA 1 HB1 ALA 1 13.570 -23.243 -2.240 4 HB2 ALA 1 HB2 ALA 1 12.219 -22.177 -2.628 5 HB3 ALA 1 HB3 ALA 1 13.639 -21.536 -1.802 6 H LEU 2 H LEU 2 10.314 -22.426 -2.034 7 HA LEU 2 HA LEU 2 9.287 -20.042 -0.836 8 HB2 LEU 2 HB2 LEU 2 8.604 -21.795 -3.088 9 HB3 LEU 2 HB3 LEU 2 7.220 -21.022 -2.316 10 HG LEU 2 HG LEU 2 9.011 -18.944 -2.675 11 HD11 LEU 2 HD11 LEU 2 9.265 -19.301 -5.285 12 HD12 LEU 2 HD12 LEU 2 9.347 -20.993 -4.794 13 HD13 LEU 2 HD13 LEU 2 10.504 -19.831 -4.145 14 HD21 LEU 2 HD21 LEU 2 7.435 -18.246 -4.444 15 HD22 LEU 2 HD22 LEU 2 6.623 -18.794 -2.979 16 HD23 LEU 2 HD23 LEU 2 6.702 -19.849 -4.390 17 H PHE 3 H PHE 3 7.255 -19.802 0.228 18 HA PHE 3 HA PHE 3 6.081 -22.224 1.371 19 HB2 PHE 3 HB2 PHE 3 7.911 -21.028 2.864 20 HB3 PHE 3 HB3 PHE 3 6.577 -19.940 3.230 21 HD1 PHE 3 HD1 PHE 3 7.768 -23.411 3.460 22 HD2 PHE 3 HD2 PHE 3 4.776 -20.616 4.626 23 HE1 PHE 3 HE1 PHE 3 6.938 -25.006 5.141 24 HE2 PHE 3 HE2 PHE 3 3.942 -22.206 6.308 25 HZ PHE 3 HZ PHE 3 5.024 -24.403 6.569 26 H GLY 4 H GLY 4 5.167 -20.361 -0.635 27 HA2 GLY 4 HA2 GLY 4 3.263 -19.215 -1.210 28 HA3 GLY 4 HA3 GLY 4 2.518 -20.007 0.172 29 H LEU 5 H LEU 5 5.091 -17.560 -0.099 30 HA LEU 5 HA LEU 5 3.415 -15.755 1.511 31 HB2 LEU 5 HB2 LEU 5 6.391 -16.137 1.802 32 HB3 LEU 5 HB3 LEU 5 5.387 -15.020 2.726 33 HG LEU 5 HG LEU 5 4.873 -17.969 2.833 34 HD11 LEU 5 HD11 LEU 5 7.224 -17.770 3.322 35 HD12 LEU 5 HD12 LEU 5 6.337 -18.067 4.817 36 HD13 LEU 5 HD13 LEU 5 6.913 -16.442 4.443 37 HD21 LEU 5 HD21 LEU 5 3.425 -17.418 4.432 38 HD22 LEU 5 HD22 LEU 5 3.637 -15.743 3.925 39 HD23 LEU 5 HD23 LEU 5 4.604 -16.393 5.249 40 H GLY 6 H GLY 6 3.473 -13.601 0.981 41 HA2 GLY 6 HA2 GLY 6 4.009 -12.841 -1.624 42 HA3 GLY 6 HA3 GLY 6 3.873 -11.721 -0.276 43 H VAL 7 H VAL 7 5.879 -12.840 -2.672 44 HA VAL 7 HA VAL 7 8.417 -12.936 -1.580 45 HB VAL 7 HB VAL 7 7.354 -12.187 -4.254 46 HG11 VAL 7 HG11 VAL 7 9.812 -11.865 -4.957 47 HG12 VAL 7 HG12 VAL 7 8.969 -10.510 -4.205 48 HG13 VAL 7 HG13 VAL 7 10.092 -11.486 -3.258 49 HG21 VAL 7 HG21 VAL 7 9.322 -13.931 -4.705 50 HG22 VAL 7 HG22 VAL 7 8.990 -14.325 -3.018 51 HG23 VAL 7 HG23 VAL 7 7.703 -14.432 -4.218 52 HA PRO 8 HA PRO 8 8.819 -8.153 -2.163 53 HB2 PRO 8 HB2 PRO 8 6.542 -6.771 -2.687 54 HB3 PRO 8 HB3 PRO 8 7.571 -7.443 -3.957 55 HG2 PRO 8 HG2 PRO 8 5.038 -8.536 -2.795 56 HG3 PRO 8 HG3 PRO 8 5.551 -8.462 -4.491 57 HD2 PRO 8 HD2 PRO 8 5.739 -10.721 -3.009 58 HD3 PRO 8 HD3 PRO 8 6.895 -10.325 -4.296 59 H GLU 9 H GLU 9 5.591 -9.010 -0.915 60 HA GLU 9 HA GLU 9 5.455 -7.096 1.109 61 HB2 GLU 9 HB2 GLU 9 3.723 -8.900 0.194 62 HB3 GLU 9 HB3 GLU 9 4.281 -9.788 1.605 63 HG2 GLU 9 HG2 GLU 9 3.799 -7.323 2.658 64 HG3 GLU 9 HG3 GLU 9 2.550 -7.443 1.420 65 H LEU 10 H LEU 10 7.217 -10.073 0.930 66 HA LEU 10 HA LEU 10 7.603 -10.662 3.620 67 HB2 LEU 10 HB2 LEU 10 8.587 -11.573 1.179 68 HB3 LEU 10 HB3 LEU 10 10.016 -11.058 2.075 69 HG LEU 10 HG LEU 10 9.608 -13.434 2.378 70 HD11 LEU 10 HD11 LEU 10 8.814 -12.320 5.011 71 HD12 LEU 10 HD12 LEU 10 10.314 -11.739 4.288 72 HD13 LEU 10 HD13 LEU 10 10.095 -13.461 4.599 73 HD21 LEU 10 HD21 LEU 10 7.179 -13.071 3.989 74 HD22 LEU 10 HD22 LEU 10 7.618 -14.358 2.865 75 HD23 LEU 10 HD23 LEU 10 6.967 -12.836 2.254 76 H ALA 11 H ALA 11 9.250 -8.337 1.547 77 HA ALA 11 HA ALA 11 11.350 -7.656 3.277 78 HB1 ALA 11 HB1 ALA 11 9.980 -6.232 1.030 79 HB2 ALA 11 HB2 ALA 11 11.216 -5.417 1.989 80 HB3 ALA 11 HB3 ALA 11 11.615 -6.891 1.105 81 H VAL 12 H VAL 12 8.014 -6.566 3.111 82 HA VAL 12 HA VAL 12 8.362 -4.429 4.994 83 HB VAL 12 HB VAL 12 5.797 -5.762 4.117 84 HG11 VAL 12 HG11 VAL 12 4.892 -3.446 4.713 85 HG12 VAL 12 HG12 VAL 12 5.317 -4.520 6.048 86 HG13 VAL 12 HG13 VAL 12 6.408 -3.214 5.584 87 HG21 VAL 12 HG21 VAL 12 6.990 -4.929 2.186 88 HG22 VAL 12 HG22 VAL 12 5.613 -3.882 2.526 89 HG23 VAL 12 HG23 VAL 12 7.240 -3.372 2.975 90 H ILE 13 H ILE 13 6.548 -7.499 5.170 91 HA ILE 13 HA ILE 13 5.994 -7.417 7.894 92 HB ILE 13 HB ILE 13 4.973 -9.012 6.280 93 HG12 ILE 13 HG12 ILE 13 6.234 -10.396 8.654 94 HG13 ILE 13 HG13 ILE 13 4.865 -9.294 8.773 95 HG21 ILE 13 HG21 ILE 13 7.330 -9.613 5.368 96 HG22 ILE 13 HG22 ILE 13 7.330 -10.806 6.666 97 HG23 ILE 13 HG23 ILE 13 6.077 -10.853 5.426 98 HD11 ILE 13 HD11 ILE 13 4.593 -11.534 6.873 99 HD12 ILE 13 HD12 ILE 13 4.602 -11.937 8.590 100 HD13 ILE 13 HD13 ILE 13 3.407 -10.807 7.955 101 H ALA 14 H ALA 14 8.928 -8.210 6.234 102 HA ALA 14 HA ALA 14 10.262 -9.799 8.059 103 HB1 ALA 14 HB1 ALA 14 12.272 -8.211 7.153 104 HB2 ALA 14 HB2 ALA 14 11.604 -9.585 6.273 105 HB3 ALA 14 HB3 ALA 14 11.040 -7.953 5.918 106 H GLY 15 H GLY 15 10.409 -6.232 7.874 107 HA2 GLY 15 HA2 GLY 15 11.720 -6.065 10.436 108 HA3 GLY 15 HA3 GLY 15 11.198 -4.715 9.438 109 H VAL 16 H VAL 16 8.455 -5.569 9.214 110 HA VAL 16 HA VAL 16 7.354 -4.278 11.435 111 HB VAL 16 HB VAL 16 5.975 -6.218 9.573 112 HG11 VAL 16 HG11 VAL 16 4.662 -5.815 11.564 113 HG12 VAL 16 HG12 VAL 16 4.871 -4.073 11.385 114 HG13 VAL 16 HG13 VAL 16 3.934 -4.977 10.194 115 HG21 VAL 16 HG21 VAL 16 7.178 -3.766 8.986 116 HG22 VAL 16 HG22 VAL 16 6.042 -4.665 7.980 117 HG23 VAL 16 HG23 VAL 16 5.451 -3.426 9.088 118 H ALA 17 H ALA 17 7.469 -7.751 10.661 119 HA ALA 17 HA ALA 17 6.270 -8.534 13.136 120 HB1 ALA 17 HB1 ALA 17 7.894 -10.482 11.608 121 HB2 ALA 17 HB2 ALA 17 6.282 -10.646 12.306 122 HB3 ALA 17 HB3 ALA 17 6.501 -9.773 10.789 123 H ALA 18 H ALA 18 9.505 -7.913 12.053 124 HA ALA 18 HA ALA 18 10.834 -9.344 14.145 125 HB1 ALA 18 HB1 ALA 18 11.761 -7.253 12.191 126 HB2 ALA 18 HB2 ALA 18 12.823 -7.984 13.395 127 HB3 ALA 18 HB3 ALA 18 12.069 -8.990 12.159 128 H LEU 19 H LEU 19 9.397 -6.214 13.840 129 HA LEU 19 HA LEU 19 10.826 -4.918 15.927 130 HB2 LEU 19 HB2 LEU 19 8.305 -4.390 14.428 131 HB3 LEU 19 HB3 LEU 19 8.629 -3.480 15.902 132 HG LEU 19 HG LEU 19 10.564 -3.572 13.599 133 HD11 LEU 19 HD11 LEU 19 8.770 -1.242 14.035 134 HD12 LEU 19 HD12 LEU 19 8.140 -2.641 13.167 135 HD13 LEU 19 HD13 LEU 19 9.567 -1.799 12.564 136 HD21 LEU 19 HD21 LEU 19 11.653 -1.820 14.653 137 HD22 LEU 19 HD22 LEU 19 11.175 -2.843 16.007 138 HD23 LEU 19 HD23 LEU 19 10.245 -1.393 15.625 139 H LEU 20 H LEU 20 7.858 -6.810 15.796 140 HA LEU 20 HA LEU 20 7.371 -6.401 18.637 141 HB2 LEU 20 HB2 LEU 20 5.327 -7.638 18.286 142 HB3 LEU 20 HB3 LEU 20 5.488 -6.368 17.074 143 HG LEU 20 HG LEU 20 6.513 -8.414 15.686 144 HD11 LEU 20 HD11 LEU 20 5.662 -9.725 17.940 145 HD12 LEU 20 HD12 LEU 20 5.939 -10.461 16.362 146 HD13 LEU 20 HD13 LEU 20 4.316 -9.952 16.824 147 HD21 LEU 20 HD21 LEU 20 4.455 -8.510 14.526 148 HD22 LEU 20 HD22 LEU 20 4.581 -6.871 15.164 149 HD23 LEU 20 HD23 LEU 20 3.539 -8.052 15.961 150 H PHE 21 H PHE 21 8.261 -8.991 16.404 151 HA PHE 21 HA PHE 21 8.326 -11.028 18.399 152 HB2 PHE 21 HB2 PHE 21 8.129 -11.245 15.808 153 HB3 PHE 21 HB3 PHE 21 9.888 -11.176 15.840 154 HD1 PHE 21 HD1 PHE 21 11.150 -13.076 16.326 155 HD2 PHE 21 HD2 PHE 21 6.978 -13.048 17.165 156 HE1 PHE 21 HE1 PHE 21 11.237 -15.484 16.822 157 HE2 PHE 21 HE2 PHE 21 7.058 -15.457 17.663 158 HZ PHE 21 HZ PHE 21 9.189 -16.677 17.492 159 H GLY 22 H GLY 22 10.562 -8.629 17.284 160 HA2 GLY 22 HA2 GLY 22 12.690 -9.869 18.914 161 HA3 GLY 22 HA3 GLY 22 12.990 -8.829 17.531 162 HA PRO 23 HA PRO 23 13.487 -6.159 21.225 163 HB2 PRO 23 HB2 PRO 23 15.486 -4.674 20.141 164 HB3 PRO 23 HB3 PRO 23 15.768 -6.219 20.954 165 HG2 PRO 23 HG2 PRO 23 15.567 -5.628 18.026 166 HG3 PRO 23 HG3 PRO 23 16.718 -6.672 18.881 167 HD2 PRO 23 HD2 PRO 23 14.565 -7.650 17.563 168 HD3 PRO 23 HD3 PRO 23 15.221 -8.419 19.021 169 H LYS 24 H LYS 24 13.938 -3.577 21.013 170 HA LYS 24 HA LYS 24 13.034 -1.557 20.489 171 HB2 LYS 24 HB2 LYS 24 13.971 -2.208 18.222 172 HB3 LYS 24 HB3 LYS 24 12.348 -2.739 17.798 173 HG2 LYS 24 HG2 LYS 24 12.078 -0.664 17.032 174 HG3 LYS 24 HG3 LYS 24 11.888 -0.217 18.729 175 HD2 LYS 24 HD2 LYS 24 13.961 0.724 18.854 176 HD3 LYS 24 HD3 LYS 24 14.650 -0.374 17.657 177 HE2 LYS 24 HE2 LYS 24 12.588 1.431 16.614 178 HE3 LYS 24 3HE LYS 24 14.033 2.244 17.212 179 HZ1 LYS 24 1HZ LYS 24 15.199 1.557 15.467 180 HZ2 LYS 24 2HZ LYS 24 13.735 1.096 14.758 181 HZ3 LYS 24 3HZ LYS 24 14.657 -0.038 15.609 182 H LYS 25 H LYS 25 11.359 -1.906 22.026 183 HA LYS 25 HA LYS 25 8.746 -2.578 20.843 184 HB2 LYS 25 HB2 LYS 25 9.846 -3.838 22.922 185 HB3 LYS 25 HB3 LYS 25 9.111 -2.500 23.796 186 HG2 LYS 25 HG2 LYS 25 7.007 -3.242 23.441 187 HG3 LYS 25 HG3 LYS 25 7.390 -3.901 21.849 188 HD2 LYS 25 HD2 LYS 25 7.340 -5.912 22.820 189 HD3 LYS 25 HD3 LYS 25 8.874 -5.469 23.574 190 HE2 LYS 25 HE2 LYS 25 6.378 -4.542 24.885 191 HE3 LYS 25 3HE LYS 25 6.759 -6.259 24.985 192 HZ1 LYS 25 1HZ LYS 25 8.979 -5.601 25.839 193 HZ2 LYS 25 2HZ LYS 25 7.702 -5.180 26.863 194 HZ3 LYS 25 3HZ LYS 25 8.442 -3.998 25.907 195 H LEU 26 H LEU 26 10.597 -0.185 22.533 196 HA LEU 26 HA LEU 26 8.862 1.914 21.870 197 HB2 LEU 26 HB2 LEU 26 8.180 2.502 24.237 198 HB3 LEU 26 HB3 LEU 26 7.313 1.178 23.462 199 HG LEU 26 HG LEU 26 9.492 0.067 24.908 200 HD11 LEU 26 HD11 LEU 26 8.659 0.781 27.208 201 HD12 LEU 26 HD12 LEU 26 7.931 2.161 26.388 202 HD13 LEU 26 HD13 LEU 26 9.677 1.921 26.329 203 HD21 LEU 26 HD21 LEU 26 7.395 -1.057 24.368 204 HD22 LEU 26 HD22 LEU 26 6.518 0.052 25.423 205 HD23 LEU 26 HD23 LEU 26 7.693 -1.074 26.107 206 HA PRO 27 HA PRO 27 13.211 2.902 23.233 207 HB2 PRO 27 HB2 PRO 27 13.946 4.066 20.893 208 HB3 PRO 27 HB3 PRO 27 14.098 2.330 21.192 209 HG2 PRO 27 HG2 PRO 27 11.967 3.817 19.704 210 HG3 PRO 27 HG3 PRO 27 12.777 2.298 19.278 211 HD2 PRO 27 HD2 PRO 27 10.309 2.372 20.389 212 HD3 PRO 27 HD3 PRO 27 11.454 1.049 20.693 213 H GLU 28 H GLU 28 10.380 4.467 22.552 214 HA GLU 28 HA GLU 28 11.037 7.131 22.154 215 HB2 GLU 28 HB2 GLU 28 8.870 7.642 23.280 216 HB3 GLU 28 HB3 GLU 28 8.748 6.417 22.024 217 HG2 GLU 28 HG2 GLU 28 8.912 4.696 23.861 218 HG3 GLU 28 HG3 GLU 28 8.699 6.024 24.999 219 H ILE 29 H ILE 29 11.387 5.166 24.978 220 HA ILE 29 HA ILE 29 11.496 7.215 26.925 221 HB ILE 29 HB ILE 29 12.306 5.611 28.428 222 HG12 ILE 29 HG12 ILE 29 14.266 4.968 26.981 223 HG13 ILE 29 HG13 ILE 29 13.521 3.629 27.849 224 HG21 ILE 29 HG21 ILE 29 10.061 5.109 27.587 225 HG22 ILE 29 HG22 ILE 29 10.761 4.069 26.348 226 HG23 ILE 29 HG23 ILE 29 10.925 3.643 28.051 227 HD11 ILE 29 HD11 ILE 29 14.073 2.987 25.585 228 HD12 ILE 29 HD12 ILE 29 12.324 2.994 25.810 229 HD13 ILE 29 HD13 ILE 29 13.108 4.318 24.950 230 H GLY 30 H GLY 30 13.769 6.064 24.580 231 HA2 GLY 30 HA2 GLY 30 16.093 7.151 25.893 232 HA3 GLY 30 HA3 GLY 30 16.023 6.497 24.264 233 H LYS 31 H LYS 31 13.665 8.357 23.761 234 HA LYS 31 HA LYS 31 15.245 10.530 22.731 235 HB2 LYS 31 HB2 LYS 31 13.395 9.594 21.424 236 HB3 LYS 31 HB3 LYS 31 12.256 10.064 22.679 237 HG2 LYS 31 HG2 LYS 31 12.952 12.442 22.281 238 HG3 LYS 31 HG3 LYS 31 13.852 11.866 20.876 239 HD2 LYS 31 HD2 LYS 31 11.109 10.883 20.953 240 HD3 LYS 31 HD3 LYS 31 11.208 12.645 20.901 241 HE2 LYS 31 HE2 LYS 31 11.152 11.948 18.652 242 HE3 LYS 31 3HE LYS 31 12.837 12.352 18.980 243 HZ1 LYS 31 1HZ LYS 31 12.033 9.583 19.412 244 HZ2 LYS 31 2HZ LYS 31 13.483 10.206 18.805 245 HZ3 LYS 31 3HZ LYS 31 12.122 10.108 17.806 246 H SER 32 H SER 32 13.232 9.964 25.490 247 HA SER 32 HA SER 32 12.835 12.753 26.100 248 HB2 SER 32 HB2 SER 32 11.087 11.589 27.014 249 HB3 SER 32 HB3 SER 32 12.065 10.155 27.325 250 HG SER 32 HG SER 32 11.939 10.894 29.307 251 H ILE 33 H ILE 33 14.765 10.096 27.462 252 HA ILE 33 HA ILE 33 16.112 11.839 29.314 253 HB ILE 33 HB ILE 33 17.530 9.850 29.792 254 HG12 ILE 33 HG12 ILE 33 15.897 7.890 28.474 255 HG13 ILE 33 HG13 ILE 33 16.541 9.006 27.276 256 HG21 ILE 33 HG21 ILE 33 15.476 8.394 30.513 257 HG22 ILE 33 HG22 ILE 33 15.754 9.974 31.242 258 HG23 ILE 33 HG23 ILE 33 14.555 9.793 29.963 259 HD11 ILE 33 HD11 ILE 33 18.593 8.243 29.129 260 HD12 ILE 33 HD12 ILE 33 17.825 6.819 28.427 261 HD13 ILE 33 HD13 ILE 33 18.529 8.050 27.378 262 H GLY 34 H GLY 34 16.649 10.682 26.088 263 HA2 GLY 34 HA2 GLY 34 19.406 10.919 25.838 264 HA3 GLY 34 HA3 GLY 34 18.260 11.200 24.536 265 H LYS 35 H LYS 35 16.994 13.416 26.079 266 HA LYS 35 HA LYS 35 18.463 15.547 24.973 267 HB2 LYS 35 HB2 LYS 35 16.120 15.298 26.795 268 HB3 LYS 35 HB3 LYS 35 16.932 16.856 26.721 269 HG2 LYS 35 HG2 LYS 35 16.466 17.103 24.423 270 HG3 LYS 35 HG3 LYS 35 15.982 15.413 24.264 271 HD2 LYS 35 HD2 LYS 35 13.880 16.060 24.608 272 HD3 LYS 35 HD3 LYS 35 14.337 16.476 26.262 273 HE2 LYS 35 HE2 LYS 35 15.221 18.660 24.946 274 HE3 LYS 35 3HE LYS 35 13.854 18.211 23.927 275 HZ1 LYS 35 1HZ LYS 35 12.406 18.859 25.474 276 HZ2 LYS 35 2HZ LYS 35 13.701 19.674 26.195 277 HZ3 LYS 35 3HZ LYS 35 13.263 18.134 26.739 278 H THR 36 H THR 36 18.335 14.197 28.227 279 HA THR 36 HA THR 36 20.168 16.211 29.244 280 HB THR 36 HB THR 36 19.703 13.967 31.029 281 HG1 THR 36 HG1 THR 36 17.636 13.704 30.711 282 HG21 THR 36 HG21 THR 36 19.314 16.940 31.055 283 HG22 THR 36 HG22 THR 36 20.399 15.948 32.031 284 HG23 THR 36 HG23 THR 36 18.666 15.941 32.356 285 H VAL 37 H VAL 37 20.122 12.686 28.770 286 HA VAL 37 HA VAL 37 22.672 12.092 29.682 287 HB VAL 37 HB VAL 37 21.225 10.781 27.375 288 HG11 VAL 37 HG11 VAL 37 23.596 9.969 29.027 289 HG12 VAL 37 HG12 VAL 37 22.590 8.778 28.199 290 HG13 VAL 37 HG13 VAL 37 23.436 10.019 27.272 291 HG21 VAL 37 HG21 VAL 37 20.647 10.871 30.178 292 HG22 VAL 37 HG22 VAL 37 19.764 10.059 28.886 293 HG23 VAL 37 HG23 VAL 37 21.079 9.225 29.715 294 H LYS 38 H LYS 38 21.680 12.804 26.332 295 HA LYS 38 HA LYS 38 24.292 12.767 25.264 296 HB2 LYS 38 HB2 LYS 38 22.194 12.548 23.932 297 HB3 LYS 38 HB3 LYS 38 21.884 14.258 24.206 298 HG2 LYS 38 HG2 LYS 38 23.701 14.916 22.886 299 HG3 LYS 38 HG3 LYS 38 24.419 13.304 22.919 300 HD2 LYS 38 HD2 LYS 38 22.657 12.436 21.527 301 HD3 LYS 38 HD3 LYS 38 21.789 13.971 21.601 302 HE2 LYS 38 HE2 LYS 38 22.841 14.497 19.707 303 HE3 LYS 38 3HE LYS 38 24.290 14.694 20.692 304 HZ1 LYS 38 1HZ LYS 38 23.602 12.015 19.714 305 HZ2 LYS 38 2HZ LYS 38 25.121 12.684 20.039 306 HZ3 LYS 38 3HZ LYS 38 24.289 13.120 18.632 307 H SER 39 H SER 39 22.470 15.189 26.946 308 HA SER 39 HA SER 39 24.102 17.402 26.102 309 HB2 SER 39 HB2 SER 39 21.859 17.934 26.706 310 HB3 SER 39 HB3 SER 39 21.998 17.086 28.246 311 HG SER 39 HG SER 39 22.196 19.480 28.242 312 H PHE 40 H PHE 40 24.185 15.034 28.623 313 HA PHE 40 HA PHE 40 25.772 16.378 30.509 314 HB2 PHE 40 HB2 PHE 40 24.769 13.727 30.116 315 HB3 PHE 40 HB3 PHE 40 26.478 13.627 30.525 316 HD1 PHE 40 HD1 PHE 40 23.196 13.955 31.790 317 HD2 PHE 40 HD2 PHE 40 27.248 14.991 32.586 318 HE1 PHE 40 HE1 PHE 40 22.640 14.291 34.163 319 HE2 PHE 40 HE2 PHE 40 26.698 15.327 34.960 320 HZ PHE 40 HZ PHE 40 24.393 14.976 35.752 321 H GLN 41 H GLN 41 26.549 14.873 27.483 322 HA GLN 41 HA GLN 41 29.246 14.323 27.769 323 HB2 GLN 41 HB2 GLN 41 29.405 14.390 25.406 324 HB3 GLN 41 HB3 GLN 41 27.769 13.856 25.764 325 HG2 GLN 41 HG2 GLN 41 27.090 16.294 25.492 326 HG3 GLN 41 HG3 GLN 41 28.683 16.534 24.777 327 HE21 GLN 41 HE21 GLN 41 26.631 17.129 23.226 328 HE22 GLN 41 HE22 GLN 41 26.377 15.928 22.011 329 H GLN 42 H GLN 42 27.632 17.389 27.494 330 HA GLN 42 HA GLN 42 29.662 19.054 26.638 331 HB2 GLN 42 HB2 GLN 42 27.292 19.717 27.093 332 HB3 GLN 42 HB3 GLN 42 27.669 19.714 28.810 333 HG2 GLN 42 HG2 GLN 42 29.595 21.303 27.424 334 HG3 GLN 42 HG3 GLN 42 27.970 21.813 26.968 335 HE21 GLN 42 HE21 GLN 42 26.502 22.403 28.666 336 HE22 GLN 42 HE22 GLN 42 27.114 23.043 30.150 337 H ALA 43 H ALA 43 29.057 17.784 29.879 338 HA ALA 43 HA ALA 43 31.497 19.083 30.853 339 HB1 ALA 43 HB1 ALA 43 29.113 18.962 32.043 340 HB2 ALA 43 HB2 ALA 43 29.815 17.476 32.684 341 HB3 ALA 43 HB3 ALA 43 30.626 19.020 32.947 342 H ALA 44 H ALA 44 30.076 15.932 30.259 343 HA ALA 44 HA ALA 44 31.977 14.347 31.585 344 HB1 ALA 44 HB1 ALA 44 31.128 12.885 29.361 345 HB2 ALA 44 HB2 ALA 44 30.454 12.845 30.990 346 HB3 ALA 44 HB3 ALA 44 29.775 13.935 29.781 347 H LYS 45 H LYS 45 32.092 16.050 28.572 348 HA LYS 45 HA LYS 45 34.023 14.646 27.167 349 HB2 LYS 45 HB2 LYS 45 32.740 16.636 26.348 350 HB3 LYS 45 HB3 LYS 45 33.800 17.656 27.312 351 HG2 LYS 45 HG2 LYS 45 35.707 17.006 26.010 352 HG3 LYS 45 HG3 LYS 45 34.747 15.818 25.125 353 HD2 LYS 45 HD2 LYS 45 33.280 17.987 24.619 354 HD3 LYS 45 HD3 LYS 45 34.842 18.770 24.860 355 HE2 LYS 45 HE2 LYS 45 35.087 16.413 23.205 356 HE3 LYS 45 3HE LYS 45 33.910 17.544 22.536 357 HZ1 LYS 45 1HZ LYS 45 36.748 18.095 23.202 358 HZ2 LYS 45 2HZ LYS 45 35.634 19.298 22.787 359 HZ3 LYS 45 3HZ LYS 45 36.036 18.095 21.668 360 H GLU 46 H GLU 46 34.373 16.789 29.912 361 HA GLU 46 HA GLU 46 37.260 16.845 29.719 362 HB2 GLU 46 HB2 GLU 46 35.282 17.959 31.697 363 HB3 GLU 46 HB3 GLU 46 37.014 18.010 31.991 364 HG2 GLU 46 HG2 GLU 46 37.243 19.209 29.794 365 HG3 GLU 46 HG3 GLU 46 35.485 19.336 29.773 366 H PHE 47 H PHE 47 34.788 15.126 31.495 367 HA PHE 47 HA PHE 47 36.454 14.012 33.489 368 HB2 PHE 47 HB2 PHE 47 33.704 13.716 32.591 369 HB3 PHE 47 HB3 PHE 47 34.405 12.174 33.069 370 HD1 PHE 47 HD1 PHE 47 33.372 15.489 34.196 371 HD2 PHE 47 HD2 PHE 47 35.066 11.762 35.358 372 HE1 PHE 47 HE1 PHE 47 32.983 16.054 36.559 373 HE2 PHE 47 HE2 PHE 47 34.680 12.319 37.723 374 HZ PHE 47 HZ PHE 47 33.636 14.467 38.326 375 H GLU 48 H GLU 48 35.854 13.195 30.172 376 HA GLU 48 HA GLU 48 36.559 10.514 30.103 377 HB2 GLU 48 HB2 GLU 48 35.703 11.996 28.204 378 HB3 GLU 48 HB3 GLU 48 37.375 12.489 27.979 379 HG2 GLU 48 HG2 GLU 48 38.037 10.382 27.275 380 HG3 GLU 48 HG3 GLU 48 36.629 9.595 27.985 381 H SER 49 H SER 49 38.584 13.366 30.318 382 HA SER 49 HA SER 49 41.056 12.243 29.681 383 HB2 SER 49 HB2 SER 49 40.224 14.728 30.399 384 HB3 SER 49 HB3 SER 49 41.064 14.233 31.868 385 HG SER 49 HG SER 49 42.423 15.275 30.290 386 H GLU 50 H GLU 50 39.111 11.973 32.543 387 HA GLU 50 HA GLU 50 39.341 10.788 34.471 388 HB2 GLU 50 HB2 GLU 50 41.344 9.283 32.780 389 HB3 GLU 50 HB3 GLU 50 40.787 8.751 34.361 390 HG2 GLU 50 HG2 GLU 50 38.922 7.892 33.523 391 HG3 GLU 50 HG3 GLU 50 38.583 9.344 32.582 392 H LEU 51 H LEU 51 40.830 13.184 34.256 393 HA LEU 51 HA LEU 51 43.291 12.549 35.736 394 HB2 LEU 51 HB2 LEU 51 42.714 14.388 33.641 395 HB3 LEU 51 HB3 LEU 51 43.162 15.304 35.078 396 HG LEU 51 HG LEU 51 45.067 14.865 33.575 397 HD11 LEU 51 HD11 LEU 51 45.225 15.068 36.114 398 HD12 LEU 51 HD12 LEU 51 46.599 14.353 35.269 399 HD13 LEU 51 HD13 LEU 51 45.451 13.318 36.118 400 HD21 LEU 51 HD21 LEU 51 45.961 12.614 33.368 401 HD22 LEU 51 HD22 LEU 51 44.324 12.692 32.716 402 HD23 LEU 51 HD23 LEU 51 44.609 11.974 34.302 403 H LYS 52 H LYS 52 40.237 14.200 35.878 404 HA LYS 52 HA LYS 52 40.746 15.808 38.150 405 HB2 LYS 52 HB2 LYS 52 38.134 14.689 37.116 406 HB3 LYS 52 HB3 LYS 52 38.284 15.955 38.329 407 HG2 LYS 52 HG2 LYS 52 39.801 16.892 36.222 408 HG3 LYS 52 HG3 LYS 52 38.418 16.122 35.439 409 HD2 LYS 52 HD2 LYS 52 37.431 18.117 35.806 410 HD3 LYS 52 HD3 LYS 52 37.172 17.464 37.426 411 HE2 LYS 52 HE2 LYS 52 39.698 18.499 37.610 412 HE3 LYS 52 3HE LYS 52 38.909 19.641 36.524 413 HZ1 LYS 52 1HZ LYS 52 37.155 19.930 38.160 414 HZ2 LYS 52 2HZ LYS 52 38.662 20.302 38.833 415 HZ3 LYS 52 3HZ LYS 52 37.909 18.832 39.201 416 H THR 53 H THR 53 39.228 12.613 37.791 417 HA THR 53 HA THR 53 39.599 12.209 40.688 418 HB THR 53 HB THR 53 37.251 12.152 40.182 419 HG1 THR 53 HG1 THR 53 36.807 10.006 40.859 420 HG21 THR 53 HG21 THR 53 38.153 10.555 37.854 421 HG22 THR 53 HG22 THR 53 36.851 11.739 37.981 422 HG23 THR 53 HG23 THR 53 36.614 10.099 38.584 Start of MODEL 5 1 H1 ALA 1 H ALA 1 -0.251 -9.276 -2.348 2 HA ALA 1 HA ALA 1 -1.483 -7.317 -2.320 3 HB1 ALA 1 HB1 ALA 1 0.813 -6.076 -3.832 4 HB2 ALA 1 HB2 ALA 1 -0.569 -5.225 -3.140 5 HB3 ALA 1 HB3 ALA 1 0.595 -6.024 -2.083 6 H LEU 2 H LEU 2 -3.209 -7.654 -3.551 7 HA LEU 2 HA LEU 2 -4.561 -7.945 -5.357 8 HB2 LEU 2 HB2 LEU 2 -2.933 -5.722 -5.854 9 HB3 LEU 2 HB3 LEU 2 -2.950 -6.642 -7.357 10 HG LEU 2 HG LEU 2 -4.669 -4.990 -7.472 11 HD11 LEU 2 HD11 LEU 2 -6.018 -7.602 -6.824 12 HD12 LEU 2 HD12 LEU 2 -5.155 -7.286 -8.328 13 HD13 LEU 2 HD13 LEU 2 -6.584 -6.338 -7.915 14 HD21 LEU 2 HD21 LEU 2 -5.786 -6.124 -4.910 15 HD22 LEU 2 HD22 LEU 2 -6.429 -4.770 -5.842 16 HD23 LEU 2 HD23 LEU 2 -4.869 -4.622 -5.030 17 H PHE 3 H PHE 3 -2.319 -9.833 -4.878 18 HA PHE 3 HA PHE 3 -1.638 -11.798 -5.816 19 HB2 PHE 3 HB2 PHE 3 -3.923 -11.527 -7.042 20 HB3 PHE 3 HB3 PHE 3 -2.932 -11.074 -8.426 21 HD1 PHE 3 HD1 PHE 3 -0.932 -12.748 -8.908 22 HD2 PHE 3 HD2 PHE 3 -4.500 -13.732 -6.807 23 HE1 PHE 3 HE1 PHE 3 -0.585 -15.125 -9.439 24 HE2 PHE 3 HE2 PHE 3 -4.160 -16.111 -7.335 25 HZ PHE 3 HZ PHE 3 -2.200 -16.810 -8.652 26 H GLY 4 H GLY 4 -1.705 -9.536 -8.577 27 HA2 GLY 4 HA2 GLY 4 0.746 -10.330 -9.659 28 HA3 GLY 4 HA3 GLY 4 -0.029 -8.780 -9.950 29 H LEU 5 H LEU 5 0.062 -7.491 -7.614 30 HA LEU 5 HA LEU 5 2.892 -6.956 -7.325 31 HB2 LEU 5 HB2 LEU 5 0.627 -5.614 -5.873 32 HB3 LEU 5 HB3 LEU 5 2.252 -4.994 -6.151 33 HG LEU 5 HG LEU 5 1.087 -5.467 -8.687 34 HD11 LEU 5 HD11 LEU 5 -0.708 -3.922 -6.821 35 HD12 LEU 5 HD12 LEU 5 -1.093 -5.443 -7.625 36 HD13 LEU 5 HD13 LEU 5 -0.861 -3.977 -8.578 37 HD21 LEU 5 HD21 LEU 5 2.802 -3.781 -7.999 38 HD22 LEU 5 HD22 LEU 5 1.501 -2.842 -7.267 39 HD23 LEU 5 HD23 LEU 5 1.503 -3.140 -9.005 40 H GLY 6 H GLY 6 3.357 -6.193 -4.845 41 HA2 GLY 6 HA2 GLY 6 3.008 -6.876 -2.529 42 HA3 GLY 6 HA3 GLY 6 2.587 -8.471 -3.132 43 H VAL 7 H VAL 7 5.238 -6.834 -4.609 44 HA VAL 7 HA VAL 7 7.061 -8.901 -4.036 45 HB VAL 7 HB VAL 7 7.265 -6.199 -5.261 46 HG11 VAL 7 HG11 VAL 7 9.789 -6.670 -5.478 47 HG12 VAL 7 HG12 VAL 7 9.190 -5.977 -3.969 48 HG13 VAL 7 HG13 VAL 7 9.567 -7.699 -4.063 49 HG21 VAL 7 HG21 VAL 7 6.713 -8.287 -6.518 50 HG22 VAL 7 HG22 VAL 7 8.123 -7.423 -7.129 51 HG23 VAL 7 HG23 VAL 7 8.335 -8.873 -6.149 52 HA PRO 8 HA PRO 8 9.065 -5.865 -0.851 53 HB2 PRO 8 HB2 PRO 8 7.641 -3.655 -0.177 54 HB3 PRO 8 HB3 PRO 8 8.790 -3.684 -1.520 55 HG2 PRO 8 HG2 PRO 8 5.808 -3.940 -1.573 56 HG3 PRO 8 HG3 PRO 8 6.870 -3.008 -2.644 57 HD2 PRO 8 HD2 PRO 8 5.843 -5.414 -3.344 58 HD3 PRO 8 HD3 PRO 8 7.435 -4.857 -3.900 59 H GLU 9 H GLU 9 5.710 -6.654 -0.916 60 HA GLU 9 HA GLU 9 4.944 -6.275 1.724 61 HB2 GLU 9 HB2 GLU 9 3.846 -7.474 -0.536 62 HB3 GLU 9 HB3 GLU 9 3.925 -8.774 0.645 63 HG2 GLU 9 HG2 GLU 9 2.924 -6.646 2.089 64 HG3 GLU 9 HG3 GLU 9 2.152 -6.487 0.511 65 H LEU 10 H LEU 10 7.062 -8.646 0.339 66 HA LEU 10 HA LEU 10 7.004 -10.372 2.660 67 HB2 LEU 10 HB2 LEU 10 8.008 -10.495 -0.045 68 HB3 LEU 10 HB3 LEU 10 9.229 -11.026 1.111 69 HG LEU 10 HG LEU 10 6.589 -12.213 1.547 70 HD11 LEU 10 HD11 LEU 10 6.856 -13.795 -0.362 71 HD12 LEU 10 HD12 LEU 10 8.078 -12.709 -1.024 72 HD13 LEU 10 HD13 LEU 10 6.414 -12.154 -0.834 73 HD21 LEU 10 HD21 LEU 10 9.252 -12.743 2.157 74 HD22 LEU 10 HD22 LEU 10 8.796 -13.996 1.003 75 HD23 LEU 10 HD23 LEU 10 7.862 -13.777 2.484 76 H ALA 11 H ALA 11 8.864 -7.703 1.470 77 HA ALA 11 HA ALA 11 11.071 -8.163 3.294 78 HB1 ALA 11 HB1 ALA 11 10.669 -5.631 1.750 79 HB2 ALA 11 HB2 ALA 11 12.171 -6.425 2.228 80 HB3 ALA 11 HB3 ALA 11 11.185 -7.108 0.934 81 H VAL 12 H VAL 12 8.108 -6.376 3.197 82 HA VAL 12 HA VAL 12 8.857 -4.654 5.417 83 HB VAL 12 HB VAL 12 7.427 -3.802 3.566 84 HG11 VAL 12 HG11 VAL 12 5.431 -4.684 2.997 85 HG12 VAL 12 HG12 VAL 12 6.102 -6.144 3.727 86 HG13 VAL 12 HG13 VAL 12 5.022 -5.107 4.659 87 HG21 VAL 12 HG21 VAL 12 6.026 -2.497 4.951 88 HG22 VAL 12 HG22 VAL 12 5.929 -3.763 6.176 89 HG23 VAL 12 HG23 VAL 12 7.439 -2.887 5.931 90 H ILE 13 H ILE 13 7.021 -7.559 4.809 91 HA ILE 13 HA ILE 13 5.608 -7.609 7.274 92 HB ILE 13 HB ILE 13 4.893 -8.922 5.317 93 HG12 ILE 13 HG12 ILE 13 5.463 -11.049 7.296 94 HG13 ILE 13 HG13 ILE 13 4.682 -9.603 7.929 95 HG21 ILE 13 HG21 ILE 13 7.225 -10.732 5.915 96 HG22 ILE 13 HG22 ILE 13 6.052 -10.890 4.608 97 HG23 ILE 13 HG23 ILE 13 7.201 -9.552 4.605 98 HD11 ILE 13 HD11 ILE 13 2.742 -10.015 6.846 99 HD12 ILE 13 HD12 ILE 13 3.540 -10.779 5.470 100 HD13 ILE 13 HD13 ILE 13 3.326 -11.674 6.974 101 H ALA 14 H ALA 14 8.817 -8.490 6.326 102 HA ALA 14 HA ALA 14 9.324 -10.183 8.599 103 HB1 ALA 14 HB1 ALA 14 10.484 -10.462 6.423 104 HB2 ALA 14 HB2 ALA 14 11.317 -8.933 6.713 105 HB3 ALA 14 HB3 ALA 14 11.585 -10.303 7.793 106 H GLY 15 H GLY 15 10.248 -6.888 7.623 107 HA2 GLY 15 HA2 GLY 15 11.719 -6.333 9.994 108 HA3 GLY 15 HA3 GLY 15 11.142 -5.148 8.833 109 H VAL 16 H VAL 16 8.402 -5.569 8.986 110 HA VAL 16 HA VAL 16 7.658 -3.960 11.119 111 HB VAL 16 HB VAL 16 6.274 -4.375 9.091 112 HG11 VAL 16 HG11 VAL 16 5.061 -6.322 8.748 113 HG12 VAL 16 HG12 VAL 16 6.605 -6.931 9.345 114 HG13 VAL 16 HG13 VAL 16 5.216 -6.835 10.429 115 HG21 VAL 16 HG21 VAL 16 5.422 -3.380 11.264 116 HG22 VAL 16 HG22 VAL 16 4.202 -4.031 10.168 117 HG23 VAL 16 HG23 VAL 16 4.698 -4.956 11.585 118 H ALA 17 H ALA 17 8.113 -7.401 10.983 119 HA ALA 17 HA ALA 17 6.785 -7.847 13.532 120 HB1 ALA 17 HB1 ALA 17 6.773 -10.047 13.016 121 HB2 ALA 17 HB2 ALA 17 7.008 -9.428 11.380 122 HB3 ALA 17 HB3 ALA 17 8.390 -10.004 12.311 123 H ALA 18 H ALA 18 9.980 -7.365 12.271 124 HA ALA 18 HA ALA 18 11.453 -8.494 14.407 125 HB1 ALA 18 HB1 ALA 18 12.034 -7.230 11.968 126 HB2 ALA 18 HB2 ALA 18 12.851 -6.292 13.219 127 HB3 ALA 18 HB3 ALA 18 13.160 -8.023 13.071 128 H LEU 19 H LEU 19 9.924 -5.390 13.926 129 HA LEU 19 HA LEU 19 11.236 -4.131 16.157 130 HB2 LEU 19 HB2 LEU 19 9.194 -3.383 14.154 131 HB3 LEU 19 HB3 LEU 19 9.124 -2.539 15.700 132 HG LEU 19 HG LEU 19 11.592 -2.651 13.975 133 HD11 LEU 19 HD11 LEU 19 11.012 -0.682 12.942 134 HD12 LEU 19 HD12 LEU 19 9.853 -0.238 14.195 135 HD13 LEU 19 HD13 LEU 19 9.450 -1.498 13.029 136 HD21 LEU 19 HD21 LEU 19 10.800 -1.189 16.466 137 HD22 LEU 19 HD22 LEU 19 12.034 -0.539 15.385 138 HD23 LEU 19 HD23 LEU 19 12.262 -2.119 16.136 139 H LEU 20 H LEU 20 8.341 -5.973 15.628 140 HA LEU 20 HA LEU 20 7.098 -5.206 18.111 141 HB2 LEU 20 HB2 LEU 20 6.485 -7.335 16.076 142 HB3 LEU 20 HB3 LEU 20 5.544 -7.116 17.550 143 HG LEU 20 HG LEU 20 5.844 -5.118 15.307 144 HD11 LEU 20 HD11 LEU 20 3.223 -5.612 15.470 145 HD12 LEU 20 HD12 LEU 20 3.840 -7.179 15.989 146 HD13 LEU 20 HD13 LEU 20 4.309 -6.523 14.422 147 HD21 LEU 20 HD21 LEU 20 4.390 -4.974 17.940 148 HD22 LEU 20 HD22 LEU 20 4.061 -3.896 16.583 149 HD23 LEU 20 HD23 LEU 20 5.654 -3.900 17.342 150 H PHE 21 H PHE 21 8.517 -8.228 16.857 151 HA PHE 21 HA PHE 21 8.420 -9.570 19.354 152 HB2 PHE 21 HB2 PHE 21 9.194 -10.183 16.668 153 HB3 PHE 21 HB3 PHE 21 10.484 -10.687 17.755 154 HD1 PHE 21 HD1 PHE 21 9.529 -11.897 19.969 155 HD2 PHE 21 HD2 PHE 21 7.609 -11.751 16.172 156 HE1 PHE 21 HE1 PHE 21 8.256 -13.925 20.538 157 HE2 PHE 21 HE2 PHE 21 6.333 -13.778 16.736 158 HZ PHE 21 HZ PHE 21 6.654 -14.866 18.922 159 H GLY 22 H GLY 22 10.946 -7.762 17.661 160 HA2 GLY 22 HA2 GLY 22 13.057 -7.116 18.330 161 HA3 GLY 22 HA3 GLY 22 12.221 -6.703 19.820 162 HA PRO 23 HA PRO 23 14.944 -9.556 21.795 163 HB2 PRO 23 HB2 PRO 23 13.661 -9.689 24.184 164 HB3 PRO 23 HB3 PRO 23 14.630 -8.295 23.690 165 HG2 PRO 23 HG2 PRO 23 11.660 -8.664 23.602 166 HG3 PRO 23 HG3 PRO 23 12.597 -7.247 24.110 167 HD2 PRO 23 HD2 PRO 23 11.442 -7.429 21.668 168 HD3 PRO 23 HD3 PRO 23 12.961 -6.552 21.943 169 H LYS 24 H LYS 24 14.645 -11.581 23.269 170 HA LYS 24 HA LYS 24 12.511 -13.244 22.098 171 HB2 LYS 24 HB2 LYS 24 14.130 -15.163 22.569 172 HB3 LYS 24 HB3 LYS 24 14.537 -14.084 21.240 173 HG2 LYS 24 HG2 LYS 24 15.676 -13.205 23.759 174 HG3 LYS 24 HG3 LYS 24 16.194 -14.832 23.311 175 HD2 LYS 24 HD2 LYS 24 16.309 -12.457 21.456 176 HD3 LYS 24 HD3 LYS 24 17.662 -12.995 22.453 177 HE2 LYS 24 HE2 LYS 24 17.302 -15.283 21.339 178 HE3 LYS 24 3HE LYS 24 16.340 -14.399 20.155 179 HZ1 LYS 24 1HZ LYS 24 18.522 -12.903 20.191 180 HZ2 LYS 24 2HZ LYS 24 18.335 -14.222 19.150 181 HZ3 LYS 24 3HZ LYS 24 19.217 -14.394 20.583 182 H LYS 25 H LYS 25 14.132 -12.214 24.980 183 HA LYS 25 HA LYS 25 13.650 -12.464 27.189 184 HB2 LYS 25 HB2 LYS 25 11.148 -12.630 25.836 185 HB3 LYS 25 HB3 LYS 25 11.139 -13.816 27.134 186 HG2 LYS 25 HG2 LYS 25 12.037 -11.023 27.683 187 HG3 LYS 25 HG3 LYS 25 10.315 -11.395 27.578 188 HD2 LYS 25 HD2 LYS 25 10.322 -12.606 29.501 189 HD3 LYS 25 HD3 LYS 25 11.970 -13.189 29.256 190 HE2 LYS 25 HE2 LYS 25 12.551 -11.733 30.846 191 HE3 LYS 25 3HE LYS 25 12.324 -10.489 29.617 192 HZ1 LYS 25 1HZ LYS 25 10.302 -11.402 31.590 193 HZ2 LYS 25 2HZ LYS 25 10.008 -10.279 30.360 194 HZ3 LYS 25 3HZ LYS 25 11.108 -9.915 31.592 195 H LEU 26 H LEU 26 14.775 -14.696 25.481 196 HA LEU 26 HA LEU 26 14.710 -16.710 27.573 197 HB2 LEU 26 HB2 LEU 26 14.033 -17.390 24.715 198 HB3 LEU 26 HB3 LEU 26 14.228 -18.539 26.038 199 HG LEU 26 HG LEU 26 12.086 -16.419 25.971 200 HD11 LEU 26 HD11 LEU 26 12.044 -19.271 25.018 201 HD12 LEU 26 HD12 LEU 26 11.621 -17.814 24.121 202 HD13 LEU 26 HD13 LEU 26 10.584 -18.371 25.435 203 HD21 LEU 26 HD21 LEU 26 11.531 -18.792 27.494 204 HD22 LEU 26 HD22 LEU 26 11.570 -17.108 28.018 205 HD23 LEU 26 HD23 LEU 26 13.052 -18.067 28.019 206 HA PRO 27 HA PRO 27 18.835 -15.971 25.514 207 HB2 PRO 27 HB2 PRO 27 20.174 -15.450 27.816 208 HB3 PRO 27 HB3 PRO 27 19.336 -14.201 26.889 209 HG2 PRO 27 HG2 PRO 27 18.433 -15.674 29.333 210 HG3 PRO 27 HG3 PRO 27 18.288 -13.949 28.950 211 HD2 PRO 27 HD2 PRO 27 16.228 -15.682 28.663 212 HD3 PRO 27 HD3 PRO 27 16.444 -14.273 27.605 213 H GLU 28 H GLU 28 17.560 -17.973 28.015 214 HA GLU 28 HA GLU 28 19.738 -19.544 28.713 215 HB2 GLU 28 HB2 GLU 28 18.175 -21.198 29.430 216 HB3 GLU 28 HB3 GLU 28 17.442 -19.628 29.725 217 HG2 GLU 28 HG2 GLU 28 16.100 -19.859 27.708 218 HG3 GLU 28 HG3 GLU 28 16.848 -21.423 27.384 219 H ILE 29 H ILE 29 17.887 -19.483 25.777 220 HA ILE 29 HA ILE 29 18.719 -22.032 24.799 221 HB ILE 29 HB ILE 29 17.805 -21.344 22.664 222 HG12 ILE 29 HG12 ILE 29 16.699 -18.868 22.925 223 HG13 ILE 29 HG13 ILE 29 18.204 -18.654 23.811 224 HG21 ILE 29 HG21 ILE 29 16.327 -21.940 24.658 225 HG22 ILE 29 HG22 ILE 29 15.962 -20.218 24.749 226 HG23 ILE 29 HG23 ILE 29 15.558 -21.130 23.294 227 HD11 ILE 29 HD11 ILE 29 19.038 -18.148 21.802 228 HD12 ILE 29 HD12 ILE 29 19.086 -19.897 21.572 229 HD13 ILE 29 HD13 ILE 29 17.730 -18.961 20.942 230 H GLY 30 H GLY 30 20.036 -18.804 24.713 231 HA2 GLY 30 HA2 GLY 30 21.812 -19.058 22.560 232 HA3 GLY 30 HA3 GLY 30 22.033 -17.984 23.933 233 H LYS 31 H LYS 31 21.903 -20.487 25.689 234 HA LYS 31 HA LYS 31 24.712 -20.863 25.885 235 HB2 LYS 31 HB2 LYS 31 22.462 -22.432 27.159 236 HB3 LYS 31 HB3 LYS 31 24.155 -22.509 27.631 237 HG2 LYS 31 HG2 LYS 31 22.393 -20.072 27.798 238 HG3 LYS 31 HG3 LYS 31 22.860 -21.110 29.148 239 HD2 LYS 31 HD2 LYS 31 25.264 -20.432 27.930 240 HD3 LYS 31 HD3 LYS 31 24.315 -18.945 27.885 241 HE2 LYS 31 HE2 LYS 31 23.821 -19.758 30.408 242 HE3 LYS 31 3HE LYS 31 25.440 -20.416 30.181 243 HZ1 LYS 31 1HZ LYS 31 25.080 -17.990 31.045 244 HZ2 LYS 31 2HZ LYS 31 24.942 -17.637 29.397 245 HZ3 LYS 31 3HZ LYS 31 26.355 -18.352 29.993 246 H SER 32 H SER 32 22.076 -23.070 24.945 247 HA SER 32 HA SER 32 23.938 -25.085 24.063 248 HB2 SER 32 HB2 SER 32 21.096 -24.921 24.596 249 HB3 SER 32 HB3 SER 32 21.400 -25.720 23.054 250 HG SER 32 HG SER 32 21.840 -26.612 25.587 251 H ILE 33 H ILE 33 21.607 -22.907 22.496 252 HA ILE 33 HA ILE 33 22.183 -23.708 19.851 253 HB ILE 33 HB ILE 33 21.145 -21.023 20.761 254 HG12 ILE 33 HG12 ILE 33 19.798 -22.886 21.655 255 HG13 ILE 33 HG13 ILE 33 18.910 -21.961 20.449 256 HG21 ILE 33 HG21 ILE 33 21.578 -20.671 18.549 257 HG22 ILE 33 HG22 ILE 33 21.398 -22.373 18.129 258 HG23 ILE 33 HG23 ILE 33 19.969 -21.381 18.419 259 HD11 ILE 33 HD11 ILE 33 18.559 -23.791 19.264 260 HD12 ILE 33 HD12 ILE 33 20.292 -24.108 19.171 261 HD13 ILE 33 HD13 ILE 33 19.354 -24.728 20.530 262 H GLY 34 H GLY 34 23.661 -21.383 22.011 263 HA2 GLY 34 HA2 GLY 34 25.079 -19.783 20.263 264 HA3 GLY 34 HA3 GLY 34 25.653 -20.248 21.858 265 H LYS 35 H LYS 35 26.144 -22.891 21.639 266 HA LYS 35 HA LYS 35 28.634 -22.997 20.387 267 HB2 LYS 35 HB2 LYS 35 27.622 -24.517 22.220 268 HB3 LYS 35 HB3 LYS 35 26.974 -25.455 20.880 269 HG2 LYS 35 HG2 LYS 35 29.027 -26.216 20.234 270 HG3 LYS 35 HG3 LYS 35 29.873 -24.803 20.871 271 HD2 LYS 35 HD2 LYS 35 30.049 -25.682 22.955 272 HD3 LYS 35 HD3 LYS 35 28.499 -26.519 22.848 273 HE2 LYS 35 HE2 LYS 35 30.924 -27.390 21.297 274 HE3 LYS 35 3HE LYS 35 30.582 -27.971 22.926 275 HZ1 LYS 35 1HZ LYS 35 29.368 -28.707 20.428 276 HZ2 LYS 35 2HZ LYS 35 28.235 -28.351 21.633 277 HZ3 LYS 35 3HZ LYS 35 29.407 -29.543 21.899 278 H THR 36 H THR 36 25.476 -23.438 19.101 279 HA THR 36 HA THR 36 26.420 -24.843 16.733 280 HB THR 36 HB THR 36 23.638 -23.794 17.267 281 HG1 THR 36 HG1 THR 36 23.919 -25.250 18.865 282 HG21 THR 36 HG21 THR 36 24.179 -26.206 15.630 283 HG22 THR 36 HG22 THR 36 24.612 -24.647 14.927 284 HG23 THR 36 HG23 THR 36 22.951 -24.954 15.434 285 H VAL 37 H VAL 37 24.517 -21.872 17.295 286 HA VAL 37 HA VAL 37 24.768 -20.812 14.739 287 HB VAL 37 HB VAL 37 24.302 -18.604 15.771 288 HG11 VAL 37 HG11 VAL 37 22.148 -19.374 16.945 289 HG12 VAL 37 HG12 VAL 37 22.380 -19.817 15.252 290 HG13 VAL 37 HG13 VAL 37 22.672 -21.004 16.524 291 HG21 VAL 37 HG21 VAL 37 24.911 -20.140 18.258 292 HG22 VAL 37 HG22 VAL 37 25.401 -18.510 17.797 293 HG23 VAL 37 HG23 VAL 37 23.744 -18.819 18.315 294 H LYS 38 H LYS 38 26.897 -20.497 17.537 295 HA LYS 38 HA LYS 38 28.654 -18.615 16.295 296 HB2 LYS 38 HB2 LYS 38 28.386 -18.864 18.764 297 HB3 LYS 38 HB3 LYS 38 29.195 -20.422 18.658 298 HG2 LYS 38 HG2 LYS 38 30.690 -18.237 17.426 299 HG3 LYS 38 HG3 LYS 38 30.413 -18.032 19.157 300 HD2 LYS 38 HD2 LYS 38 31.216 -20.742 18.438 301 HD3 LYS 38 HD3 LYS 38 32.420 -19.524 18.009 302 HE2 LYS 38 HE2 LYS 38 31.306 -19.071 20.647 303 HE3 LYS 38 3HE LYS 38 32.030 -20.672 20.506 304 HZ1 LYS 38 1HZ LYS 38 34.091 -19.727 19.872 305 HZ2 LYS 38 2HZ LYS 38 33.574 -18.877 21.239 306 HZ3 LYS 38 3HZ LYS 38 33.424 -18.181 19.704 307 H SER 39 H SER 39 28.329 -22.045 16.253 308 HA SER 39 HA SER 39 31.024 -22.630 15.477 309 HB2 SER 39 HB2 SER 39 29.996 -24.471 16.453 310 HB3 SER 39 HB3 SER 39 28.466 -24.187 15.621 311 HG SER 39 HG SER 39 30.819 -25.394 14.673 312 H PHE 40 H PHE 40 28.011 -21.964 13.812 313 HA PHE 40 HA PHE 40 29.002 -22.695 11.219 314 HB2 PHE 40 HB2 PHE 40 26.549 -22.641 12.010 315 HB3 PHE 40 HB3 PHE 40 26.633 -20.906 11.725 316 HD1 PHE 40 HD1 PHE 40 27.250 -24.162 10.032 317 HD2 PHE 40 HD2 PHE 40 26.151 -20.070 9.628 318 HE1 PHE 40 HE1 PHE 40 26.749 -24.535 7.653 319 HE2 PHE 40 HE2 PHE 40 25.647 -20.436 7.248 320 HZ PHE 40 HZ PHE 40 25.945 -22.671 6.258 321 H GLN 41 H GLN 41 28.828 -19.773 13.128 322 HA GLN 41 HA GLN 41 29.312 -17.910 11.069 323 HB2 GLN 41 HB2 GLN 41 29.504 -17.907 14.035 324 HB3 GLN 41 HB3 GLN 41 30.368 -16.641 13.173 325 HG2 GLN 41 HG2 GLN 41 27.948 -16.548 11.954 326 HG3 GLN 41 HG3 GLN 41 27.495 -17.020 13.591 327 HE21 GLN 41 HE21 GLN 41 28.796 -14.532 11.582 328 HE22 GLN 41 HE22 GLN 41 28.801 -13.280 12.771 329 H GLN 42 H GLN 42 31.483 -19.725 13.188 330 HA GLN 42 HA GLN 42 33.887 -18.498 12.497 331 HB2 GLN 42 HB2 GLN 42 33.272 -20.400 14.242 332 HB3 GLN 42 HB3 GLN 42 33.846 -21.445 12.949 333 HG2 GLN 42 HG2 GLN 42 35.879 -19.752 12.987 334 HG3 GLN 42 HG3 GLN 42 35.335 -19.529 14.648 335 HE21 GLN 42 HE21 GLN 42 37.770 -20.489 14.392 336 HE22 GLN 42 HE22 GLN 42 37.838 -22.180 14.736 337 H ALA 43 H ALA 43 32.088 -21.066 10.893 338 HA ALA 43 HA ALA 43 34.133 -21.567 8.938 339 HB1 ALA 43 HB1 ALA 43 32.949 -23.466 8.991 340 HB2 ALA 43 HB2 ALA 43 31.504 -22.661 9.606 341 HB3 ALA 43 HB3 ALA 43 31.858 -22.640 7.878 342 H ALA 44 H ALA 44 31.429 -19.425 9.242 343 HA ALA 44 HA ALA 44 31.156 -18.848 6.449 344 HB1 ALA 44 HB1 ALA 44 30.206 -17.211 8.795 345 HB2 ALA 44 HB2 ALA 44 29.632 -17.117 7.130 346 HB3 ALA 44 HB3 ALA 44 29.319 -18.562 8.089 347 H LYS 45 H LYS 45 33.155 -17.696 9.032 348 HA LYS 45 HA LYS 45 33.826 -15.148 8.186 349 HB2 LYS 45 HB2 LYS 45 34.640 -16.750 10.210 350 HB3 LYS 45 HB3 LYS 45 36.064 -16.809 9.181 351 HG2 LYS 45 HG2 LYS 45 36.200 -14.372 9.223 352 HG3 LYS 45 HG3 LYS 45 34.766 -14.310 10.249 353 HD2 LYS 45 HD2 LYS 45 36.594 -14.107 11.719 354 HD3 LYS 45 HD3 LYS 45 36.055 -15.780 11.876 355 HE2 LYS 45 HE2 LYS 45 37.868 -16.001 9.871 356 HE3 LYS 45 3HE LYS 45 38.571 -14.687 10.813 357 HZ1 LYS 45 1HZ LYS 45 38.673 -17.416 11.348 358 HZ2 LYS 45 2HZ LYS 45 37.714 -16.722 12.557 359 HZ3 LYS 45 3HZ LYS 45 39.285 -16.152 12.291 360 H GLU 46 H GLU 46 35.049 -18.264 7.074 361 HA GLU 46 HA GLU 46 36.963 -17.038 5.287 362 HB2 GLU 46 HB2 GLU 46 37.387 -19.377 4.552 363 HB3 GLU 46 HB3 GLU 46 37.573 -19.142 6.284 364 HG2 GLU 46 HG2 GLU 46 35.773 -20.426 6.798 365 HG3 GLU 46 HG3 GLU 46 34.927 -20.037 5.301 366 H PHE 47 H PHE 47 33.705 -18.207 5.163 367 HA PHE 47 HA PHE 47 33.605 -18.416 2.293 368 HB2 PHE 47 HB2 PHE 47 31.833 -18.990 4.538 369 HB3 PHE 47 HB3 PHE 47 30.983 -18.255 3.182 370 HD1 PHE 47 HD1 PHE 47 31.892 -19.300 0.816 371 HD2 PHE 47 HD2 PHE 47 31.755 -21.270 4.587 372 HE1 PHE 47 HE1 PHE 47 31.833 -21.477 -0.328 373 HE2 PHE 47 HE2 PHE 47 31.696 -23.451 3.450 374 HZ PHE 47 HZ PHE 47 31.737 -23.556 0.990 375 H GLU 48 H GLU 48 33.795 -15.840 4.315 376 HA GLU 48 HA GLU 48 31.823 -14.065 3.439 377 HB2 GLU 48 HB2 GLU 48 34.267 -13.929 4.966 378 HB3 GLU 48 HB3 GLU 48 34.135 -12.537 3.901 379 HG2 GLU 48 HG2 GLU 48 32.253 -11.740 4.940 380 HG3 GLU 48 HG3 GLU 48 31.784 -13.329 5.545 381 H SER 49 H SER 49 35.226 -14.201 2.368 382 HA SER 49 HA SER 49 34.539 -12.679 -0.014 383 HB2 SER 49 HB2 SER 49 36.951 -12.603 -0.420 384 HB3 SER 49 HB3 SER 49 36.597 -12.129 1.241 385 HG SER 49 HG SER 49 38.333 -13.601 1.148 386 H GLU 50 H GLU 50 36.048 -15.811 0.757 387 HA GLU 50 HA GLU 50 34.711 -17.185 -1.312 388 HB2 GLU 50 HB2 GLU 50 36.591 -17.634 -2.815 389 HB3 GLU 50 HB3 GLU 50 36.214 -15.918 -2.766 390 HG2 GLU 50 HG2 GLU 50 38.070 -15.684 -1.074 391 HG3 GLU 50 HG3 GLU 50 38.522 -17.339 -1.477 392 H LEU 51 H LEU 51 37.563 -17.019 0.755 393 HA LEU 51 HA LEU 51 36.989 -19.449 2.055 394 HB2 LEU 51 HB2 LEU 51 38.839 -20.820 1.258 395 HB3 LEU 51 HB3 LEU 51 37.696 -20.458 -0.034 396 HG LEU 51 HG LEU 51 39.730 -18.489 -0.127 397 HD11 LEU 51 HD11 LEU 51 40.963 -20.304 1.206 398 HD12 LEU 51 HD12 LEU 51 41.742 -19.654 -0.236 399 HD13 LEU 51 HD13 LEU 51 40.943 -21.225 -0.298 400 HD21 LEU 51 HD21 LEU 51 38.235 -19.713 -1.901 401 HD22 LEU 51 HD22 LEU 51 39.618 -20.803 -2.005 402 HD23 LEU 51 HD23 LEU 51 39.822 -19.083 -2.343 403 H LYS 52 H LYS 52 37.766 -16.717 2.619 404 HA LYS 52 HA LYS 52 39.499 -17.136 4.771 405 HB2 LYS 52 HB2 LYS 52 40.897 -16.962 2.354 406 HB3 LYS 52 HB3 LYS 52 41.081 -15.377 3.096 407 HG2 LYS 52 HG2 LYS 52 41.656 -16.827 5.225 408 HG3 LYS 52 HG3 LYS 52 42.072 -18.026 3.999 409 HD2 LYS 52 HD2 LYS 52 43.361 -16.003 2.922 410 HD3 LYS 52 HD3 LYS 52 43.317 -15.376 4.571 411 HE2 LYS 52 HE2 LYS 52 45.177 -16.582 4.882 412 HE3 LYS 52 3HE LYS 52 44.093 -17.971 4.957 413 HZ1 LYS 52 1HZ LYS 52 46.143 -17.745 3.252 414 HZ2 LYS 52 2HZ LYS 52 44.875 -17.177 2.288 415 HZ3 LYS 52 3HZ LYS 52 44.788 -18.719 2.977 416 H THR 53 H THR 53 38.511 -15.764 6.097 417 HA THR 53 HA THR 53 37.522 -13.886 6.934 418 HB THR 53 HB THR 53 39.278 -12.242 5.137 419 HG1 THR 53 HG1 THR 53 40.052 -13.942 7.267 420 HG21 THR 53 HG21 THR 53 38.096 -10.820 6.516 421 HG22 THR 53 HG22 THR 53 39.540 -11.106 7.488 422 HG23 THR 53 HG23 THR 53 38.049 -11.977 7.846 Start of MODEL 6 1 H1 ALA 1 H ALA 1 -1.138 -18.398 -8.753 2 HA ALA 1 HA ALA 1 0.215 -16.460 -7.298 3 HB1 ALA 1 HB1 ALA 1 -1.757 -15.757 -9.448 4 HB2 ALA 1 HB2 ALA 1 -0.219 -14.984 -9.058 5 HB3 ALA 1 HB3 ALA 1 -0.239 -16.577 -9.814 6 H LEU 2 H LEU 2 -0.403 -15.535 -5.460 7 HA LEU 2 HA LEU 2 -3.196 -15.250 -4.781 8 HB2 LEU 2 HB2 LEU 2 -0.601 -14.936 -3.394 9 HB3 LEU 2 HB3 LEU 2 -1.943 -13.966 -2.790 10 HG LEU 2 HG LEU 2 -1.678 -16.049 -1.534 11 HD11 LEU 2 HD11 LEU 2 -4.184 -16.158 -3.196 12 HD12 LEU 2 HD12 LEU 2 -3.915 -14.983 -1.909 13 HD13 LEU 2 HD13 LEU 2 -3.962 -16.705 -1.534 14 HD21 LEU 2 HD21 LEU 2 -2.475 -17.528 -4.026 15 HD22 LEU 2 HD22 LEU 2 -1.909 -18.185 -2.490 16 HD23 LEU 2 HD23 LEU 2 -0.790 -17.322 -3.547 17 H PHE 3 H PHE 3 -4.077 -13.184 -4.002 18 HA PHE 3 HA PHE 3 -3.527 -11.089 -5.902 19 HB2 PHE 3 HB2 PHE 3 -5.806 -11.905 -4.711 20 HB3 PHE 3 HB3 PHE 3 -5.375 -10.574 -3.643 21 HD1 PHE 3 HD1 PHE 3 -6.405 -11.511 -7.019 22 HD2 PHE 3 HD2 PHE 3 -5.378 -8.291 -4.433 23 HE1 PHE 3 HE1 PHE 3 -7.356 -9.916 -8.633 24 HE2 PHE 3 HE2 PHE 3 -6.329 -6.691 -6.043 25 HZ PHE 3 HZ PHE 3 -7.320 -7.503 -8.145 26 H GLY 4 H GLY 4 -2.785 -11.778 -2.581 27 HA2 GLY 4 HA2 GLY 4 -1.921 -9.037 -2.065 28 HA3 GLY 4 HA3 GLY 4 -1.957 -10.353 -0.901 29 H LEU 5 H LEU 5 -0.550 -11.021 -3.965 30 HA LEU 5 HA LEU 5 1.928 -11.757 -2.874 31 HB2 LEU 5 HB2 LEU 5 0.979 -11.233 -5.668 32 HB3 LEU 5 HB3 LEU 5 2.663 -11.632 -5.340 33 HG LEU 5 HG LEU 5 0.295 -13.383 -4.681 34 HD11 LEU 5 HD11 LEU 5 0.369 -14.070 -6.786 35 HD12 LEU 5 HD12 LEU 5 2.040 -14.579 -6.545 36 HD13 LEU 5 HD13 LEU 5 1.690 -12.954 -7.133 37 HD21 LEU 5 HD21 LEU 5 2.244 -15.072 -4.475 38 HD22 LEU 5 HD22 LEU 5 1.918 -13.971 -3.136 39 HD23 LEU 5 HD23 LEU 5 3.245 -13.638 -4.250 40 H GLY 6 H GLY 6 4.044 -10.827 -3.917 41 HA2 GLY 6 HA2 GLY 6 4.554 -8.349 -4.778 42 HA3 GLY 6 HA3 GLY 6 4.142 -8.039 -3.098 43 H VAL 7 H VAL 7 6.612 -8.798 -5.234 44 HA VAL 7 HA VAL 7 8.345 -10.399 -3.774 45 HB VAL 7 HB VAL 7 8.712 -8.348 -5.895 46 HG11 VAL 7 HG11 VAL 7 10.556 -7.672 -4.646 47 HG12 VAL 7 HG12 VAL 7 10.886 -9.306 -4.067 48 HG13 VAL 7 HG13 VAL 7 11.229 -8.878 -5.743 49 HG21 VAL 7 HG21 VAL 7 10.096 -10.946 -5.960 50 HG22 VAL 7 HG22 VAL 7 8.334 -11.024 -5.917 51 HG23 VAL 7 HG23 VAL 7 9.146 -10.133 -7.204 52 HA PRO 8 HA PRO 8 10.236 -6.407 -1.808 53 HB2 PRO 8 HB2 PRO 8 8.840 -4.097 -2.103 54 HB3 PRO 8 HB3 PRO 8 10.071 -4.629 -3.255 55 HG2 PRO 8 HG2 PRO 8 7.092 -4.872 -3.419 56 HG3 PRO 8 HG3 PRO 8 8.248 -4.411 -4.682 57 HD2 PRO 8 HD2 PRO 8 7.194 -6.899 -4.510 58 HD3 PRO 8 HD3 PRO 8 8.834 -6.596 -5.120 59 H GLU 9 H GLU 9 6.774 -6.881 -1.880 60 HA GLU 9 HA GLU 9 6.090 -5.653 0.547 61 HB2 GLU 9 HB2 GLU 9 4.756 -7.093 -1.433 62 HB3 GLU 9 HB3 GLU 9 4.542 -8.055 0.023 63 HG2 GLU 9 HG2 GLU 9 3.171 -6.556 0.972 64 HG3 GLU 9 HG3 GLU 9 4.083 -5.176 0.363 65 H LEU 10 H LEU 10 7.109 -8.970 -0.174 66 HA LEU 10 HA LEU 10 6.770 -10.086 2.350 67 HB2 LEU 10 HB2 LEU 10 7.697 -10.968 -0.045 68 HB3 LEU 10 HB3 LEU 10 9.183 -10.936 0.902 69 HG LEU 10 HG LEU 10 7.928 -12.345 2.617 70 HD11 LEU 10 HD11 LEU 10 6.165 -13.195 0.378 71 HD12 LEU 10 HD12 LEU 10 5.713 -11.769 1.314 72 HD13 LEU 10 HD13 LEU 10 5.924 -13.322 2.121 73 HD21 LEU 10 HD21 LEU 10 8.928 -14.149 1.729 74 HD22 LEU 10 HD22 LEU 10 9.513 -13.010 0.516 75 HD23 LEU 10 HD23 LEU 10 8.082 -13.989 0.190 76 H ALA 11 H ALA 11 9.172 -7.877 1.189 77 HA ALA 11 HA ALA 11 11.060 -8.350 3.299 78 HB1 ALA 11 HB1 ALA 11 12.422 -7.116 2.046 79 HB2 ALA 11 HB2 ALA 11 11.127 -7.050 0.850 80 HB3 ALA 11 HB3 ALA 11 11.297 -5.757 2.037 81 H VAL 12 H VAL 12 8.252 -6.367 2.852 82 HA VAL 12 HA VAL 12 8.832 -4.469 4.904 83 HB VAL 12 HB VAL 12 6.132 -5.214 3.776 84 HG11 VAL 12 HG11 VAL 12 6.862 -3.503 5.881 85 HG12 VAL 12 HG12 VAL 12 6.442 -2.464 4.518 86 HG13 VAL 12 HG13 VAL 12 5.284 -3.656 5.110 87 HG21 VAL 12 HG21 VAL 12 8.358 -3.591 2.696 88 HG22 VAL 12 HG22 VAL 12 7.116 -4.520 1.853 89 HG23 VAL 12 HG23 VAL 12 6.731 -2.933 2.518 90 H ILE 13 H ILE 13 6.510 -7.174 4.751 91 HA ILE 13 HA ILE 13 5.619 -7.108 7.361 92 HB ILE 13 HB ILE 13 4.616 -8.565 5.686 93 HG12 ILE 13 HG12 ILE 13 5.706 -10.106 8.052 94 HG13 ILE 13 HG13 ILE 13 4.268 -9.090 8.060 95 HG21 ILE 13 HG21 ILE 13 6.917 -10.464 5.990 96 HG22 ILE 13 HG22 ILE 13 5.643 -10.454 4.772 97 HG23 ILE 13 HG23 ILE 13 6.904 -9.222 4.739 98 HD11 ILE 13 HD11 ILE 13 3.979 -10.968 5.966 99 HD12 ILE 13 HD12 ILE 13 4.499 -11.837 7.412 100 HD13 ILE 13 HD13 ILE 13 3.052 -10.829 7.459 101 H ALA 14 H ALA 14 8.599 -8.441 6.080 102 HA ALA 14 HA ALA 14 9.424 -10.003 8.226 103 HB1 ALA 14 HB1 ALA 14 11.509 -8.413 6.862 104 HB2 ALA 14 HB2 ALA 14 11.413 -10.150 7.157 105 HB3 ALA 14 HB3 ALA 14 10.489 -9.426 5.840 106 H GLY 15 H GLY 15 9.938 -6.531 7.653 107 HA2 GLY 15 HA2 GLY 15 11.423 -6.108 10.045 108 HA3 GLY 15 HA3 GLY 15 10.684 -4.862 9.050 109 H VAL 16 H VAL 16 8.014 -6.131 9.304 110 HA VAL 16 HA VAL 16 6.994 -4.635 11.407 111 HB VAL 16 HB VAL 16 5.807 -7.136 10.196 112 HG11 VAL 16 HG11 VAL 16 3.688 -5.660 10.919 113 HG12 VAL 16 HG12 VAL 16 4.412 -6.887 11.960 114 HG13 VAL 16 HG13 VAL 16 4.821 -5.186 12.183 115 HG21 VAL 16 HG21 VAL 16 4.493 -5.477 8.850 116 HG22 VAL 16 HG22 VAL 16 5.580 -4.224 9.450 117 HG23 VAL 16 HG23 VAL 16 6.214 -5.544 8.467 118 H ALA 17 H ALA 17 7.552 -8.157 11.320 119 HA ALA 17 HA ALA 17 6.900 -8.574 14.044 120 HB1 ALA 17 HB1 ALA 17 7.112 -10.244 12.023 121 HB2 ALA 17 HB2 ALA 17 8.758 -10.420 12.631 122 HB3 ALA 17 HB3 ALA 17 7.387 -10.780 13.681 123 H ALA 18 H ALA 18 9.824 -7.642 12.403 124 HA ALA 18 HA ALA 18 11.704 -8.315 14.378 125 HB1 ALA 18 HB1 ALA 18 12.735 -6.057 13.201 126 HB2 ALA 18 HB2 ALA 18 12.927 -7.708 12.612 127 HB3 ALA 18 HB3 ALA 18 11.645 -6.684 11.965 128 H LEU 19 H LEU 19 9.396 -5.744 14.175 129 HA LEU 19 HA LEU 19 10.657 -4.004 16.060 130 HB2 LEU 19 HB2 LEU 19 7.801 -4.159 15.111 131 HB3 LEU 19 HB3 LEU 19 8.461 -2.865 16.110 132 HG LEU 19 HG LEU 19 9.225 -3.514 13.264 133 HD11 LEU 19 HD11 LEU 19 7.928 -1.784 12.594 134 HD12 LEU 19 HD12 LEU 19 8.163 -0.880 14.089 135 HD13 LEU 19 HD13 LEU 19 7.022 -2.223 14.041 136 HD21 LEU 19 HD21 LEU 19 10.585 -1.994 15.352 137 HD22 LEU 19 HD22 LEU 19 10.295 -1.066 13.880 138 HD23 LEU 19 HD23 LEU 19 11.187 -2.587 13.802 139 H LEU 20 H LEU 20 8.264 -6.575 16.244 140 HA LEU 20 HA LEU 20 7.651 -6.113 19.009 141 HB2 LEU 20 HB2 LEU 20 7.138 -8.607 17.403 142 HB3 LEU 20 HB3 LEU 20 6.316 -8.092 18.875 143 HG LEU 20 HG LEU 20 6.148 -6.499 16.333 144 HD11 LEU 20 HD11 LEU 20 5.283 -8.483 15.541 145 HD12 LEU 20 HD12 LEU 20 3.847 -7.701 16.201 146 HD13 LEU 20 HD13 LEU 20 4.661 -8.966 17.120 147 HD21 LEU 20 HD21 LEU 20 5.439 -5.305 18.268 148 HD22 LEU 20 HD22 LEU 20 4.501 -6.680 18.848 149 HD23 LEU 20 HD23 LEU 20 3.990 -5.811 17.401 150 H PHE 21 H PHE 21 9.251 -8.827 17.328 151 HA PHE 21 HA PHE 21 10.263 -9.986 19.701 152 HB2 PHE 21 HB2 PHE 21 10.098 -10.736 17.040 153 HB3 PHE 21 HB3 PHE 21 11.829 -10.564 17.305 154 HD1 PHE 21 HD1 PHE 21 13.041 -12.167 18.523 155 HD2 PHE 21 HD2 PHE 21 8.786 -12.281 18.505 156 HE1 PHE 21 HE1 PHE 21 13.099 -14.381 19.595 157 HE2 PHE 21 HE2 PHE 21 8.837 -14.495 19.577 158 HZ PHE 21 HZ PHE 21 10.995 -15.547 20.125 159 H GLY 22 H GLY 22 11.640 -7.750 17.338 160 HA2 GLY 22 HA2 GLY 22 14.006 -7.478 19.084 161 HA3 GLY 22 HA3 GLY 22 14.018 -7.186 17.350 162 HA PRO 23 HA PRO 23 11.674 -3.483 19.440 163 HB2 PRO 23 HB2 PRO 23 12.026 -3.242 22.121 164 HB3 PRO 23 HB3 PRO 23 10.685 -4.145 21.406 165 HG2 PRO 23 HG2 PRO 23 13.272 -5.161 22.518 166 HG3 PRO 23 HG3 PRO 23 11.634 -5.809 22.725 167 HD2 PRO 23 HD2 PRO 23 13.407 -6.866 20.973 168 HD3 PRO 23 HD3 PRO 23 11.657 -6.866 20.677 169 H LYS 24 H LYS 24 12.963 -1.925 18.673 170 HA LYS 24 HA LYS 24 15.700 -1.660 19.606 171 HB2 LYS 24 HB2 LYS 24 14.287 0.138 17.643 172 HB3 LYS 24 HB3 LYS 24 16.017 -0.129 17.816 173 HG2 LYS 24 HG2 LYS 24 15.624 -2.501 17.101 174 HG3 LYS 24 HG3 LYS 24 13.965 -2.034 16.720 175 HD2 LYS 24 HD2 LYS 24 14.834 -1.612 14.680 176 HD3 LYS 24 HD3 LYS 24 15.324 -0.091 15.428 177 HE2 LYS 24 HE2 LYS 24 17.163 -2.377 15.770 178 HE3 LYS 24 3HE LYS 24 17.022 -1.726 14.138 179 HZ1 LYS 24 1HZ LYS 24 17.327 0.263 16.212 180 HZ2 LYS 24 2HZ LYS 24 18.087 0.143 14.706 181 HZ3 LYS 24 3HZ LYS 24 18.664 -0.755 16.019 182 H LYS 25 H LYS 25 12.734 0.291 19.544 183 HA LYS 25 HA LYS 25 12.026 2.026 20.833 184 HB2 LYS 25 HB2 LYS 25 14.225 1.332 22.774 185 HB3 LYS 25 HB3 LYS 25 12.685 2.109 23.115 186 HG2 LYS 25 HG2 LYS 25 11.711 -0.151 22.194 187 HG3 LYS 25 HG3 LYS 25 13.304 -0.761 22.649 188 HD2 LYS 25 HD2 LYS 25 12.906 0.316 24.914 189 HD3 LYS 25 HD3 LYS 25 11.227 0.525 24.408 190 HE2 LYS 25 HE2 LYS 25 11.133 -1.933 23.982 191 HE3 LYS 25 3HE LYS 25 12.742 -2.066 24.691 192 HZ1 LYS 25 1HZ LYS 25 10.738 -0.677 26.279 193 HZ2 LYS 25 2HZ LYS 25 11.954 -1.748 26.765 194 HZ3 LYS 25 3HZ LYS 25 10.520 -2.345 26.097 195 H LEU 26 H LEU 26 14.209 2.342 18.862 196 HA LEU 26 HA LEU 26 16.058 4.265 19.861 197 HB2 LEU 26 HB2 LEU 26 15.380 3.062 17.274 198 HB3 LEU 26 HB3 LEU 26 15.970 4.721 17.172 199 HG LEU 26 HG LEU 26 17.431 2.396 18.427 200 HD11 LEU 26 HD11 LEU 26 17.146 2.603 15.848 201 HD12 LEU 26 HD12 LEU 26 18.735 2.265 16.534 202 HD13 LEU 26 HD13 LEU 26 18.330 3.900 16.010 203 HD21 LEU 26 HD21 LEU 26 17.888 5.319 18.406 204 HD22 LEU 26 HD22 LEU 26 19.292 4.290 18.123 205 HD23 LEU 26 HD23 LEU 26 18.346 4.105 19.600 206 HA PRO 27 HA PRO 27 13.226 7.489 17.649 207 HB2 PRO 27 HB2 PRO 27 10.819 6.626 16.738 208 HB3 PRO 27 HB3 PRO 27 12.288 6.586 15.756 209 HG2 PRO 27 HG2 PRO 27 10.980 4.380 17.300 210 HG3 PRO 27 HG3 PRO 27 11.682 4.343 15.671 211 HD2 PRO 27 HD2 PRO 27 12.994 3.403 17.846 212 HD3 PRO 27 HD3 PRO 27 13.836 4.142 16.469 213 H GLU 28 H GLU 28 12.334 5.225 19.976 214 HA GLU 28 HA GLU 28 9.894 6.044 20.950 215 HB2 GLU 28 HB2 GLU 28 10.423 4.941 22.918 216 HB3 GLU 28 HB3 GLU 28 11.528 4.190 21.775 217 HG2 GLU 28 HG2 GLU 28 13.304 5.724 22.538 218 HG3 GLU 28 HG3 GLU 28 12.189 6.370 23.741 219 H ILE 29 H ILE 29 12.985 7.643 21.181 220 HA ILE 29 HA ILE 29 12.586 9.401 23.269 221 HB ILE 29 HB ILE 29 14.063 10.993 21.993 222 HG12 ILE 29 HG12 ILE 29 13.996 8.767 19.944 223 HG13 ILE 29 HG13 ILE 29 13.329 10.381 19.731 224 HG21 ILE 29 HG21 ILE 29 16.029 9.605 22.190 225 HG22 ILE 29 HG22 ILE 29 14.918 9.243 23.510 226 HG23 ILE 29 HG23 ILE 29 15.041 8.145 22.135 227 HD11 ILE 29 HD11 ILE 29 15.294 10.748 18.712 228 HD12 ILE 29 HD12 ILE 29 15.865 11.001 20.363 229 HD13 ILE 29 HD13 ILE 29 16.108 9.443 19.574 230 H GLY 30 H GLY 30 11.331 9.546 19.986 231 HA2 GLY 30 HA2 GLY 30 10.329 12.212 20.176 232 HA3 GLY 30 HA3 GLY 30 9.891 11.022 18.960 233 H LYS 31 H LYS 31 8.884 9.015 20.652 234 HA LYS 31 HA LYS 31 6.249 10.016 21.084 235 HB2 LYS 31 HB2 LYS 31 6.924 7.655 20.366 236 HB3 LYS 31 HB3 LYS 31 7.302 7.367 22.059 237 HG2 LYS 31 HG2 LYS 31 5.124 7.322 22.685 238 HG3 LYS 31 HG3 LYS 31 4.627 8.474 21.443 239 HD2 LYS 31 HD2 LYS 31 3.724 6.618 20.512 240 HD3 LYS 31 HD3 LYS 31 5.360 6.425 19.877 241 HE2 LYS 31 HE2 LYS 31 5.901 4.989 21.814 242 HE3 LYS 31 3HE LYS 31 4.230 5.132 22.358 243 HZ1 LYS 31 1HZ LYS 31 4.884 4.118 19.661 244 HZ2 LYS 31 2HZ LYS 31 3.459 3.913 20.550 245 HZ3 LYS 31 3HZ LYS 31 4.865 3.089 21.005 246 H SER 32 H SER 32 9.019 9.418 23.111 247 HA SER 32 HA SER 32 7.765 9.332 25.615 248 HB2 SER 32 HB2 SER 32 10.209 8.831 25.050 249 HB3 SER 32 HB3 SER 32 10.473 10.572 25.127 250 HG SER 32 HG SER 32 10.141 8.767 27.147 251 H ILE 33 H ILE 33 8.485 11.983 23.491 252 HA ILE 33 HA ILE 33 8.395 14.112 25.311 253 HB ILE 33 HB ILE 33 7.441 14.164 22.447 254 HG12 ILE 33 HG12 ILE 33 9.696 13.224 22.587 255 HG13 ILE 33 HG13 ILE 33 9.743 14.838 21.888 256 HG21 ILE 33 HG21 ILE 33 7.662 16.165 24.501 257 HG22 ILE 33 HG22 ILE 33 8.708 16.556 23.137 258 HG23 ILE 33 HG23 ILE 33 6.983 16.294 22.879 259 HD11 ILE 33 HD11 ILE 33 10.459 14.081 24.707 260 HD12 ILE 33 HD12 ILE 33 11.565 14.566 23.423 261 HD13 ILE 33 HD13 ILE 33 10.416 15.730 24.084 262 H GLY 34 H GLY 34 5.819 12.438 23.557 263 HA2 GLY 34 HA2 GLY 34 3.696 14.140 24.204 264 HA3 GLY 34 HA3 GLY 34 3.544 12.424 23.853 265 H LYS 35 H LYS 35 5.215 11.585 26.073 266 HA LYS 35 HA LYS 35 3.266 11.230 28.036 267 HB2 LYS 35 HB2 LYS 35 5.260 9.790 27.759 268 HB3 LYS 35 HB3 LYS 35 6.268 11.092 28.376 269 HG2 LYS 35 HG2 LYS 35 4.659 10.957 30.435 270 HG3 LYS 35 HG3 LYS 35 4.347 9.332 29.819 271 HD2 LYS 35 HD2 LYS 35 7.113 10.409 30.342 272 HD3 LYS 35 HD3 LYS 35 6.181 9.501 31.535 273 HE2 LYS 35 HE2 LYS 35 6.143 7.567 30.139 274 HE3 LYS 35 3HE LYS 35 6.811 8.465 28.776 275 HZ1 LYS 35 1HZ LYS 35 8.157 7.401 31.141 276 HZ2 LYS 35 2HZ LYS 35 8.739 8.859 30.510 277 HZ3 LYS 35 3HZ LYS 35 8.689 7.476 29.537 278 H THR 36 H THR 36 5.786 13.666 27.720 279 HA THR 36 HA THR 36 5.137 14.843 30.295 280 HB THR 36 HB THR 36 6.913 16.250 28.362 281 HG1 THR 36 HG1 THR 36 8.383 14.713 28.346 282 HG21 THR 36 HG21 THR 36 6.293 16.543 31.028 283 HG22 THR 36 HG22 THR 36 7.697 17.237 30.218 284 HG23 THR 36 HG23 THR 36 7.843 15.703 31.075 285 H VAL 37 H VAL 37 5.048 15.832 26.874 286 HA VAL 37 HA VAL 37 3.914 18.343 27.193 287 HB VAL 37 HB VAL 37 3.445 16.399 24.926 288 HG11 VAL 37 HG11 VAL 37 2.714 19.245 25.350 289 HG12 VAL 37 HG12 VAL 37 3.260 18.764 23.742 290 HG13 VAL 37 HG13 VAL 37 1.862 17.974 24.473 291 HG21 VAL 37 HG21 VAL 37 5.295 18.614 24.507 292 HG22 VAL 37 HG22 VAL 37 5.829 17.486 25.753 293 HG23 VAL 37 HG23 VAL 37 5.475 16.902 24.128 294 H LYS 38 H LYS 38 2.241 15.253 26.593 295 HA LYS 38 HA LYS 38 -0.367 16.313 26.774 296 HB2 LYS 38 HB2 LYS 38 0.169 14.145 25.714 297 HB3 LYS 38 HB3 LYS 38 0.562 13.482 27.294 298 HG2 LYS 38 HG2 LYS 38 -1.697 13.659 28.019 299 HG3 LYS 38 HG3 LYS 38 -2.144 14.587 26.586 300 HD2 LYS 38 HD2 LYS 38 -0.974 11.862 26.250 301 HD3 LYS 38 HD3 LYS 38 -2.664 12.020 26.735 302 HE2 LYS 38 HE2 LYS 38 -3.253 13.101 24.755 303 HE3 LYS 38 3HE LYS 38 -1.586 13.545 24.391 304 HZ1 LYS 38 1HZ LYS 38 -1.152 11.118 24.093 305 HZ2 LYS 38 2HZ LYS 38 -2.185 11.796 22.938 306 HZ3 LYS 38 3HZ LYS 38 -2.820 10.857 24.194 307 H SER 39 H SER 39 1.867 15.055 29.166 308 HA SER 39 HA SER 39 0.079 14.727 31.301 309 HB2 SER 39 HB2 SER 39 3.012 15.010 31.001 310 HB3 SER 39 HB3 SER 39 2.358 15.394 32.593 311 HG SER 39 HG SER 39 2.063 13.347 32.918 312 H PHE 40 H PHE 40 1.608 17.561 29.967 313 HA PHE 40 HA PHE 40 1.223 19.312 32.142 314 HB2 PHE 40 HB2 PHE 40 2.513 19.534 29.793 315 HB3 PHE 40 HB3 PHE 40 1.043 20.416 29.393 316 HD1 PHE 40 HD1 PHE 40 4.219 20.543 31.009 317 HD2 PHE 40 HD2 PHE 40 0.361 22.338 30.911 318 HE1 PHE 40 HE1 PHE 40 5.122 22.538 32.132 319 HE2 PHE 40 HE2 PHE 40 1.258 24.335 32.032 320 HZ PHE 40 HZ PHE 40 3.641 24.439 32.643 321 H GLN 41 H GLN 41 -0.832 18.406 29.427 322 HA GLN 41 HA GLN 41 -2.851 20.331 29.862 323 HB2 GLN 41 HB2 GLN 41 -2.787 17.684 28.440 324 HB3 GLN 41 HB3 GLN 41 -4.279 18.605 28.580 325 HG2 GLN 41 HG2 GLN 41 -2.743 20.539 27.634 326 HG3 GLN 41 HG3 GLN 41 -1.839 19.168 26.995 327 HE21 GLN 41 HE21 GLN 41 -3.472 21.269 25.682 328 HE22 GLN 41 HE22 GLN 41 -4.618 20.411 24.715 329 H GLN 42 H GLN 42 -2.520 16.957 30.917 330 HA GLN 42 HA GLN 42 -4.987 16.946 32.354 331 HB2 GLN 42 HB2 GLN 42 -3.015 15.046 31.606 332 HB3 GLN 42 HB3 GLN 42 -3.186 14.963 33.355 333 HG2 GLN 42 HG2 GLN 42 -5.364 14.259 33.249 334 HG3 GLN 42 HG3 GLN 42 -5.635 14.981 31.664 335 HE21 GLN 42 HE21 GLN 42 -6.616 12.681 31.615 336 HE22 GLN 42 HE22 GLN 42 -5.591 11.463 30.944 337 H ALA 43 H ALA 43 -1.731 17.871 33.081 338 HA ALA 43 HA ALA 43 -1.996 17.759 35.932 339 HB1 ALA 43 HB1 ALA 43 0.204 17.572 35.146 340 HB2 ALA 43 HB2 ALA 43 0.038 18.970 34.083 341 HB3 ALA 43 HB3 ALA 43 0.114 19.194 35.831 342 H ALA 44 H ALA 44 -2.521 20.175 33.450 343 HA ALA 44 HA ALA 44 -2.569 22.504 34.936 344 HB1 ALA 44 HB1 ALA 44 -4.716 22.277 32.940 345 HB2 ALA 44 HB2 ALA 44 -3.418 23.463 33.086 346 HB3 ALA 44 HB3 ALA 44 -3.097 21.889 32.356 347 H LYS 45 H LYS 45 -4.985 19.970 34.699 348 HA LYS 45 HA LYS 45 -7.203 21.223 35.765 349 HB2 LYS 45 HB2 LYS 45 -6.864 18.788 34.905 350 HB3 LYS 45 HB3 LYS 45 -6.489 18.425 36.585 351 HG2 LYS 45 HG2 LYS 45 -8.638 18.883 37.303 352 HG3 LYS 45 HG3 LYS 45 -9.008 19.874 35.889 353 HD2 LYS 45 HD2 LYS 45 -8.509 16.907 35.742 354 HD3 LYS 45 HD3 LYS 45 -10.115 17.608 35.956 355 HE2 LYS 45 HE2 LYS 45 -8.722 18.890 33.785 356 HE3 LYS 45 3HE LYS 45 -8.764 17.143 33.550 357 HZ1 LYS 45 1HZ LYS 45 -11.005 19.041 33.734 358 HZ2 LYS 45 2HZ LYS 45 -11.245 17.421 34.157 359 HZ3 LYS 45 3HZ LYS 45 -10.728 17.819 32.597 360 H GLU 46 H GLU 46 -4.292 20.163 37.358 361 HA GLU 46 HA GLU 46 -5.444 20.759 39.987 362 HB2 GLU 46 HB2 GLU 46 -3.258 19.050 39.011 363 HB3 GLU 46 HB3 GLU 46 -2.884 19.939 40.481 364 HG2 GLU 46 HG2 GLU 46 -3.796 17.686 40.896 365 HG3 GLU 46 HG3 GLU 46 -4.758 18.976 41.617 366 H PHE 47 H PHE 47 -2.612 21.561 37.990 367 HA PHE 47 HA PHE 47 -1.436 23.447 39.641 368 HB2 PHE 47 HB2 PHE 47 -0.160 22.855 37.782 369 HB3 PHE 47 HB3 PHE 47 -1.502 23.086 36.664 370 HD1 PHE 47 HD1 PHE 47 1.151 24.737 38.566 371 HD2 PHE 47 HD2 PHE 47 -2.039 25.267 35.798 372 HE1 PHE 47 HE1 PHE 47 1.989 26.989 38.035 373 HE2 PHE 47 HE2 PHE 47 -1.206 27.519 35.263 374 HZ PHE 47 HZ PHE 47 0.811 28.383 36.381 375 H GLU 48 H GLU 48 -4.242 23.726 37.585 376 HA GLU 48 HA GLU 48 -4.381 26.589 37.708 377 HB2 GLU 48 HB2 GLU 48 -6.413 26.398 36.504 378 HB3 GLU 48 HB3 GLU 48 -5.360 25.137 35.877 379 HG2 GLU 48 HG2 GLU 48 -6.544 23.615 37.588 380 HG3 GLU 48 HG3 GLU 48 -7.767 24.883 37.630 381 H SER 49 H SER 49 -5.594 23.927 39.599 382 HA SER 49 HA SER 49 -7.544 25.458 41.037 383 HB2 SER 49 HB2 SER 49 -7.783 23.030 40.789 384 HB3 SER 49 HB3 SER 49 -6.285 22.781 41.688 385 HG SER 49 HG SER 49 -7.276 23.630 43.511 386 H GLU 50 H GLU 50 -4.188 24.537 41.537 387 HA GLU 50 HA GLU 50 -3.978 26.546 43.634 388 HB2 GLU 50 HB2 GLU 50 -3.200 23.654 44.040 389 HB3 GLU 50 HB3 GLU 50 -2.732 24.967 45.112 390 HG2 GLU 50 HG2 GLU 50 -5.167 25.429 45.462 391 HG3 GLU 50 HG3 GLU 50 -5.507 23.947 44.570 392 H LEU 51 H LEU 51 -1.870 23.876 42.603 393 HA LEU 51 HA LEU 51 -0.217 25.470 40.944 394 HB2 LEU 51 HB2 LEU 51 0.241 25.789 43.685 395 HB3 LEU 51 HB3 LEU 51 1.526 24.726 43.115 396 HG LEU 51 HG LEU 51 0.903 27.392 41.858 397 HD11 LEU 51 HD11 LEU 51 1.665 28.245 43.792 398 HD12 LEU 51 HD12 LEU 51 3.240 27.769 43.159 399 HD13 LEU 51 HD13 LEU 51 2.396 26.722 44.300 400 HD21 LEU 51 HD21 LEU 51 3.596 26.263 41.716 401 HD22 LEU 51 HD22 LEU 51 2.598 26.984 40.453 402 HD23 LEU 51 HD23 LEU 51 2.368 25.294 40.903 403 H LYS 52 H LYS 52 -0.470 22.649 43.043 404 HA LYS 52 HA LYS 52 0.185 20.859 40.942 405 HB2 LYS 52 HB2 LYS 52 2.266 19.933 41.986 406 HB3 LYS 52 HB3 LYS 52 2.455 21.536 41.288 407 HG2 LYS 52 HG2 LYS 52 2.692 22.551 43.333 408 HG3 LYS 52 HG3 LYS 52 1.810 21.282 44.185 409 HD2 LYS 52 HD2 LYS 52 3.932 19.889 43.225 410 HD3 LYS 52 HD3 LYS 52 4.662 21.473 43.495 411 HE2 LYS 52 HE2 LYS 52 3.535 21.365 45.804 412 HE3 LYS 52 3HE LYS 52 3.337 19.645 45.473 413 HZ1 LYS 52 1HZ LYS 52 5.379 19.416 46.283 414 HZ2 LYS 52 2HZ LYS 52 5.679 21.081 46.258 415 HZ3 LYS 52 3HZ LYS 52 5.950 20.151 44.871 416 H THR 53 H THR 53 0.479 18.566 41.841 417 HA THR 53 HA THR 53 -1.728 17.883 43.382 418 HB THR 53 HB THR 53 -0.614 16.266 41.932 419 HG1 THR 53 HG1 THR 53 -1.686 15.061 43.332 420 HG21 THR 53 HG21 THR 53 1.680 16.689 42.125 421 HG22 THR 53 HG22 THR 53 1.473 15.136 42.935 422 HG23 THR 53 HG23 THR 53 1.640 16.611 43.886 Start of MODEL 7 1 H1 ALA 1 H ALA 1 -0.158 -17.052 -3.668 2 HA ALA 1 HA ALA 1 0.641 -19.385 -3.594 3 HB1 ALA 1 HB1 ALA 1 -0.566 -19.704 -6.316 4 HB2 ALA 1 HB2 ALA 1 -0.034 -20.944 -5.179 5 HB3 ALA 1 HB3 ALA 1 -1.509 -20.032 -4.861 6 H LEU 2 H LEU 2 0.482 -16.953 -6.079 7 HA LEU 2 HA LEU 2 3.066 -17.723 -7.184 8 HB2 LEU 2 HB2 LEU 2 1.230 -15.445 -7.912 9 HB3 LEU 2 HB3 LEU 2 2.685 -15.917 -8.787 10 HG LEU 2 HG LEU 2 0.202 -17.608 -8.497 11 HD11 LEU 2 HD11 LEU 2 1.062 -15.600 -10.488 12 HD12 LEU 2 HD12 LEU 2 -0.557 -16.091 -9.994 13 HD13 LEU 2 HD13 LEU 2 0.365 -17.095 -11.113 14 HD21 LEU 2 HD21 LEU 2 1.914 -18.352 -10.650 15 HD22 LEU 2 HD22 LEU 2 1.414 -19.304 -9.251 16 HD23 LEU 2 HD23 LEU 2 2.860 -18.296 -9.162 17 H PHE 3 H PHE 3 3.669 -17.195 -4.735 18 HA PHE 3 HA PHE 3 4.440 -14.366 -4.547 19 HB2 PHE 3 HB2 PHE 3 4.876 -14.881 -2.142 20 HB3 PHE 3 HB3 PHE 3 3.201 -15.131 -2.623 21 HD1 PHE 3 HD1 PHE 3 2.235 -17.331 -2.672 22 HD2 PHE 3 HD2 PHE 3 6.321 -16.764 -1.623 23 HE1 PHE 3 HE1 PHE 3 2.328 -19.631 -1.801 24 HE2 PHE 3 HE2 PHE 3 6.421 -19.062 -0.753 25 HZ PHE 3 HZ PHE 3 4.424 -20.499 -0.841 26 H GLY 4 H GLY 4 5.792 -16.375 -6.223 27 HA2 GLY 4 HA2 GLY 4 8.218 -17.179 -4.982 28 HA3 GLY 4 HA3 GLY 4 7.914 -17.116 -6.711 29 H LEU 5 H LEU 5 7.164 -14.185 -6.328 30 HA LEU 5 HA LEU 5 9.917 -13.153 -6.140 31 HB2 LEU 5 HB2 LEU 5 9.199 -11.424 -7.788 32 HB3 LEU 5 HB3 LEU 5 9.273 -13.066 -8.421 33 HG LEU 5 HG LEU 5 6.652 -12.014 -7.467 34 HD11 LEU 5 HD11 LEU 5 7.552 -11.492 -10.270 35 HD12 LEU 5 HD12 LEU 5 7.864 -10.316 -8.994 36 HD13 LEU 5 HD13 LEU 5 6.207 -10.783 -9.375 37 HD21 LEU 5 HD21 LEU 5 6.220 -13.360 -9.763 38 HD22 LEU 5 HD22 LEU 5 6.261 -14.119 -8.171 39 HD23 LEU 5 HD23 LEU 5 7.692 -14.154 -9.204 40 H GLY 6 H GLY 6 7.889 -13.343 -4.035 41 HA2 GLY 6 HA2 GLY 6 6.946 -10.627 -3.636 42 HA3 GLY 6 HA3 GLY 6 6.683 -11.993 -2.563 43 H VAL 7 H VAL 7 9.580 -10.339 -3.825 44 HA VAL 7 HA VAL 7 11.055 -10.678 -1.439 45 HB VAL 7 HB VAL 7 11.592 -8.505 -3.448 46 HG11 VAL 7 HG11 VAL 7 13.769 -8.563 -2.709 47 HG12 VAL 7 HG12 VAL 7 12.898 -8.933 -1.219 48 HG13 VAL 7 HG13 VAL 7 13.648 -10.231 -2.148 49 HG21 VAL 7 HG21 VAL 7 11.709 -11.440 -3.797 50 HG22 VAL 7 HG22 VAL 7 11.456 -10.164 -4.989 51 HG23 VAL 7 HG23 VAL 7 13.082 -10.512 -4.401 52 HA PRO 8 HA PRO 8 9.939 -6.025 -0.631 53 HB2 PRO 8 HB2 PRO 8 7.797 -5.050 -1.985 54 HB3 PRO 8 HB3 PRO 8 9.450 -4.948 -2.601 55 HG2 PRO 8 HG2 PRO 8 7.291 -6.904 -3.287 56 HG3 PRO 8 HG3 PRO 8 8.430 -6.074 -4.362 57 HD2 PRO 8 HD2 PRO 8 8.781 -8.638 -3.569 58 HD3 PRO 8 HD3 PRO 8 10.142 -7.544 -3.891 59 H GLU 9 H GLU 9 7.030 -7.849 -1.611 60 HA GLU 9 HA GLU 9 5.360 -6.970 0.446 61 HB2 GLU 9 HB2 GLU 9 3.936 -8.837 -0.095 62 HB3 GLU 9 HB3 GLU 9 4.610 -8.193 -1.585 63 HG2 GLU 9 HG2 GLU 9 4.837 -10.445 -1.918 64 HG3 GLU 9 HG3 GLU 9 6.414 -10.034 -1.247 65 H LEU 10 H LEU 10 7.767 -9.511 0.371 66 HA LEU 10 HA LEU 10 7.001 -10.507 2.989 67 HB2 LEU 10 HB2 LEU 10 7.864 -11.919 1.042 68 HB3 LEU 10 HB3 LEU 10 9.456 -11.272 1.436 69 HG LEU 10 HG LEU 10 7.929 -12.558 3.631 70 HD11 LEU 10 HD11 LEU 10 8.670 -14.784 2.945 71 HD12 LEU 10 HD12 LEU 10 9.258 -14.119 1.422 72 HD13 LEU 10 HD13 LEU 10 7.533 -14.094 1.786 73 HD21 LEU 10 HD21 LEU 10 10.433 -11.528 3.377 74 HD22 LEU 10 HD22 LEU 10 10.727 -13.242 3.081 75 HD23 LEU 10 HD23 LEU 10 9.955 -12.725 4.580 76 H ALA 11 H ALA 11 9.288 -8.322 1.582 77 HA ALA 11 HA ALA 11 11.102 -8.278 3.799 78 HB1 ALA 11 HB1 ALA 11 12.005 -6.242 2.676 79 HB2 ALA 11 HB2 ALA 11 11.941 -7.671 1.644 80 HB3 ALA 11 HB3 ALA 11 10.727 -6.403 1.471 81 H VAL 12 H VAL 12 8.385 -6.281 2.731 82 HA VAL 12 HA VAL 12 8.647 -4.246 4.654 83 HB VAL 12 HB VAL 12 7.230 -3.956 2.699 84 HG11 VAL 12 HG11 VAL 12 5.262 -5.867 3.932 85 HG12 VAL 12 HG12 VAL 12 5.219 -5.139 2.325 86 HG13 VAL 12 HG13 VAL 12 6.433 -6.359 2.710 87 HG21 VAL 12 HG21 VAL 12 6.738 -2.575 4.620 88 HG22 VAL 12 HG22 VAL 12 5.233 -3.012 3.810 89 HG23 VAL 12 HG23 VAL 12 5.705 -3.832 5.298 90 H ILE 13 H ILE 13 7.033 -7.371 4.732 91 HA ILE 13 HA ILE 13 5.778 -6.897 7.275 92 HB ILE 13 HB ILE 13 4.757 -8.432 5.668 93 HG12 ILE 13 HG12 ILE 13 5.677 -10.053 8.039 94 HG13 ILE 13 HG13 ILE 13 4.552 -8.709 8.206 95 HG21 ILE 13 HG21 ILE 13 5.794 -10.674 5.319 96 HG22 ILE 13 HG22 ILE 13 6.682 -9.342 4.583 97 HG23 ILE 13 HG23 ILE 13 7.256 -10.060 6.088 98 HD11 ILE 13 HD11 ILE 13 4.104 -11.138 6.489 99 HD12 ILE 13 HD12 ILE 13 3.423 -10.877 8.095 100 HD13 ILE 13 HD13 ILE 13 2.967 -9.818 6.762 101 H ALA 14 H ALA 14 8.814 -8.133 6.167 102 HA ALA 14 HA ALA 14 9.578 -9.720 8.333 103 HB1 ALA 14 HB1 ALA 14 11.463 -9.929 7.173 104 HB2 ALA 14 HB2 ALA 14 10.764 -8.825 5.988 105 HB3 ALA 14 HB3 ALA 14 11.796 -8.200 7.274 106 H GLY 15 H GLY 15 10.520 -6.322 7.741 107 HA2 GLY 15 HA2 GLY 15 11.708 -5.848 10.205 108 HA3 GLY 15 HA3 GLY 15 10.972 -4.609 9.200 109 H VAL 16 H VAL 16 8.329 -5.985 9.385 110 HA VAL 16 HA VAL 16 7.333 -4.561 11.624 111 HB VAL 16 HB VAL 16 5.971 -6.713 9.996 112 HG11 VAL 16 HG11 VAL 16 4.571 -6.546 11.792 113 HG12 VAL 16 HG12 VAL 16 5.050 -4.886 12.152 114 HG13 VAL 16 HG13 VAL 16 3.951 -5.217 10.813 115 HG21 VAL 16 HG21 VAL 16 6.852 -4.204 9.183 116 HG22 VAL 16 HG22 VAL 16 5.668 -5.224 8.367 117 HG23 VAL 16 HG23 VAL 16 5.131 -3.990 9.506 118 H ALA 17 H ALA 17 7.729 -8.042 10.997 119 HA ALA 17 HA ALA 17 6.819 -8.856 13.562 120 HB1 ALA 17 HB1 ALA 17 8.006 -10.147 11.202 121 HB2 ALA 17 HB2 ALA 17 8.318 -10.952 12.741 122 HB3 ALA 17 HB3 ALA 17 6.659 -10.655 12.221 123 H ALA 18 H ALA 18 9.884 -7.811 12.314 124 HA ALA 18 HA ALA 18 11.499 -8.905 14.397 125 HB1 ALA 18 HB1 ALA 18 13.286 -7.887 13.371 126 HB2 ALA 18 HB2 ALA 18 12.160 -8.043 12.021 127 HB3 ALA 18 HB3 ALA 18 12.334 -6.496 12.850 128 H LEU 19 H LEU 19 9.568 -6.051 14.051 129 HA LEU 19 HA LEU 19 10.832 -4.642 16.233 130 HB2 LEU 19 HB2 LEU 19 8.612 -4.120 14.337 131 HB3 LEU 19 HB3 LEU 19 8.579 -3.266 15.879 132 HG LEU 19 HG LEU 19 11.009 -3.184 14.121 133 HD11 LEU 19 HD11 LEU 19 8.532 -1.486 13.906 134 HD12 LEU 19 HD12 LEU 19 9.269 -2.482 12.652 135 HD13 LEU 19 HD13 LEU 19 10.097 -1.036 13.230 136 HD21 LEU 19 HD21 LEU 19 10.948 -2.399 16.552 137 HD22 LEU 19 HD22 LEU 19 9.928 -1.082 15.974 138 HD23 LEU 19 HD23 LEU 19 11.567 -1.267 15.348 139 H LEU 20 H LEU 20 7.969 -6.608 15.711 140 HA LEU 20 HA LEU 20 6.819 -6.077 18.276 141 HB2 LEU 20 HB2 LEU 20 6.289 -8.364 16.384 142 HB3 LEU 20 HB3 LEU 20 5.272 -7.870 17.737 143 HG LEU 20 HG LEU 20 5.817 -5.917 15.549 144 HD11 LEU 20 HD11 LEU 20 3.767 -6.802 14.401 145 HD12 LEU 20 HD12 LEU 20 3.929 -8.253 15.390 146 HD13 LEU 20 HD13 LEU 20 5.207 -7.811 14.258 147 HD21 LEU 20 HD21 LEU 20 4.573 -4.899 17.176 148 HD22 LEU 20 HD22 LEU 20 3.767 -6.393 17.653 149 HD23 LEU 20 HD23 LEU 20 3.283 -5.562 16.173 150 H PHE 21 H PHE 21 8.486 -8.899 16.875 151 HA PHE 21 HA PHE 21 8.612 -10.265 19.389 152 HB2 PHE 21 HB2 PHE 21 9.921 -10.773 16.716 153 HB3 PHE 21 HB3 PHE 21 10.158 -11.817 18.115 154 HD1 PHE 21 HD1 PHE 21 7.671 -12.250 19.306 155 HD2 PHE 21 HD2 PHE 21 8.513 -11.695 15.171 156 HE1 PHE 21 HE1 PHE 21 5.628 -13.492 18.728 157 HE2 PHE 21 HE2 PHE 21 6.471 -12.935 14.585 158 HZ PHE 21 HZ PHE 21 5.025 -13.835 16.364 159 H GLY 22 H GLY 22 10.888 -8.411 17.412 160 HA2 GLY 22 HA2 GLY 22 13.034 -7.685 17.850 161 HA3 GLY 22 HA3 GLY 22 12.338 -7.258 19.406 162 HA PRO 23 HA PRO 23 15.337 -9.974 21.162 163 HB2 PRO 23 HB2 PRO 23 14.304 -10.083 23.671 164 HB3 PRO 23 HB3 PRO 23 15.173 -8.675 23.050 165 HG2 PRO 23 HG2 PRO 23 12.223 -9.135 23.270 166 HG3 PRO 23 HG3 PRO 23 13.159 -7.677 23.649 167 HD2 PRO 23 HD2 PRO 23 11.772 -7.959 21.340 168 HD3 PRO 23 HD3 PRO 23 13.282 -7.030 21.440 169 H LYS 24 H LYS 24 15.556 -12.134 21.353 170 HA LYS 24 HA LYS 24 13.370 -13.817 22.198 171 HB2 LYS 24 HB2 LYS 24 13.494 -15.220 20.104 172 HB3 LYS 24 HB3 LYS 24 12.716 -13.653 19.916 173 HG2 LYS 24 HG2 LYS 24 14.867 -12.767 19.027 174 HG3 LYS 24 HG3 LYS 24 15.500 -14.416 19.069 175 HD2 LYS 24 HD2 LYS 24 12.906 -14.160 17.731 176 HD3 LYS 24 HD3 LYS 24 14.213 -13.271 16.945 177 HE2 LYS 24 HE2 LYS 24 15.301 -15.154 16.332 178 HE3 LYS 24 3HE LYS 24 14.861 -16.015 17.805 179 HZ1 LYS 24 1HZ LYS 24 13.361 -15.750 15.292 180 HZ2 LYS 24 2HZ LYS 24 12.512 -15.983 16.736 181 HZ3 LYS 24 3HZ LYS 24 13.649 -17.128 16.229 182 H LYS 25 H LYS 25 16.566 -13.717 20.657 183 HA LYS 25 HA LYS 25 17.867 -15.115 22.698 184 HB2 LYS 25 HB2 LYS 25 16.325 -16.852 21.228 185 HB3 LYS 25 HB3 LYS 25 17.893 -16.989 20.441 186 HG2 LYS 25 HG2 LYS 25 18.167 -18.583 22.019 187 HG3 LYS 25 HG3 LYS 25 18.700 -17.192 22.967 188 HD2 LYS 25 HD2 LYS 25 16.774 -17.137 24.221 189 HD3 LYS 25 HD3 LYS 25 15.806 -17.910 22.963 190 HE2 LYS 25 HE2 LYS 25 18.003 -19.423 24.316 191 HE3 LYS 25 3HE LYS 25 16.439 -19.238 25.109 192 HZ1 LYS 25 1HZ LYS 25 15.712 -20.922 23.895 193 HZ2 LYS 25 2HZ LYS 25 17.171 -21.015 23.046 194 HZ3 LYS 25 3HZ LYS 25 15.932 -20.006 22.491 195 H LEU 26 H LEU 26 17.719 -14.334 19.278 196 HA LEU 26 HA LEU 26 20.648 -14.015 19.270 197 HB2 LEU 26 HB2 LEU 26 18.760 -14.544 16.982 198 HB3 LEU 26 HB3 LEU 26 20.481 -14.208 16.802 199 HG LEU 26 HG LEU 26 19.627 -16.510 18.497 200 HD11 LEU 26 HD11 LEU 26 19.982 -17.767 16.175 201 HD12 LEU 26 HD12 LEU 26 19.272 -16.271 15.569 202 HD13 LEU 26 HD13 LEU 26 18.395 -17.249 16.745 203 HD21 LEU 26 HD21 LEU 26 21.995 -15.749 18.315 204 HD22 LEU 26 HD22 LEU 26 21.941 -16.154 16.599 205 HD23 LEU 26 HD23 LEU 26 21.731 -17.419 17.811 206 HA PRO 27 HA PRO 27 18.778 -9.774 18.989 207 HB2 PRO 27 HB2 PRO 27 20.492 -8.646 20.765 208 HB3 PRO 27 HB3 PRO 27 18.994 -9.446 21.253 209 HG2 PRO 27 HG2 PRO 27 21.795 -10.500 21.270 210 HG3 PRO 27 HG3 PRO 27 20.530 -10.668 22.500 211 HD2 PRO 27 HD2 PRO 27 21.124 -12.641 20.742 212 HD3 PRO 27 HD3 PRO 27 19.483 -12.383 21.370 213 H GLU 28 H GLU 28 21.893 -11.186 18.565 214 HA GLU 28 HA GLU 28 23.456 -9.036 17.790 215 HB2 GLU 28 HB2 GLU 28 24.707 -10.680 16.391 216 HB3 GLU 28 HB3 GLU 28 24.434 -11.214 18.044 217 HG2 GLU 28 HG2 GLU 28 22.698 -12.696 17.359 218 HG3 GLU 28 HG3 GLU 28 22.715 -12.042 15.721 219 H ILE 29 H ILE 29 20.898 -10.666 16.067 220 HA ILE 29 HA ILE 29 21.480 -9.647 13.485 221 HB ILE 29 HB ILE 29 19.226 -10.315 12.875 222 HG12 ILE 29 HG12 ILE 29 18.094 -11.515 15.071 223 HG13 ILE 29 HG13 ILE 29 18.801 -10.063 15.769 224 HG21 ILE 29 HG21 ILE 29 20.070 -12.479 14.738 225 HG22 ILE 29 HG22 ILE 29 19.564 -12.575 13.052 226 HG23 ILE 29 HG23 ILE 29 21.174 -11.979 13.456 227 HD11 ILE 29 HD11 ILE 29 16.914 -10.113 13.427 228 HD12 ILE 29 HD12 ILE 29 16.468 -9.751 15.096 229 HD13 ILE 29 HD13 ILE 29 17.564 -8.680 14.223 230 H GLY 30 H GLY 30 19.741 -8.388 16.244 231 HA2 GLY 30 HA2 GLY 30 18.264 -6.364 14.985 232 HA3 GLY 30 HA3 GLY 30 18.803 -6.335 16.657 233 H LYS 31 H LYS 31 21.646 -6.618 15.552 234 HA LYS 31 HA LYS 31 22.186 -3.797 15.484 235 HB2 LYS 31 HB2 LYS 31 24.144 -6.037 14.979 236 HB3 LYS 31 HB3 LYS 31 24.500 -4.403 15.522 237 HG2 LYS 31 HG2 LYS 31 22.752 -5.392 17.433 238 HG3 LYS 31 HG3 LYS 31 23.810 -6.752 17.054 239 HD2 LYS 31 HD2 LYS 31 25.665 -5.714 17.872 240 HD3 LYS 31 HD3 LYS 31 25.085 -4.102 17.441 241 HE2 LYS 31 HE2 LYS 31 23.806 -5.710 19.631 242 HE3 LYS 31 3HE LYS 31 25.224 -4.708 19.930 243 HZ1 LYS 31 1HZ LYS 31 23.287 -3.446 20.437 244 HZ2 LYS 31 2HZ LYS 31 22.575 -3.804 18.947 245 HZ3 LYS 31 3HZ LYS 31 23.943 -2.812 19.013 246 H SER 32 H SER 32 22.116 -6.434 13.168 247 HA SER 32 HA SER 32 23.230 -4.829 11.040 248 HB2 SER 32 HB2 SER 32 23.291 -7.462 11.424 249 HB3 SER 32 HB3 SER 32 21.802 -7.390 10.482 250 HG SER 32 HG SER 32 23.653 -7.651 9.157 251 H ILE 33 H ILE 33 20.057 -6.230 11.816 252 HA ILE 33 HA ILE 33 18.760 -4.982 9.588 253 HB ILE 33 HB ILE 33 17.461 -6.148 12.050 254 HG12 ILE 33 HG12 ILE 33 18.165 -7.521 9.447 255 HG13 ILE 33 HG13 ILE 33 19.008 -7.757 10.974 256 HG21 ILE 33 HG21 ILE 33 15.553 -6.502 10.532 257 HG22 ILE 33 HG22 ILE 33 15.963 -4.798 10.715 258 HG23 ILE 33 HG23 ILE 33 16.437 -5.666 9.256 259 HD11 ILE 33 HD11 ILE 33 16.821 -8.540 11.931 260 HD12 ILE 33 HD12 ILE 33 16.191 -8.529 10.284 261 HD13 ILE 33 HD13 ILE 33 17.540 -9.583 10.704 262 H GLY 34 H GLY 34 19.472 -4.084 12.857 263 HA2 GLY 34 HA2 GLY 34 17.512 -2.231 13.449 264 HA3 GLY 34 HA3 GLY 34 19.185 -2.093 13.969 265 H LYS 35 H LYS 35 20.564 -1.602 11.719 266 HA LYS 35 HA LYS 35 20.169 1.113 11.260 267 HB2 LYS 35 HB2 LYS 35 22.095 -0.760 10.595 268 HB3 LYS 35 HB3 LYS 35 21.470 -0.255 9.030 269 HG2 LYS 35 HG2 LYS 35 21.827 2.135 9.857 270 HG3 LYS 35 HG3 LYS 35 22.798 1.408 11.141 271 HD2 LYS 35 HD2 LYS 35 23.850 0.161 9.002 272 HD3 LYS 35 HD3 LYS 35 23.358 1.681 8.251 273 HE2 LYS 35 HE2 LYS 35 25.327 2.454 8.988 274 HE3 LYS 35 3HE LYS 35 24.531 2.546 10.558 275 HZ1 LYS 35 1HZ LYS 35 25.503 -0.071 10.110 276 HZ2 LYS 35 2HZ LYS 35 25.897 1.011 11.348 277 HZ3 LYS 35 3HZ LYS 35 26.755 1.045 9.891 278 H THR 36 H THR 36 18.649 -1.617 9.821 279 HA THR 36 HA THR 36 17.698 -0.118 7.515 280 HB THR 36 HB THR 36 16.992 -2.938 8.345 281 HG1 THR 36 HG1 THR 36 19.113 -3.067 7.878 282 HG21 THR 36 HG21 THR 36 15.401 -2.524 6.776 283 HG22 THR 36 HG22 THR 36 16.729 -2.888 5.674 284 HG23 THR 36 HG23 THR 36 16.318 -1.212 6.038 285 H VAL 37 H VAL 37 16.104 -2.078 10.039 286 HA VAL 37 HA VAL 37 13.521 -1.160 9.632 287 HB VAL 37 HB VAL 37 13.987 -3.078 11.053 288 HG11 VAL 37 HG11 VAL 37 15.103 -3.000 13.090 289 HG12 VAL 37 HG12 VAL 37 16.047 -1.904 12.080 290 HG13 VAL 37 HG13 VAL 37 14.897 -1.257 13.250 291 HG21 VAL 37 HG21 VAL 37 11.983 -1.380 11.395 292 HG22 VAL 37 HG22 VAL 37 12.204 -2.779 12.448 293 HG23 VAL 37 HG23 VAL 37 12.742 -1.184 12.976 294 H LYS 38 H LYS 38 16.094 0.201 11.632 295 HA LYS 38 HA LYS 38 14.458 2.247 12.773 296 HB2 LYS 38 HB2 LYS 38 17.468 2.040 12.577 297 HB3 LYS 38 HB3 LYS 38 16.591 3.189 13.579 298 HG2 LYS 38 HG2 LYS 38 15.914 1.572 15.076 299 HG3 LYS 38 HG3 LYS 38 16.112 0.261 13.911 300 HD2 LYS 38 HD2 LYS 38 17.966 -0.102 15.189 301 HD3 LYS 38 HD3 LYS 38 18.644 1.044 14.030 302 HE2 LYS 38 HE2 LYS 38 18.033 2.867 15.665 303 HE3 LYS 38 3HE LYS 38 17.678 1.592 16.829 304 HZ1 LYS 38 1HZ LYS 38 20.004 0.794 16.437 305 HZ2 LYS 38 2HZ LYS 38 19.883 2.288 17.221 306 HZ3 LYS 38 3HZ LYS 38 20.290 2.225 15.581 307 H SER 39 H SER 39 16.235 1.890 9.835 308 HA SER 39 HA SER 39 16.495 4.684 9.261 309 HB2 SER 39 HB2 SER 39 18.075 3.432 8.111 310 HB3 SER 39 HB3 SER 39 16.930 2.146 7.731 311 HG SER 39 HG SER 39 17.550 3.589 5.951 312 H PHE 40 H PHE 40 14.263 2.116 8.279 313 HA PHE 40 HA PHE 40 12.766 3.566 6.424 314 HB2 PHE 40 HB2 PHE 40 12.621 1.023 7.666 315 HB3 PHE 40 HB3 PHE 40 11.046 1.784 7.866 316 HD1 PHE 40 HD1 PHE 40 13.159 -0.032 5.680 317 HD2 PHE 40 HD2 PHE 40 9.966 2.782 5.750 318 HE1 PHE 40 HE1 PHE 40 12.582 -0.633 3.365 319 HE2 PHE 40 HE2 PHE 40 9.383 2.183 3.436 320 HZ PHE 40 HZ PHE 40 10.691 0.473 2.240 321 H GLN 41 H GLN 41 12.636 3.487 9.919 322 HA GLN 41 HA GLN 41 10.133 4.739 10.258 323 HB2 GLN 41 HB2 GLN 41 12.325 3.903 11.922 324 HB3 GLN 41 HB3 GLN 41 11.795 5.509 12.403 325 HG2 GLN 41 HG2 GLN 41 9.719 3.440 11.959 326 HG3 GLN 41 HG3 GLN 41 10.722 3.316 13.403 327 HE21 GLN 41 HE21 GLN 41 7.882 4.431 12.313 328 HE22 GLN 41 HE22 GLN 41 7.616 5.735 13.416 329 H GLN 42 H GLN 42 13.391 6.010 9.833 330 HA GLN 42 HA GLN 42 12.793 8.708 10.410 331 HB2 GLN 42 HB2 GLN 42 15.089 7.602 10.243 332 HB3 GLN 42 HB3 GLN 42 14.933 7.786 8.501 333 HG2 GLN 42 HG2 GLN 42 15.941 9.747 8.819 334 HG3 GLN 42 HG3 GLN 42 14.357 10.298 9.365 335 HE21 GLN 42 HE21 GLN 42 14.347 11.297 11.235 336 HE22 GLN 42 HE22 GLN 42 15.484 11.082 12.518 337 H ALA 43 H ALA 43 12.607 6.791 7.472 338 HA ALA 43 HA ALA 43 12.044 9.044 5.777 339 HB1 ALA 43 HB1 ALA 43 13.119 6.798 5.118 340 HB2 ALA 43 HB2 ALA 43 11.462 6.199 5.046 341 HB3 ALA 43 HB3 ALA 43 11.962 7.536 4.010 342 H ALA 44 H ALA 44 10.174 6.552 7.422 343 HA ALA 44 HA ALA 44 7.685 7.155 6.205 344 HB1 ALA 44 HB1 ALA 44 8.497 5.098 7.656 345 HB2 ALA 44 HB2 ALA 44 7.762 6.036 8.956 346 HB3 ALA 44 HB3 ALA 44 6.796 5.554 7.562 347 H LYS 45 H LYS 45 9.448 8.525 8.872 348 HA LYS 45 HA LYS 45 7.397 9.796 10.267 349 HB2 LYS 45 HB2 LYS 45 10.227 9.813 10.277 350 HB3 LYS 45 HB3 LYS 45 9.713 11.492 10.167 351 HG2 LYS 45 HG2 LYS 45 8.160 10.060 12.131 352 HG3 LYS 45 HG3 LYS 45 9.890 9.933 12.461 353 HD2 LYS 45 HD2 LYS 45 8.423 12.519 11.947 354 HD3 LYS 45 HD3 LYS 45 8.817 11.890 13.547 355 HE2 LYS 45 HE2 LYS 45 11.235 11.851 12.766 356 HE3 LYS 45 3HE LYS 45 10.698 12.812 11.390 357 HZ1 LYS 45 1HZ LYS 45 11.217 13.632 14.064 358 HZ2 LYS 45 2HZ LYS 45 9.651 14.065 13.596 359 HZ3 LYS 45 3HZ LYS 45 10.980 14.577 12.681 360 H GLU 46 H GLU 46 9.192 10.831 7.403 361 HA GLU 46 HA GLU 46 8.000 13.413 7.265 362 HB2 GLU 46 HB2 GLU 46 10.179 12.450 6.142 363 HB3 GLU 46 HB3 GLU 46 9.074 12.033 4.840 364 HG2 GLU 46 HG2 GLU 46 8.389 14.389 4.694 365 HG3 GLU 46 HG3 GLU 46 9.551 14.787 5.956 366 H PHE 47 H PHE 47 7.138 10.250 6.083 367 HA PHE 47 HA PHE 47 5.303 10.957 4.095 368 HB2 PHE 47 HB2 PHE 47 6.006 8.569 5.587 369 HB3 PHE 47 HB3 PHE 47 4.273 8.653 5.289 370 HD1 PHE 47 HD1 PHE 47 3.438 8.828 2.951 371 HD2 PHE 47 HD2 PHE 47 7.527 8.072 3.858 372 HE1 PHE 47 HE1 PHE 47 3.793 8.016 0.657 373 HE2 PHE 47 HE2 PHE 47 7.889 7.259 1.563 374 HZ PHE 47 HZ PHE 47 6.021 7.231 -0.040 375 H GLU 48 H GLU 48 5.001 10.838 7.580 376 HA GLU 48 HA GLU 48 2.222 10.893 7.826 377 HB2 GLU 48 HB2 GLU 48 4.211 10.796 9.601 378 HB3 GLU 48 HB3 GLU 48 3.848 12.512 9.721 379 HG2 GLU 48 HG2 GLU 48 2.525 11.617 11.372 380 HG3 GLU 48 HG3 GLU 48 1.403 11.726 10.017 381 H SER 49 H SER 49 4.480 13.390 6.953 382 HA SER 49 HA SER 49 2.676 15.577 7.385 383 HB2 SER 49 HB2 SER 49 5.160 15.538 5.658 384 HB3 SER 49 HB3 SER 49 4.370 16.951 6.356 385 HG SER 49 HG SER 49 6.149 16.360 7.613 386 H GLU 50 H GLU 50 3.443 13.434 4.741 387 HA GLU 50 HA GLU 50 2.123 15.013 2.736 388 HB2 GLU 50 HB2 GLU 50 2.895 12.093 2.626 389 HB3 GLU 50 HB3 GLU 50 2.513 13.132 1.260 390 HG2 GLU 50 HG2 GLU 50 4.524 14.534 2.355 391 HG3 GLU 50 HG3 GLU 50 4.988 12.903 2.835 392 H LEU 51 H LEU 51 0.178 15.183 4.250 393 HA LEU 51 HA LEU 51 -2.029 14.768 4.601 394 HB2 LEU 51 HB2 LEU 51 -1.429 13.633 2.025 395 HB3 LEU 51 HB3 LEU 51 -2.661 12.676 2.845 396 HG LEU 51 HG LEU 51 -2.880 15.654 2.446 397 HD11 LEU 51 HD11 LEU 51 -3.867 15.388 0.424 398 HD12 LEU 51 HD12 LEU 51 -4.471 13.775 0.802 399 HD13 LEU 51 HD13 LEU 51 -2.778 14.001 0.360 400 HD21 LEU 51 HD21 LEU 51 -4.602 15.409 3.828 401 HD22 LEU 51 HD22 LEU 51 -4.416 13.655 3.845 402 HD23 LEU 51 HD23 LEU 51 -5.381 14.429 2.585 403 H LYS 52 H LYS 52 0.214 13.026 5.724 404 HA LYS 52 HA LYS 52 0.356 11.368 7.278 405 HB2 LYS 52 HB2 LYS 52 -2.431 12.127 7.297 406 HB3 LYS 52 HB3 LYS 52 -2.261 10.404 7.608 407 HG2 LYS 52 HG2 LYS 52 -0.567 11.011 9.374 408 HG3 LYS 52 HG3 LYS 52 -1.075 12.687 9.159 409 HD2 LYS 52 HD2 LYS 52 -2.620 12.238 10.717 410 HD3 LYS 52 HD3 LYS 52 -3.465 11.366 9.437 411 HE2 LYS 52 HE2 LYS 52 -2.093 9.342 10.115 412 HE3 LYS 52 3HE LYS 52 -1.627 10.259 11.545 413 HZ1 LYS 52 1HZ LYS 52 -4.406 9.566 10.762 414 HZ2 LYS 52 2HZ LYS 52 -3.966 10.458 12.130 415 HZ3 LYS 52 3HZ LYS 52 -3.515 8.832 12.000 416 H THR 53 H THR 53 -2.505 10.179 5.547 417 HA THR 53 HA THR 53 -0.860 7.986 4.468 418 HB THR 53 HB THR 53 -3.693 7.402 5.168 419 HG1 THR 53 HG1 THR 53 -3.173 8.178 7.133 420 HG21 THR 53 HG21 THR 53 -2.869 5.191 5.490 421 HG22 THR 53 HG22 THR 53 -1.197 5.751 5.531 422 HG23 THR 53 HG23 THR 53 -2.111 5.808 4.023 Start of MODEL 8 1 H1 ALA 1 H ALA 1 -6.410 -12.711 8.507 2 HA ALA 1 HA ALA 1 -7.631 -12.800 6.381 3 HB1 ALA 1 HB1 ALA 1 -8.510 -10.317 7.347 4 HB2 ALA 1 HB2 ALA 1 -7.646 -9.983 5.845 5 HB3 ALA 1 HB3 ALA 1 -8.989 -11.126 5.854 6 H LEU 2 H LEU 2 -5.810 -13.589 5.462 7 HA LEU 2 HA LEU 2 -3.660 -11.678 4.829 8 HB2 LEU 2 HB2 LEU 2 -3.354 -14.653 4.712 9 HB3 LEU 2 HB3 LEU 2 -2.111 -13.417 4.889 10 HG LEU 2 HG LEU 2 -4.110 -14.138 7.029 11 HD11 LEU 2 HD11 LEU 2 -1.336 -14.816 7.531 12 HD12 LEU 2 HD12 LEU 2 -2.002 -15.693 6.154 13 HD13 LEU 2 HD13 LEU 2 -2.794 -15.790 7.725 14 HD21 LEU 2 HD21 LEU 2 -1.523 -12.652 7.350 15 HD22 LEU 2 HD22 LEU 2 -2.892 -12.743 8.458 16 HD23 LEU 2 HD23 LEU 2 -3.028 -11.818 6.961 17 H PHE 3 H PHE 3 -6.119 -12.001 3.310 18 HA PHE 3 HA PHE 3 -5.507 -13.518 0.952 19 HB2 PHE 3 HB2 PHE 3 -7.776 -12.068 2.015 20 HB3 PHE 3 HB3 PHE 3 -7.527 -11.682 0.315 21 HD1 PHE 3 HD1 PHE 3 -8.849 -14.029 2.633 22 HD2 PHE 3 HD2 PHE 3 -7.301 -13.644 -1.313 23 HE1 PHE 3 HE1 PHE 3 -9.947 -16.138 2.001 24 HE2 PHE 3 HE2 PHE 3 -8.397 -15.751 -1.953 25 HZ PHE 3 HZ PHE 3 -9.722 -17.001 -0.296 26 H GLY 4 H GLY 4 -5.079 -10.225 2.011 27 HA2 GLY 4 HA2 GLY 4 -4.519 -9.199 -0.628 28 HA3 GLY 4 HA3 GLY 4 -4.327 -8.338 0.891 29 H LEU 5 H LEU 5 -2.888 -11.244 -0.599 30 HA LEU 5 HA LEU 5 -0.369 -10.892 0.611 31 HB2 LEU 5 HB2 LEU 5 -1.374 -12.497 -1.704 32 HB3 LEU 5 HB3 LEU 5 0.354 -12.418 -1.366 33 HG LEU 5 HG LEU 5 -1.526 -13.222 0.811 34 HD11 LEU 5 HD11 LEU 5 -0.832 -14.800 -1.615 35 HD12 LEU 5 HD12 LEU 5 -2.324 -14.768 -0.676 36 HD13 LEU 5 HD13 LEU 5 -0.912 -15.623 -0.057 37 HD21 LEU 5 HD21 LEU 5 0.892 -14.727 0.584 38 HD22 LEU 5 HD22 LEU 5 0.379 -13.633 1.869 39 HD23 LEU 5 HD23 LEU 5 1.265 -13.007 0.477 40 H GLY 6 H GLY 6 1.684 -10.734 -0.814 41 HA2 GLY 6 HA2 GLY 6 1.707 -9.257 -3.194 42 HA3 GLY 6 HA3 GLY 6 1.806 -8.119 -1.857 43 H VAL 7 H VAL 7 3.769 -8.822 -3.955 44 HA VAL 7 HA VAL 7 5.860 -10.374 -2.878 45 HB VAL 7 HB VAL 7 6.274 -8.079 -4.782 46 HG11 VAL 7 HG11 VAL 7 8.321 -9.056 -4.121 47 HG12 VAL 7 HG12 VAL 7 7.675 -10.692 -4.269 48 HG13 VAL 7 HG13 VAL 7 7.959 -9.720 -5.714 49 HG21 VAL 7 HG21 VAL 7 4.767 -10.581 -5.171 50 HG22 VAL 7 HG22 VAL 7 4.657 -9.044 -6.028 51 HG23 VAL 7 HG23 VAL 7 5.938 -10.188 -6.429 52 HA PRO 8 HA PRO 8 7.722 -6.121 -1.465 53 HB2 PRO 8 HB2 PRO 8 5.978 -4.048 -1.287 54 HB3 PRO 8 HB3 PRO 8 6.902 -4.403 -2.751 55 HG2 PRO 8 HG2 PRO 8 4.064 -5.087 -2.088 56 HG3 PRO 8 HG3 PRO 8 4.741 -4.471 -3.607 57 HD2 PRO 8 HD2 PRO 8 4.150 -7.087 -3.229 58 HD3 PRO 8 HD3 PRO 8 5.492 -6.551 -4.260 59 H GLU 9 H GLU 9 4.477 -7.088 -0.587 60 HA GLU 9 HA GLU 9 4.515 -5.995 2.046 61 HB2 GLU 9 HB2 GLU 9 2.537 -6.913 0.496 62 HB3 GLU 9 HB3 GLU 9 2.828 -8.367 1.440 63 HG2 GLU 9 HG2 GLU 9 2.356 -7.232 3.479 64 HG3 GLU 9 HG3 GLU 9 2.311 -5.671 2.663 65 H LEU 10 H LEU 10 5.690 -8.917 0.601 66 HA LEU 10 HA LEU 10 5.971 -10.336 3.096 67 HB2 LEU 10 HB2 LEU 10 5.638 -11.305 0.722 68 HB3 LEU 10 HB3 LEU 10 7.374 -11.053 0.547 69 HG LEU 10 HG LEU 10 6.442 -12.588 2.912 70 HD11 LEU 10 HD11 LEU 10 6.476 -13.706 0.113 71 HD12 LEU 10 HD12 LEU 10 5.068 -13.538 1.161 72 HD13 LEU 10 HD13 LEU 10 6.358 -14.660 1.593 73 HD21 LEU 10 HD21 LEU 10 8.547 -13.420 2.895 74 HD22 LEU 10 HD22 LEU 10 8.868 -11.934 2.001 75 HD23 LEU 10 HD23 LEU 10 8.640 -13.453 1.133 76 H ALA 11 H ALA 11 7.878 -8.194 1.154 77 HA ALA 11 HA ALA 11 10.368 -8.881 2.468 78 HB1 ALA 11 HB1 ALA 11 11.398 -7.730 0.828 79 HB2 ALA 11 HB2 ALA 11 9.843 -7.895 0.013 80 HB3 ALA 11 HB3 ALA 11 10.233 -6.408 0.877 81 H VAL 12 H VAL 12 7.795 -6.588 2.815 82 HA VAL 12 HA VAL 12 9.337 -4.849 4.563 83 HB VAL 12 HB VAL 12 7.653 -3.915 2.979 84 HG11 VAL 12 HG11 VAL 12 6.014 -5.801 3.357 85 HG12 VAL 12 HG12 VAL 12 5.577 -5.000 4.867 86 HG13 VAL 12 HG13 VAL 12 5.328 -4.177 3.327 87 HG21 VAL 12 HG21 VAL 12 8.416 -2.807 5.130 88 HG22 VAL 12 HG22 VAL 12 6.896 -2.231 4.448 89 HG23 VAL 12 HG23 VAL 12 6.883 -3.330 5.826 90 H ILE 13 H ILE 13 6.981 -7.408 4.768 91 HA ILE 13 HA ILE 13 5.989 -7.040 7.334 92 HB ILE 13 HB ILE 13 5.195 -8.768 5.722 93 HG12 ILE 13 HG12 ILE 13 5.941 -10.000 8.374 94 HG13 ILE 13 HG13 ILE 13 4.704 -8.758 8.219 95 HG21 ILE 13 HG21 ILE 13 7.105 -10.781 6.653 96 HG22 ILE 13 HG22 ILE 13 6.440 -10.503 5.043 97 HG23 ILE 13 HG23 ILE 13 7.806 -9.543 5.610 98 HD11 ILE 13 HD11 ILE 13 3.733 -10.406 6.427 99 HD12 ILE 13 HD12 ILE 13 4.671 -11.592 7.337 100 HD13 ILE 13 HD13 ILE 13 3.426 -10.642 8.147 101 H ALA 14 H ALA 14 9.122 -8.095 6.295 102 HA ALA 14 HA ALA 14 10.037 -9.502 8.500 103 HB1 ALA 14 HB1 ALA 14 11.763 -7.552 7.004 104 HB2 ALA 14 HB2 ALA 14 12.215 -9.095 7.730 105 HB3 ALA 14 HB3 ALA 14 11.212 -9.062 6.279 106 H GLY 15 H GLY 15 10.396 -5.996 7.901 107 HA2 GLY 15 HA2 GLY 15 11.535 -5.365 10.381 108 HA3 GLY 15 HA3 GLY 15 10.666 -4.239 9.350 109 H VAL 16 H VAL 16 8.189 -5.813 9.456 110 HA VAL 16 HA VAL 16 7.067 -4.604 11.783 111 HB VAL 16 HB VAL 16 5.773 -6.677 10.011 112 HG11 VAL 16 HG11 VAL 16 3.895 -4.816 10.847 113 HG12 VAL 16 HG12 VAL 16 4.103 -6.454 11.470 114 HG13 VAL 16 HG13 VAL 16 4.893 -5.096 12.273 115 HG21 VAL 16 HG21 VAL 16 5.974 -3.690 9.671 116 HG22 VAL 16 HG22 VAL 16 6.569 -4.937 8.574 117 HG23 VAL 16 HG23 VAL 16 4.834 -4.708 8.792 118 H ALA 17 H ALA 17 7.393 -8.018 10.794 119 HA ALA 17 HA ALA 17 6.496 -9.138 13.196 120 HB1 ALA 17 HB1 ALA 17 6.590 -10.869 11.798 121 HB2 ALA 17 HB2 ALA 17 7.784 -10.074 10.771 122 HB3 ALA 17 HB3 ALA 17 8.305 -10.973 12.197 123 H ALA 18 H ALA 18 9.547 -7.745 12.332 124 HA ALA 18 HA ALA 18 11.111 -8.981 14.368 125 HB1 ALA 18 HB1 ALA 18 11.533 -7.118 12.237 126 HB2 ALA 18 HB2 ALA 18 12.263 -6.498 13.719 127 HB3 ALA 18 HB3 ALA 18 12.712 -8.093 13.114 128 H LEU 19 H LEU 19 8.942 -6.284 14.280 129 HA LEU 19 HA LEU 19 9.921 -5.149 16.760 130 HB2 LEU 19 HB2 LEU 19 7.652 -4.473 14.913 131 HB3 LEU 19 HB3 LEU 19 7.858 -3.677 16.472 132 HG LEU 19 HG LEU 19 10.170 -3.663 14.609 133 HD11 LEU 19 HD11 LEU 19 9.347 -2.104 13.145 134 HD12 LEU 19 HD12 LEU 19 8.074 -1.578 14.246 135 HD13 LEU 19 HD13 LEU 19 7.919 -3.110 13.387 136 HD21 LEU 19 HD21 LEU 19 10.676 -2.540 16.541 137 HD22 LEU 19 HD22 LEU 19 9.023 -1.969 16.774 138 HD23 LEU 19 HD23 LEU 19 10.053 -1.217 15.555 139 H LEU 20 H LEU 20 7.477 -7.358 15.694 140 HA LEU 20 HA LEU 20 6.053 -7.256 18.231 141 HB2 LEU 20 HB2 LEU 20 5.621 -8.882 15.732 142 HB3 LEU 20 HB3 LEU 20 4.617 -9.004 17.176 143 HG LEU 20 HG LEU 20 4.942 -6.492 15.538 144 HD11 LEU 20 HD11 LEU 20 2.562 -8.327 15.573 145 HD12 LEU 20 HD12 LEU 20 3.834 -8.434 14.357 146 HD13 LEU 20 HD13 LEU 20 2.877 -6.960 14.503 147 HD21 LEU 20 HD21 LEU 20 2.584 -6.350 16.920 148 HD22 LEU 20 HD22 LEU 20 4.098 -5.579 17.397 149 HD23 LEU 20 HD23 LEU 20 3.654 -7.146 18.075 150 H PHE 21 H PHE 21 8.317 -9.278 16.501 151 HA PHE 21 HA PHE 21 8.168 -11.336 18.576 152 HB2 PHE 21 HB2 PHE 21 8.465 -11.541 15.860 153 HB3 PHE 21 HB3 PHE 21 10.128 -11.695 16.417 154 HD1 PHE 21 HD1 PHE 21 10.903 -13.690 17.368 155 HD2 PHE 21 HD2 PHE 21 6.727 -13.103 16.793 156 HE1 PHE 21 HE1 PHE 21 10.497 -16.052 17.926 157 HE2 PHE 21 HE2 PHE 21 6.314 -15.462 17.352 158 HZ PHE 21 HZ PHE 21 8.200 -16.940 17.919 159 H GLY 22 H GLY 22 10.215 -8.786 17.389 160 HA2 GLY 22 HA2 GLY 22 12.690 -9.483 18.413 161 HA3 GLY 22 HA3 GLY 22 12.106 -7.831 18.275 162 HA PRO 23 HA PRO 23 11.878 -7.397 22.626 163 HB2 PRO 23 HB2 PRO 23 9.515 -6.124 23.033 164 HB3 PRO 23 HB3 PRO 23 10.922 -5.332 22.310 165 HG2 PRO 23 HG2 PRO 23 8.515 -6.507 20.973 166 HG3 PRO 23 HG3 PRO 23 9.353 -4.982 20.631 167 HD2 PRO 23 HD2 PRO 23 9.724 -7.215 19.144 168 HD3 PRO 23 HD3 PRO 23 11.010 -6.021 19.413 169 H LYS 24 H LYS 24 10.207 -7.609 24.554 170 HA LYS 24 HA LYS 24 8.114 -9.487 24.355 171 HB2 LYS 24 HB2 LYS 24 10.028 -11.011 23.896 172 HB3 LYS 24 HB3 LYS 24 10.692 -10.601 25.472 173 HG2 LYS 24 HG2 LYS 24 7.973 -11.434 25.773 174 HG3 LYS 24 HG3 LYS 24 8.866 -12.637 24.839 175 HD2 LYS 24 HD2 LYS 24 10.010 -11.495 27.363 176 HD3 LYS 24 HD3 LYS 24 8.847 -12.822 27.418 177 HE2 LYS 24 HE2 LYS 24 10.280 -14.230 26.135 178 HE3 LYS 24 3HE LYS 24 11.370 -12.892 25.774 179 HZ1 LYS 24 1HZ LYS 24 12.016 -14.541 27.606 180 HZ2 LYS 24 2HZ LYS 24 10.884 -13.725 28.562 181 HZ3 LYS 24 3HZ LYS 24 12.207 -12.890 27.918 182 H LYS 25 H LYS 25 7.228 -7.803 25.647 183 HA LYS 25 HA LYS 25 6.630 -6.770 27.586 184 HB2 LYS 25 HB2 LYS 25 6.242 -9.248 28.090 185 HB3 LYS 25 HB3 LYS 25 7.745 -9.186 29.001 186 HG2 LYS 25 HG2 LYS 25 6.590 -7.157 30.185 187 HG3 LYS 25 HG3 LYS 25 5.114 -7.924 29.591 188 HD2 LYS 25 HD2 LYS 25 5.202 -9.210 31.414 189 HD3 LYS 25 HD3 LYS 25 6.570 -10.025 30.652 190 HE2 LYS 25 HE2 LYS 25 7.742 -9.402 32.448 191 HE3 LYS 25 3HE LYS 25 7.718 -7.782 31.754 192 HZ1 LYS 25 1HZ LYS 25 6.605 -8.625 34.161 193 HZ2 LYS 25 2HZ LYS 25 5.314 -8.230 33.143 194 HZ3 LYS 25 3HZ LYS 25 6.519 -7.087 33.461 195 H LEU 26 H LEU 26 9.168 -6.056 26.605 196 HA LEU 26 HA LEU 26 11.098 -5.001 27.190 197 HB2 LEU 26 HB2 LEU 26 9.545 -4.610 29.743 198 HB3 LEU 26 HB3 LEU 26 11.039 -3.766 29.340 199 HG LEU 26 HG LEU 26 9.135 -3.398 27.231 200 HD11 LEU 26 HD11 LEU 26 8.136 -2.995 30.022 201 HD12 LEU 26 HD12 LEU 26 7.304 -3.676 28.624 202 HD13 LEU 26 HD13 LEU 26 7.602 -1.940 28.712 203 HD21 LEU 26 HD21 LEU 26 10.995 -1.926 27.610 204 HD22 LEU 26 HD22 LEU 26 10.425 -1.556 29.238 205 HD23 LEU 26 HD23 LEU 26 9.499 -1.018 27.836 206 HA PRO 27 HA PRO 27 12.625 -8.749 29.477 207 HB2 PRO 27 HB2 PRO 27 14.478 -9.424 27.612 208 HB3 PRO 27 HB3 PRO 27 12.797 -9.966 27.536 209 HG2 PRO 27 HG2 PRO 27 14.127 -7.710 26.085 210 HG3 PRO 27 HG3 PRO 27 12.975 -8.911 25.472 211 HD2 PRO 27 HD2 PRO 27 12.235 -6.395 26.145 212 HD3 PRO 27 HD3 PRO 27 11.154 -7.791 26.333 213 H GLU 28 H GLU 28 13.642 -5.705 28.766 214 HA GLU 28 HA GLU 28 16.390 -5.661 29.015 215 HB2 GLU 28 HB2 GLU 28 16.032 -3.400 30.119 216 HB3 GLU 28 HB3 GLU 28 15.303 -3.619 28.534 217 HG2 GLU 28 HG2 GLU 28 13.139 -3.909 29.484 218 HG3 GLU 28 HG3 GLU 28 13.804 -3.970 31.115 219 H ILE 29 H ILE 29 13.948 -6.048 31.510 220 HA ILE 29 HA ILE 29 15.580 -5.692 33.762 221 HB ILE 29 HB ILE 29 13.878 -6.690 35.046 222 HG12 ILE 29 HG12 ILE 29 13.814 -8.806 33.678 223 HG13 ILE 29 HG13 ILE 29 12.243 -8.240 34.234 224 HG21 ILE 29 HG21 ILE 29 12.542 -5.532 32.603 225 HG22 ILE 29 HG22 ILE 29 11.831 -5.670 34.211 226 HG23 ILE 29 HG23 ILE 29 13.212 -4.605 33.945 227 HD11 ILE 29 HD11 ILE 29 11.829 -7.270 32.022 228 HD12 ILE 29 HD12 ILE 29 13.386 -7.892 31.474 229 HD13 ILE 29 HD13 ILE 29 12.109 -9.009 31.952 230 H GLY 30 H GLY 30 15.257 -8.348 31.553 231 HA2 GLY 30 HA2 GLY 30 16.306 -10.390 33.223 232 HA3 GLY 30 HA3 GLY 30 16.241 -10.424 31.467 233 H LYS 31 H LYS 31 17.797 -7.965 31.178 234 HA LYS 31 HA LYS 31 20.359 -9.072 30.969 235 HB2 LYS 31 HB2 LYS 31 19.096 -6.661 30.248 236 HB3 LYS 31 HB3 LYS 31 20.485 -6.203 31.224 237 HG2 LYS 31 HG2 LYS 31 20.825 -8.186 29.024 238 HG3 LYS 31 HG3 LYS 31 20.719 -6.466 28.647 239 HD2 LYS 31 HD2 LYS 31 22.510 -6.298 30.587 240 HD3 LYS 31 HD3 LYS 31 22.827 -7.970 30.114 241 HE2 LYS 31 HE2 LYS 31 24.300 -6.519 28.887 242 HE3 LYS 31 3HE LYS 31 23.116 -7.202 27.775 243 HZ1 LYS 31 1HZ LYS 31 22.615 -5.147 27.174 244 HZ2 LYS 31 2HZ LYS 31 23.646 -4.490 28.343 245 HZ3 LYS 31 3HZ LYS 31 22.037 -4.836 28.733 246 H SER 32 H SER 32 18.773 -7.436 33.594 247 HA SER 32 HA SER 32 21.194 -6.931 35.072 248 HB2 SER 32 HB2 SER 32 18.682 -6.944 36.591 249 HB3 SER 32 HB3 SER 32 19.886 -5.669 36.415 250 HG SER 32 HG SER 32 18.957 -5.331 34.276 251 H ILE 33 H ILE 33 18.783 -9.444 34.891 252 HA ILE 33 HA ILE 33 19.545 -10.751 37.322 253 HB ILE 33 HB ILE 33 18.038 -11.920 34.982 254 HG12 ILE 33 HG12 ILE 33 16.914 -9.904 35.755 255 HG13 ILE 33 HG13 ILE 33 16.001 -11.322 36.259 256 HG21 ILE 33 HG21 ILE 33 19.017 -13.088 37.339 257 HG22 ILE 33 HG22 ILE 33 17.278 -12.903 37.565 258 HG23 ILE 33 HG23 ILE 33 17.897 -13.789 36.171 259 HD11 ILE 33 HD11 ILE 33 17.159 -9.222 37.846 260 HD12 ILE 33 HD12 ILE 33 16.002 -10.474 38.300 261 HD13 ILE 33 HD13 ILE 33 17.733 -10.805 38.369 262 H GLY 34 H GLY 34 20.274 -11.205 33.887 263 HA2 GLY 34 HA2 GLY 34 21.653 -13.605 33.994 264 HA3 GLY 34 HA3 GLY 34 21.996 -12.316 32.851 265 H LYS 35 H LYS 35 22.726 -10.407 34.943 266 HA LYS 35 HA LYS 35 25.477 -10.819 35.022 267 HB2 LYS 35 HB2 LYS 35 23.660 -8.832 35.886 268 HB3 LYS 35 HB3 LYS 35 24.664 -9.232 37.274 269 HG2 LYS 35 HG2 LYS 35 26.651 -8.934 35.696 270 HG3 LYS 35 HG3 LYS 35 25.502 -8.156 34.604 271 HD2 LYS 35 HD2 LYS 35 25.965 -7.322 37.466 272 HD3 LYS 35 HD3 LYS 35 26.741 -6.568 36.071 273 HE2 LYS 35 HE2 LYS 35 24.984 -5.176 36.106 274 HE3 LYS 35 3HE LYS 35 24.118 -6.509 35.341 275 HZ1 LYS 35 1HZ LYS 35 24.076 -6.949 38.090 276 HZ2 LYS 35 2HZ LYS 35 22.775 -6.558 37.082 277 HZ3 LYS 35 3HZ LYS 35 23.651 -5.329 37.849 278 H THR 36 H THR 36 22.996 -11.589 37.415 279 HA THR 36 HA THR 36 24.941 -12.611 39.298 280 HB THR 36 HB THR 36 22.325 -13.449 40.020 281 HG1 THR 36 HG1 THR 36 21.364 -11.276 40.025 282 HG21 THR 36 HG21 THR 36 24.217 -12.753 41.497 283 HG22 THR 36 HG22 THR 36 22.672 -12.011 41.913 284 HG23 THR 36 HG23 THR 36 23.892 -11.081 41.041 285 H VAL 37 H VAL 37 22.234 -13.985 37.428 286 HA VAL 37 HA VAL 37 22.539 -16.645 38.095 287 HB VAL 37 HB VAL 37 21.746 -15.537 35.397 288 HG11 VAL 37 HG11 VAL 37 20.452 -17.735 35.308 289 HG12 VAL 37 HG12 VAL 37 22.198 -17.817 35.057 290 HG13 VAL 37 HG13 VAL 37 21.506 -18.273 36.615 291 HG21 VAL 37 HG21 VAL 37 20.015 -16.356 37.727 292 HG22 VAL 37 HG22 VAL 37 20.406 -14.690 37.298 293 HG23 VAL 37 HG23 VAL 37 19.469 -15.690 36.188 294 H LYS 38 H LYS 38 24.011 -14.960 35.319 295 HA LYS 38 HA LYS 38 25.541 -17.157 34.439 296 HB2 LYS 38 HB2 LYS 38 25.011 -15.165 33.054 297 HB3 LYS 38 HB3 LYS 38 26.108 -14.212 34.047 298 HG2 LYS 38 HG2 LYS 38 27.612 -16.406 33.222 299 HG3 LYS 38 HG3 LYS 38 26.677 -15.926 31.803 300 HD2 LYS 38 HD2 LYS 38 27.487 -13.509 32.686 301 HD3 LYS 38 HD3 LYS 38 28.840 -14.508 33.223 302 HE2 LYS 38 HE2 LYS 38 29.650 -14.479 31.156 303 HE3 LYS 38 3HE LYS 38 28.205 -15.318 30.596 304 HZ1 LYS 38 1HZ LYS 38 29.000 -12.760 29.945 305 HZ2 LYS 38 2HZ LYS 38 27.675 -12.559 30.975 306 HZ3 LYS 38 3HZ LYS 38 27.521 -13.491 29.573 307 H SER 39 H SER 39 26.142 -14.638 36.798 308 HA SER 39 HA SER 39 28.920 -15.010 37.086 309 HB2 SER 39 HB2 SER 39 26.762 -13.742 38.697 310 HB3 SER 39 HB3 SER 39 28.270 -14.123 39.526 311 HG SER 39 HG SER 39 29.316 -12.685 38.329 312 H PHE 40 H PHE 40 26.174 -16.750 38.320 313 HA PHE 40 HA PHE 40 27.444 -18.095 40.450 314 HB2 PHE 40 HB2 PHE 40 24.911 -17.913 39.803 315 HB3 PHE 40 HB3 PHE 40 25.240 -19.367 38.868 316 HD1 PHE 40 HD1 PHE 40 24.770 -17.967 42.173 317 HD2 PHE 40 HD2 PHE 40 25.944 -21.437 40.004 318 HE1 PHE 40 HE1 PHE 40 24.480 -19.329 44.201 319 HE2 PHE 40 HE2 PHE 40 25.655 -22.804 42.029 320 HZ PHE 40 HZ PHE 40 24.922 -21.751 44.131 321 H GLN 41 H GLN 41 27.288 -18.700 37.009 322 HA GLN 41 HA GLN 41 28.123 -21.365 36.956 323 HB2 GLN 41 HB2 GLN 41 27.629 -19.330 35.074 324 HB3 GLN 41 HB3 GLN 41 29.268 -19.890 34.763 325 HG2 GLN 41 HG2 GLN 41 27.071 -21.876 35.109 326 HG3 GLN 41 HG3 GLN 41 27.244 -21.014 33.582 327 HE21 GLN 41 HE21 GLN 41 27.816 -23.850 34.797 328 HE22 GLN 41 HE22 GLN 41 29.327 -24.259 34.067 329 H GLN 42 H GLN 42 29.941 -18.387 37.308 330 HA GLN 42 HA GLN 42 32.498 -19.701 37.052 331 HB2 GLN 42 HB2 GLN 42 31.932 -17.263 36.432 332 HB3 GLN 42 HB3 GLN 42 32.064 -16.938 38.154 333 HG2 GLN 42 HG2 GLN 42 34.344 -17.510 38.195 334 HG3 GLN 42 HG3 GLN 42 34.264 -18.259 36.602 335 HE21 GLN 42 HE21 GLN 42 34.976 -15.467 38.326 336 HE22 GLN 42 HE22 GLN 42 35.136 -14.378 36.995 337 H ALA 43 H ALA 43 30.304 -18.826 39.592 338 HA ALA 43 HA ALA 43 32.206 -19.030 41.726 339 HB1 ALA 43 HB1 ALA 43 30.064 -19.148 43.130 340 HB2 ALA 43 HB2 ALA 43 30.373 -17.671 42.215 341 HB3 ALA 43 HB3 ALA 43 29.214 -18.856 41.612 342 H ALA 44 H ALA 44 30.225 -21.247 39.956 343 HA ALA 44 HA ALA 44 29.868 -23.331 41.727 344 HB1 ALA 44 HB1 ALA 44 29.082 -23.106 39.302 345 HB2 ALA 44 HB2 ALA 44 30.636 -23.819 38.869 346 HB3 ALA 44 HB3 ALA 44 29.506 -24.717 39.880 347 H LYS 45 H LYS 45 32.778 -22.306 40.094 348 HA LYS 45 HA LYS 45 34.364 -24.568 40.309 349 HB2 LYS 45 HB2 LYS 45 34.749 -21.800 39.759 350 HB3 LYS 45 HB3 LYS 45 35.966 -22.290 40.930 351 HG2 LYS 45 HG2 LYS 45 36.891 -23.872 39.487 352 HG3 LYS 45 HG3 LYS 45 35.467 -23.885 38.443 353 HD2 LYS 45 HD2 LYS 45 37.083 -22.663 37.251 354 HD3 LYS 45 HD3 LYS 45 36.016 -21.443 37.950 355 HE2 LYS 45 HE2 LYS 45 38.222 -20.672 38.302 356 HE3 LYS 45 3HE LYS 45 37.659 -21.280 39.859 357 HZ1 LYS 45 1HZ LYS 45 39.374 -22.656 39.909 358 HZ2 LYS 45 2HZ LYS 45 39.928 -22.054 38.428 359 HZ3 LYS 45 3HZ LYS 45 38.882 -23.382 38.463 360 H GLU 46 H GLU 46 33.303 -22.360 42.773 361 HA GLU 46 HA GLU 46 35.172 -23.435 44.733 362 HB2 GLU 46 HB2 GLU 46 34.752 -21.033 44.768 363 HB3 GLU 46 HB3 GLU 46 33.031 -21.316 44.978 364 HG2 GLU 46 HG2 GLU 46 33.351 -22.185 47.162 365 HG3 GLU 46 HG3 GLU 46 35.101 -22.237 46.950 366 H PHE 47 H PHE 47 31.870 -23.756 43.740 367 HA PHE 47 HA PHE 47 30.639 -24.731 46.012 368 HB2 PHE 47 HB2 PHE 47 29.842 -24.385 43.466 369 HB3 PHE 47 HB3 PHE 47 30.020 -26.137 43.473 370 HD1 PHE 47 HD1 PHE 47 28.725 -27.486 45.134 371 HD2 PHE 47 HD2 PHE 47 28.007 -23.339 44.497 372 HE1 PHE 47 HE1 PHE 47 26.519 -27.706 46.203 373 HE2 PHE 47 HE2 PHE 47 25.802 -23.553 45.566 374 HZ PHE 47 HZ PHE 47 25.056 -25.738 46.421 375 H GLU 48 H GLU 48 32.959 -26.277 43.924 376 HA GLU 48 HA GLU 48 32.557 -28.952 44.553 377 HB2 GLU 48 HB2 GLU 48 34.791 -29.344 43.807 378 HB3 GLU 48 HB3 GLU 48 34.137 -28.038 42.828 379 HG2 GLU 48 HG2 GLU 48 35.335 -26.410 44.191 380 HG3 GLU 48 HG3 GLU 48 35.984 -27.714 45.182 381 H SER 49 H SER 49 33.900 -26.392 46.459 382 HA SER 49 HA SER 49 35.185 -28.118 48.370 383 HB2 SER 49 HB2 SER 49 34.531 -25.164 48.474 384 HB3 SER 49 HB3 SER 49 35.497 -26.022 49.674 385 HG SER 49 HG SER 49 37.023 -26.457 48.082 386 H GLU 50 H GLU 50 32.047 -26.712 47.939 387 HA GLU 50 HA GLU 50 30.096 -26.908 49.091 388 HB2 GLU 50 HB2 GLU 50 31.632 -29.310 49.849 389 HB3 GLU 50 HB3 GLU 50 30.329 -28.879 50.947 390 HG2 GLU 50 HG2 GLU 50 28.712 -29.018 49.200 391 HG3 GLU 50 HG3 GLU 50 29.972 -29.208 47.980 392 H LEU 51 H LEU 51 30.204 -24.922 50.124 393 HA LEU 51 HA LEU 51 30.175 -24.957 52.940 394 HB2 LEU 51 HB2 LEU 51 32.122 -23.576 53.418 395 HB3 LEU 51 HB3 LEU 51 32.586 -25.125 52.716 396 HG LEU 51 HG LEU 51 32.527 -23.581 50.497 397 HD11 LEU 51 HD11 LEU 51 32.962 -21.402 50.835 398 HD12 LEU 51 HD12 LEU 51 33.923 -21.706 52.281 399 HD13 LEU 51 HD13 LEU 51 32.163 -21.682 52.381 400 HD21 LEU 51 HD21 LEU 51 34.329 -25.087 51.309 401 HD22 LEU 51 HD22 LEU 51 34.883 -23.791 52.368 402 HD23 LEU 51 HD23 LEU 51 34.926 -23.578 50.618 403 H LYS 52 H LYS 52 30.587 -23.063 50.004 404 HA LYS 52 HA LYS 52 29.773 -21.039 49.345 405 HB2 LYS 52 HB2 LYS 52 27.579 -22.101 51.107 406 HB3 LYS 52 HB3 LYS 52 27.426 -20.538 50.313 407 HG2 LYS 52 HG2 LYS 52 27.545 -21.530 48.156 408 HG3 LYS 52 HG3 LYS 52 28.004 -23.093 48.835 409 HD2 LYS 52 HD2 LYS 52 25.856 -23.653 48.941 410 HD3 LYS 52 HD3 LYS 52 25.580 -22.324 50.070 411 HE2 LYS 52 HE2 LYS 52 25.104 -20.816 48.263 412 HE3 LYS 52 3HE LYS 52 25.564 -22.030 47.070 413 HZ1 LYS 52 1HZ LYS 52 23.427 -22.697 48.955 414 HZ2 LYS 52 2HZ LYS 52 23.631 -23.170 47.344 415 HZ3 LYS 52 3HZ LYS 52 23.067 -21.616 47.705 416 H THR 53 H THR 53 31.472 -19.856 50.355 417 HA THR 53 HA THR 53 32.438 -18.449 51.904 418 HB THR 53 HB THR 53 30.887 -17.018 50.563 419 HG1 THR 53 HG1 THR 53 31.490 -15.365 51.775 420 HG21 THR 53 HG21 THR 53 28.756 -17.919 51.280 421 HG22 THR 53 HG22 THR 53 28.834 -16.205 51.687 422 HG23 THR 53 HG23 THR 53 29.071 -17.420 52.942 Start of MODEL 9 1 H1 ALA 1 H ALA 1 -9.318 -11.843 -6.834 2 HA ALA 1 HA ALA 1 -8.349 -10.373 -8.984 3 HB1 ALA 1 HB1 ALA 1 -10.105 -9.282 -8.069 4 HB2 ALA 1 HB2 ALA 1 -9.665 -9.726 -6.419 5 HB3 ALA 1 HB3 ALA 1 -8.825 -8.405 -7.231 6 H LEU 2 H LEU 2 -7.041 -8.264 -8.651 7 HA LEU 2 HA LEU 2 -4.638 -8.874 -7.059 8 HB2 LEU 2 HB2 LEU 2 -4.549 -9.064 -9.652 9 HB3 LEU 2 HB3 LEU 2 -4.512 -7.303 -9.601 10 HG LEU 2 HG LEU 2 -2.515 -7.888 -7.873 11 HD11 LEU 2 HD11 LEU 2 -1.244 -9.729 -8.565 12 HD12 LEU 2 HD12 LEU 2 -2.199 -9.949 -10.032 13 HD13 LEU 2 HD13 LEU 2 -2.896 -10.340 -8.460 14 HD21 LEU 2 HD21 LEU 2 -1.145 -7.796 -10.203 15 HD22 LEU 2 HD22 LEU 2 -1.841 -6.386 -9.405 16 HD23 LEU 2 HD23 LEU 2 -2.715 -7.177 -10.719 17 H PHE 3 H PHE 3 -4.268 -7.418 -5.535 18 HA PHE 3 HA PHE 3 -5.548 -4.804 -5.696 19 HB2 PHE 3 HB2 PHE 3 -4.305 -6.416 -3.501 20 HB3 PHE 3 HB3 PHE 3 -4.464 -4.673 -3.305 21 HD1 PHE 3 HD1 PHE 3 -6.069 -7.808 -2.968 22 HD2 PHE 3 HD2 PHE 3 -6.814 -3.679 -3.683 23 HE1 PHE 3 HE1 PHE 3 -8.404 -8.110 -2.254 24 HE2 PHE 3 HE2 PHE 3 -9.150 -3.974 -2.969 25 HZ PHE 3 HZ PHE 3 -9.948 -6.191 -2.252 26 H GLY 4 H GLY 4 -2.413 -6.267 -5.929 27 HA2 GLY 4 HA2 GLY 4 -0.720 -5.011 -7.158 28 HA3 GLY 4 HA3 GLY 4 -1.248 -3.578 -6.289 29 H LEU 5 H LEU 5 -1.015 -6.528 -4.524 30 HA LEU 5 HA LEU 5 1.648 -5.829 -3.525 31 HB2 LEU 5 HB2 LEU 5 -0.806 -6.236 -1.829 32 HB3 LEU 5 HB3 LEU 5 0.838 -6.224 -1.196 33 HG LEU 5 HG LEU 5 -0.503 -3.898 -2.572 34 HD11 LEU 5 HD11 LEU 5 -0.315 -4.733 0.274 35 HD12 LEU 5 HD12 LEU 5 -1.625 -3.924 -0.585 36 HD13 LEU 5 HD13 LEU 5 -0.191 -3.016 -0.109 37 HD21 LEU 5 HD21 LEU 5 2.232 -4.475 -1.916 38 HD22 LEU 5 HD22 LEU 5 1.664 -3.081 -0.996 39 HD23 LEU 5 HD23 LEU 5 1.552 -3.082 -2.756 40 H GLY 6 H GLY 6 2.410 -7.597 -1.933 41 HA2 GLY 6 HA2 GLY 6 1.623 -10.077 -1.523 42 HA3 GLY 6 HA3 GLY 6 1.917 -10.160 -3.254 43 H VAL 7 H VAL 7 4.131 -9.425 -3.958 44 HA VAL 7 HA VAL 7 6.088 -10.912 -2.528 45 HB VAL 7 HB VAL 7 7.056 -10.904 -4.525 46 HG11 VAL 7 HG11 VAL 7 6.104 -9.702 -6.416 47 HG12 VAL 7 HG12 VAL 7 4.828 -10.403 -5.417 48 HG13 VAL 7 HG13 VAL 7 5.181 -8.678 -5.316 49 HG21 VAL 7 HG21 VAL 7 8.277 -8.974 -5.315 50 HG22 VAL 7 HG22 VAL 7 7.319 -7.908 -4.286 51 HG23 VAL 7 HG23 VAL 7 8.419 -9.080 -3.560 52 HA PRO 8 HA PRO 8 7.754 -6.443 -1.544 53 HB2 PRO 8 HB2 PRO 8 5.858 -4.499 -1.493 54 HB3 PRO 8 HB3 PRO 8 6.792 -4.893 -2.942 55 HG2 PRO 8 HG2 PRO 8 4.021 -5.738 -2.187 56 HG3 PRO 8 HG3 PRO 8 4.635 -5.190 -3.757 57 HD2 PRO 8 HD2 PRO 8 4.250 -7.806 -3.177 58 HD3 PRO 8 HD3 PRO 8 5.537 -7.249 -4.266 59 H GLU 9 H GLU 9 4.489 -7.372 -0.577 60 HA GLU 9 HA GLU 9 4.577 -6.169 1.994 61 HB2 GLU 9 HB2 GLU 9 2.592 -7.213 0.511 62 HB3 GLU 9 HB3 GLU 9 2.889 -8.573 1.585 63 HG2 GLU 9 HG2 GLU 9 2.416 -7.263 3.509 64 HG3 GLU 9 HG3 GLU 9 2.383 -5.777 2.562 65 H LEU 10 H LEU 10 5.748 -9.160 0.698 66 HA LEU 10 HA LEU 10 6.062 -10.447 3.258 67 HB2 LEU 10 HB2 LEU 10 6.126 -11.230 0.545 68 HB3 LEU 10 HB3 LEU 10 7.704 -11.613 1.229 69 HG LEU 10 HG LEU 10 6.163 -12.679 3.132 70 HD11 LEU 10 HD11 LEU 10 4.035 -12.173 2.259 71 HD12 LEU 10 HD12 LEU 10 4.296 -13.881 1.912 72 HD13 LEU 10 HD13 LEU 10 4.492 -12.682 0.633 73 HD21 LEU 10 HD21 LEU 10 6.761 -14.744 2.279 74 HD22 LEU 10 HD22 LEU 10 7.933 -13.671 1.514 75 HD23 LEU 10 HD23 LEU 10 6.531 -14.238 0.606 76 H ALA 11 H ALA 11 7.934 -8.383 1.204 77 HA ALA 11 HA ALA 11 10.441 -8.985 2.530 78 HB1 ALA 11 HB1 ALA 11 11.137 -6.909 1.086 79 HB2 ALA 11 HB2 ALA 11 10.861 -8.479 0.331 80 HB3 ALA 11 HB3 ALA 11 9.611 -7.237 0.263 81 H VAL 12 H VAL 12 7.849 -6.704 2.787 82 HA VAL 12 HA VAL 12 9.391 -4.875 4.445 83 HB VAL 12 HB VAL 12 7.710 -4.018 2.814 84 HG11 VAL 12 HG11 VAL 12 5.618 -4.977 4.748 85 HG12 VAL 12 HG12 VAL 12 5.393 -4.280 3.142 86 HG13 VAL 12 HG13 VAL 12 6.074 -5.898 3.315 87 HG21 VAL 12 HG21 VAL 12 8.469 -2.833 4.945 88 HG22 VAL 12 HG22 VAL 12 6.988 -2.253 4.183 89 HG23 VAL 12 HG23 VAL 12 6.900 -3.283 5.613 90 H ILE 13 H ILE 13 7.071 -7.446 4.768 91 HA ILE 13 HA ILE 13 6.050 -6.955 7.306 92 HB ILE 13 HB ILE 13 5.289 -8.772 5.778 93 HG12 ILE 13 HG12 ILE 13 5.902 -10.226 8.275 94 HG13 ILE 13 HG13 ILE 13 5.167 -8.642 8.491 95 HG21 ILE 13 HG21 ILE 13 7.903 -9.519 5.709 96 HG22 ILE 13 HG22 ILE 13 7.227 -10.703 6.828 97 HG23 ILE 13 HG23 ILE 13 6.553 -10.535 5.207 98 HD11 ILE 13 HD11 ILE 13 3.799 -10.152 6.454 99 HD12 ILE 13 HD12 ILE 13 3.869 -11.037 7.979 100 HD13 ILE 13 HD13 ILE 13 3.172 -9.418 7.931 101 H ALA 14 H ALA 14 9.206 -8.006 6.343 102 HA ALA 14 HA ALA 14 10.146 -9.315 8.581 103 HB1 ALA 14 HB1 ALA 14 12.281 -8.931 7.789 104 HB2 ALA 14 HB2 ALA 14 11.307 -8.743 6.330 105 HB3 ALA 14 HB3 ALA 14 11.884 -7.318 7.195 106 H GLY 15 H GLY 15 10.246 -5.802 7.959 107 HA2 GLY 15 HA2 GLY 15 11.358 -5.095 10.449 108 HA3 GLY 15 HA3 GLY 15 10.458 -4.019 9.390 109 H VAL 16 H VAL 16 8.137 -5.973 9.565 110 HA VAL 16 HA VAL 16 6.878 -4.705 11.824 111 HB VAL 16 HB VAL 16 5.739 -6.875 10.061 112 HG11 VAL 16 HG11 VAL 16 3.581 -5.804 10.718 113 HG12 VAL 16 HG12 VAL 16 4.446 -6.569 12.051 114 HG13 VAL 16 HG13 VAL 16 4.482 -4.816 11.867 115 HG21 VAL 16 HG21 VAL 16 4.615 -4.693 9.057 116 HG22 VAL 16 HG22 VAL 16 6.130 -3.967 9.596 117 HG23 VAL 16 HG23 VAL 16 6.154 -5.310 8.453 118 H ALA 17 H ALA 17 7.310 -8.121 10.875 119 HA ALA 17 HA ALA 17 6.541 -9.187 13.363 120 HB1 ALA 17 HB1 ALA 17 8.387 -10.935 12.063 121 HB2 ALA 17 HB2 ALA 17 6.635 -11.076 12.204 122 HB3 ALA 17 HB3 ALA 17 7.342 -10.190 10.853 123 H ALA 18 H ALA 18 9.570 -7.941 12.186 124 HA ALA 18 HA ALA 18 11.354 -9.136 13.968 125 HB1 ALA 18 HB1 ALA 18 12.123 -7.871 12.057 126 HB2 ALA 18 HB2 ALA 18 11.458 -6.385 12.738 127 HB3 ALA 18 HB3 ALA 18 12.809 -7.194 13.534 128 H LEU 19 H LEU 19 8.998 -6.650 14.467 129 HA LEU 19 HA LEU 19 10.147 -5.624 16.888 130 HB2 LEU 19 HB2 LEU 19 7.666 -5.200 15.331 131 HB3 LEU 19 HB3 LEU 19 7.599 -4.823 17.051 132 HG LEU 19 HG LEU 19 9.785 -3.671 15.369 133 HD11 LEU 19 HD11 LEU 19 6.901 -2.975 15.273 134 HD12 LEU 19 HD12 LEU 19 8.130 -2.890 14.012 135 HD13 LEU 19 HD13 LEU 19 8.076 -1.659 15.273 136 HD21 LEU 19 HD21 LEU 19 8.257 -2.605 17.739 137 HD22 LEU 19 HD22 LEU 19 9.697 -1.903 17.004 138 HD23 LEU 19 HD23 LEU 19 9.799 -3.456 17.835 139 H LEU 20 H LEU 20 7.570 -7.906 16.073 140 HA LEU 20 HA LEU 20 6.678 -8.354 18.713 141 HB2 LEU 20 HB2 LEU 20 6.558 -10.161 16.303 142 HB3 LEU 20 HB3 LEU 20 5.656 -10.400 17.798 143 HG LEU 20 HG LEU 20 5.305 -8.173 15.795 144 HD11 LEU 20 HD11 LEU 20 3.674 -9.399 14.923 145 HD12 LEU 20 HD12 LEU 20 2.966 -9.693 16.511 146 HD13 LEU 20 HD13 LEU 20 4.242 -10.749 15.906 147 HD21 LEU 20 HD21 LEU 20 5.028 -7.257 18.009 148 HD22 LEU 20 HD22 LEU 20 3.985 -8.602 18.473 149 HD23 LEU 20 HD23 LEU 20 3.444 -7.447 17.254 150 H PHE 21 H PHE 21 8.689 -10.448 16.635 151 HA PHE 21 HA PHE 21 9.448 -12.153 18.777 152 HB2 PHE 21 HB2 PHE 21 9.830 -12.040 15.930 153 HB3 PHE 21 HB3 PHE 21 11.373 -12.359 16.716 154 HD1 PHE 21 HD1 PHE 21 7.954 -13.592 16.196 155 HD2 PHE 21 HD2 PHE 21 11.796 -14.430 17.822 156 HE1 PHE 21 HE1 PHE 21 7.323 -15.955 16.460 157 HE2 PHE 21 HE2 PHE 21 11.173 -16.794 18.087 158 HZ PHE 21 HZ PHE 21 8.934 -17.560 17.405 159 H GLY 22 H GLY 22 10.905 -9.338 17.249 160 HA2 GLY 22 HA2 GLY 22 13.112 -9.491 19.207 161 HA3 GLY 22 HA3 GLY 22 13.239 -8.717 17.634 162 HA PRO 23 HA PRO 23 10.530 -5.848 20.463 163 HB2 PRO 23 HB2 PRO 23 10.668 -6.368 23.124 164 HB3 PRO 23 HB3 PRO 23 9.440 -7.077 22.070 165 HG2 PRO 23 HG2 PRO 23 11.994 -8.274 23.074 166 HG3 PRO 23 HG3 PRO 23 10.387 -9.012 22.948 167 HD2 PRO 23 HD2 PRO 23 12.343 -9.463 21.131 168 HD3 PRO 23 HD3 PRO 23 10.622 -9.442 20.695 169 H LYS 24 H LYS 24 13.669 -7.075 21.175 170 HA LYS 24 HA LYS 24 14.538 -4.370 21.940 171 HB2 LYS 24 HB2 LYS 24 16.227 -5.407 23.437 172 HB3 LYS 24 HB3 LYS 24 14.571 -5.697 23.956 173 HG2 LYS 24 HG2 LYS 24 14.944 -7.874 23.969 174 HG3 LYS 24 HG3 LYS 24 15.350 -7.830 22.253 175 HD2 LYS 24 HD2 LYS 24 17.581 -7.853 22.644 176 HD3 LYS 24 HD3 LYS 24 17.441 -6.879 24.111 177 HE2 LYS 24 HE2 LYS 24 16.321 -9.021 25.087 178 HE3 LYS 24 3HE LYS 24 17.137 -9.833 23.752 179 HZ1 LYS 24 1HZ LYS 24 19.190 -8.559 24.636 180 HZ2 LYS 24 2HZ LYS 24 18.686 -9.967 25.425 181 HZ3 LYS 24 3HZ LYS 24 18.303 -8.452 26.072 182 H LYS 25 H LYS 25 14.509 -5.871 19.373 183 HA LYS 25 HA LYS 25 17.353 -6.286 18.859 184 HB2 LYS 25 HB2 LYS 25 15.619 -7.900 18.020 185 HB3 LYS 25 HB3 LYS 25 15.032 -6.628 16.956 186 HG2 LYS 25 HG2 LYS 25 16.578 -7.109 15.446 187 HG3 LYS 25 HG3 LYS 25 17.865 -6.929 16.641 188 HD2 LYS 25 HD2 LYS 25 17.963 -9.164 17.070 189 HD3 LYS 25 HD3 LYS 25 16.247 -9.414 16.744 190 HE2 LYS 25 HE2 LYS 25 17.789 -8.582 14.403 191 HE3 LYS 25 3HE LYS 25 18.307 -10.124 15.083 192 HZ1 LYS 25 1HZ LYS 25 16.624 -11.013 13.969 193 HZ2 LYS 25 2HZ LYS 25 15.955 -9.505 13.595 194 HZ3 LYS 25 3HZ LYS 25 15.576 -10.258 15.062 195 H LEU 26 H LEU 26 14.806 -4.008 18.262 196 HA LEU 26 HA LEU 26 16.062 -2.620 16.116 197 HB2 LEU 26 HB2 LEU 26 13.700 -2.279 17.818 198 HB3 LEU 26 HB3 LEU 26 14.429 -0.768 17.275 199 HG LEU 26 HG LEU 26 13.434 -2.993 15.494 200 HD11 LEU 26 HD11 LEU 26 12.179 -0.618 16.649 201 HD12 LEU 26 HD12 LEU 26 11.451 -2.057 15.936 202 HD13 LEU 26 HD13 LEU 26 12.010 -0.745 14.898 203 HD21 LEU 26 HD21 LEU 26 15.014 -0.536 15.002 204 HD22 LEU 26 HD22 LEU 26 13.730 -0.915 13.854 205 HD23 LEU 26 HD23 LEU 26 15.021 -2.081 14.151 206 HA PRO 27 HA PRO 27 17.375 0.548 19.513 207 HB2 PRO 27 HB2 PRO 27 17.008 -0.171 22.105 208 HB3 PRO 27 HB3 PRO 27 15.780 0.681 21.161 209 HG2 PRO 27 HG2 PRO 27 15.999 -2.238 21.790 210 HG3 PRO 27 HG3 PRO 27 14.566 -1.194 21.809 211 HD2 PRO 27 HD2 PRO 27 15.122 -2.868 19.754 212 HD3 PRO 27 HD3 PRO 27 14.292 -1.315 19.524 213 H GLU 28 H GLU 28 17.980 -2.766 19.455 214 HA GLU 28 HA GLU 28 20.017 -3.188 21.268 215 HB2 GLU 28 HB2 GLU 28 20.551 -5.087 20.062 216 HB3 GLU 28 HB3 GLU 28 18.904 -4.785 19.528 217 HG2 GLU 28 HG2 GLU 28 19.843 -3.605 17.543 218 HG3 GLU 28 HG3 GLU 28 21.443 -4.137 18.056 219 H ILE 29 H ILE 29 20.073 -1.403 18.275 220 HA ILE 29 HA ILE 29 22.906 -1.265 18.016 221 HB ILE 29 HB ILE 29 22.483 0.553 16.411 222 HG12 ILE 29 HG12 ILE 29 19.784 0.642 16.004 223 HG13 ILE 29 HG13 ILE 29 19.863 0.532 17.759 224 HG21 ILE 29 HG21 ILE 29 22.123 -1.996 15.980 225 HG22 ILE 29 HG22 ILE 29 20.431 -1.529 15.816 226 HG23 ILE 29 HG23 ILE 29 21.649 -0.816 14.758 227 HD11 ILE 29 HD11 ILE 29 20.293 2.787 16.077 228 HD12 ILE 29 HD12 ILE 29 20.254 2.702 17.839 229 HD13 ILE 29 HD13 ILE 29 21.771 2.446 16.977 230 H GLY 30 H GLY 30 20.472 0.720 19.601 231 HA2 GLY 30 HA2 GLY 30 22.127 2.953 20.140 232 HA3 GLY 30 HA3 GLY 30 20.647 2.539 20.994 233 H LYS 31 H LYS 31 21.833 -0.151 21.654 234 HA LYS 31 HA LYS 31 23.189 0.724 24.074 235 HB2 LYS 31 HB2 LYS 31 21.816 -1.758 23.176 236 HB3 LYS 31 HB3 LYS 31 23.083 -1.930 24.384 237 HG2 LYS 31 HG2 LYS 31 21.147 0.202 24.936 238 HG3 LYS 31 HG3 LYS 31 20.478 -1.431 24.932 239 HD2 LYS 31 HD2 LYS 31 21.552 -2.006 26.824 240 HD3 LYS 31 HD3 LYS 31 23.030 -1.163 26.355 241 HE2 LYS 31 HE2 LYS 31 22.356 0.096 28.154 242 HE3 LYS 31 3HE LYS 31 21.605 0.978 26.825 243 HZ1 LYS 31 1HZ LYS 31 19.530 0.271 27.403 244 HZ2 LYS 31 2HZ LYS 31 20.241 0.324 28.936 245 HZ3 LYS 31 3HZ LYS 31 20.077 -1.155 28.132 246 H SER 32 H SER 32 23.896 -0.847 21.061 247 HA SER 32 HA SER 32 26.265 -2.173 21.702 248 HB2 SER 32 HB2 SER 32 25.651 -0.778 19.089 249 HB3 SER 32 HB3 SER 32 26.770 -2.118 19.334 250 HG SER 32 HG SER 32 25.121 -3.353 18.974 251 H ILE 33 H ILE 33 25.613 1.208 21.190 252 HA ILE 33 HA ILE 33 28.164 2.173 20.647 253 HB ILE 33 HB ILE 33 27.430 4.312 21.483 254 HG12 ILE 33 HG12 ILE 33 24.907 4.135 22.446 255 HG13 ILE 33 HG13 ILE 33 25.575 2.626 23.058 256 HG21 ILE 33 HG21 ILE 33 26.531 3.606 19.341 257 HG22 ILE 33 HG22 ILE 33 25.174 2.821 20.149 258 HG23 ILE 33 HG23 ILE 33 25.344 4.576 20.214 259 HD11 ILE 33 HD11 ILE 33 27.352 4.869 23.501 260 HD12 ILE 33 HD12 ILE 33 25.768 5.099 24.243 261 HD13 ILE 33 HD13 ILE 33 26.728 3.673 24.636 262 H GLY 34 H GLY 34 26.802 0.980 23.613 263 HA2 GLY 34 HA2 GLY 34 28.391 2.158 25.540 264 HA3 GLY 34 HA3 GLY 34 27.782 0.513 25.638 265 H LYS 35 H LYS 35 29.114 -0.830 23.738 266 HA LYS 35 HA LYS 35 31.591 -1.361 24.886 267 HB2 LYS 35 HB2 LYS 35 30.376 -2.939 23.437 268 HB3 LYS 35 HB3 LYS 35 30.708 -1.916 22.046 269 HG2 LYS 35 HG2 LYS 35 33.143 -2.273 22.462 270 HG3 LYS 35 HG3 LYS 35 32.699 -3.446 23.703 271 HD2 LYS 35 HD2 LYS 35 31.317 -3.911 21.188 272 HD3 LYS 35 HD3 LYS 35 33.072 -3.965 21.011 273 HE2 LYS 35 HE2 LYS 35 31.644 -5.452 23.196 274 HE3 LYS 35 3HE LYS 35 31.872 -6.146 21.591 275 HZ1 LYS 35 1HZ LYS 35 34.080 -5.160 23.314 276 HZ2 LYS 35 2HZ LYS 35 34.232 -5.982 21.843 277 HZ3 LYS 35 3HZ LYS 35 33.613 -6.782 23.199 278 H THR 36 H THR 36 30.677 1.075 22.635 279 HA THR 36 HA THR 36 33.411 1.583 21.777 280 HB THR 36 HB THR 36 30.936 3.193 21.134 281 HG1 THR 36 HG1 THR 36 30.467 1.714 19.694 282 HG21 THR 36 HG21 THR 36 33.032 3.101 19.140 283 HG22 THR 36 HG22 THR 36 33.634 3.719 20.679 284 HG23 THR 36 HG23 THR 36 32.260 4.495 19.894 285 H VAL 37 H VAL 37 30.827 3.619 23.166 286 HA VAL 37 HA VAL 37 32.417 5.749 23.940 287 HB VAL 37 HB VAL 37 29.989 5.884 23.975 288 HG11 VAL 37 HG11 VAL 37 29.805 3.497 24.950 289 HG12 VAL 37 HG12 VAL 37 29.913 4.302 26.516 290 HG13 VAL 37 HG13 VAL 37 28.598 4.699 25.408 291 HG21 VAL 37 HG21 VAL 37 29.953 7.455 25.586 292 HG22 VAL 37 HG22 VAL 37 30.511 6.339 26.833 293 HG23 VAL 37 HG23 VAL 37 31.671 7.079 25.729 294 H LYS 38 H LYS 38 31.689 2.760 25.672 295 HA LYS 38 HA LYS 38 32.985 3.522 28.091 296 HB2 LYS 38 HB2 LYS 38 31.264 1.774 28.027 297 HB3 LYS 38 HB3 LYS 38 32.308 0.773 27.029 298 HG2 LYS 38 HG2 LYS 38 33.551 0.095 28.775 299 HG3 LYS 38 HG3 LYS 38 33.477 1.667 29.574 300 HD2 LYS 38 HD2 LYS 38 31.125 -0.208 29.438 301 HD3 LYS 38 HD3 LYS 38 32.305 -0.246 30.750 302 HE2 LYS 38 HE2 LYS 38 31.649 1.800 31.578 303 HE3 LYS 38 3HE LYS 38 31.025 2.348 30.022 304 HZ1 LYS 38 1HZ LYS 38 29.668 1.008 32.142 305 HZ2 LYS 38 2HZ LYS 38 29.473 0.190 30.675 306 HZ3 LYS 38 3HZ LYS 38 29.029 1.818 30.801 307 H SER 39 H SER 39 33.997 1.860 25.166 308 HA SER 39 HA SER 39 36.518 0.997 26.167 309 HB2 SER 39 HB2 SER 39 35.617 -0.158 24.273 310 HB3 SER 39 HB3 SER 39 35.454 1.341 23.359 311 HG SER 39 HG SER 39 37.411 -0.217 23.120 312 H PHE 40 H PHE 40 35.359 3.903 24.599 313 HA PHE 40 HA PHE 40 37.981 4.974 24.113 314 HB2 PHE 40 HB2 PHE 40 35.576 5.502 23.024 315 HB3 PHE 40 HB3 PHE 40 35.642 6.795 24.217 316 HD1 PHE 40 HD1 PHE 40 36.717 8.769 23.696 317 HD2 PHE 40 HD2 PHE 40 37.662 5.247 21.501 318 HE1 PHE 40 HE1 PHE 40 38.127 10.097 22.179 319 HE2 PHE 40 HE2 PHE 40 39.074 6.569 19.982 320 HZ PHE 40 HZ PHE 40 39.310 8.997 20.320 321 H GLN 41 H GLN 41 35.681 5.030 26.705 322 HA GLN 41 HA GLN 41 36.416 7.339 28.064 323 HB2 GLN 41 HB2 GLN 41 35.004 4.873 28.682 324 HB3 GLN 41 HB3 GLN 41 35.911 5.472 30.065 325 HG2 GLN 41 HG2 GLN 41 34.095 7.257 28.487 326 HG3 GLN 41 HG3 GLN 41 33.493 6.236 29.791 327 HE21 GLN 41 HE21 GLN 41 32.876 8.319 30.715 328 HE22 GLN 41 HE22 GLN 41 34.041 9.196 31.640 329 H GLN 42 H GLN 42 37.959 4.186 27.963 330 HA GLN 42 HA GLN 42 39.708 4.423 30.107 331 HB2 GLN 42 HB2 GLN 42 40.149 3.061 27.446 332 HB3 GLN 42 HB3 GLN 42 41.153 2.824 28.871 333 HG2 GLN 42 HG2 GLN 42 38.545 2.363 29.735 334 HG3 GLN 42 HG3 GLN 42 38.657 1.586 28.157 335 HE21 GLN 42 HE21 GLN 42 40.044 1.744 31.369 336 HE22 GLN 42 HE22 GLN 42 40.776 0.180 31.337 337 H ALA 43 H ALA 43 39.888 5.782 26.883 338 HA ALA 43 HA ALA 43 42.554 6.858 27.404 339 HB1 ALA 43 HB1 ALA 43 41.128 6.073 25.061 340 HB2 ALA 43 HB2 ALA 43 41.592 7.769 24.914 341 HB3 ALA 43 HB3 ALA 43 42.819 6.542 25.226 342 H ALA 44 H ALA 44 39.229 7.817 27.306 343 HA ALA 44 HA ALA 44 39.441 10.554 26.845 344 HB1 ALA 44 HB1 ALA 44 37.498 9.010 28.551 345 HB2 ALA 44 HB2 ALA 44 37.327 10.725 28.175 346 HB3 ALA 44 HB3 ALA 44 37.290 9.530 26.879 347 H LYS 45 H LYS 45 40.318 8.681 29.620 348 HA LYS 45 HA LYS 45 40.205 10.524 31.674 349 HB2 LYS 45 HB2 LYS 45 40.865 8.103 31.849 350 HB3 LYS 45 HB3 LYS 45 42.455 8.553 31.249 351 HG2 LYS 45 HG2 LYS 45 41.681 10.216 33.473 352 HG3 LYS 45 HG3 LYS 45 41.606 8.504 33.895 353 HD2 LYS 45 HD2 LYS 45 43.982 9.801 32.568 354 HD3 LYS 45 HD3 LYS 45 43.822 9.601 34.314 355 HE2 LYS 45 HE2 LYS 45 43.495 7.241 32.513 356 HE3 LYS 45 3HE LYS 45 45.113 7.827 32.898 357 HZ1 LYS 45 1HZ LYS 45 44.742 7.459 35.193 358 HZ2 LYS 45 2HZ LYS 45 44.246 6.052 34.397 359 HZ3 LYS 45 3HZ LYS 45 43.093 7.153 34.963 360 H GLU 46 H GLU 46 42.449 10.321 29.010 361 HA GLU 46 HA GLU 46 44.258 12.275 30.144 362 HB2 GLU 46 HB2 GLU 46 44.176 11.058 27.377 363 HB3 GLU 46 HB3 GLU 46 45.473 12.058 28.016 364 HG2 GLU 46 HG2 GLU 46 46.163 10.412 29.521 365 HG3 GLU 46 HG3 GLU 46 44.657 9.509 29.360 366 H PHE 47 H PHE 47 41.606 12.172 27.877 367 HA PHE 47 HA PHE 47 42.054 14.747 26.740 368 HB2 PHE 47 HB2 PHE 47 40.082 12.617 26.504 369 HB3 PHE 47 HB3 PHE 47 39.341 14.214 26.456 370 HD1 PHE 47 HD1 PHE 47 40.059 15.850 24.730 371 HD2 PHE 47 HD2 PHE 47 41.341 11.791 24.688 372 HE1 PHE 47 HE1 PHE 47 40.710 16.083 22.368 373 HE2 PHE 47 HE2 PHE 47 41.995 12.018 22.327 374 HZ PHE 47 HZ PHE 47 41.681 14.166 21.164 375 H GLU 48 H GLU 48 40.452 13.573 29.590 376 HA GLU 48 HA GLU 48 38.715 15.670 30.150 377 HB2 GLU 48 HB2 GLU 48 38.984 13.460 31.391 378 HB3 GLU 48 HB3 GLU 48 40.320 14.218 32.248 379 HG2 GLU 48 HG2 GLU 48 38.246 14.293 33.531 380 HG3 GLU 48 HG3 GLU 48 38.837 15.907 33.137 381 H SER 49 H SER 49 42.172 15.520 30.332 382 HA SER 49 HA SER 49 42.530 17.746 32.081 383 HB2 SER 49 HB2 SER 49 44.194 15.820 31.348 384 HB3 SER 49 HB3 SER 49 44.625 16.978 30.091 385 HG SER 49 HG SER 49 44.570 17.612 32.853 386 H GLU 50 H GLU 50 41.989 17.370 28.677 387 HA GLU 50 HA GLU 50 42.933 19.964 27.919 388 HB2 GLU 50 HB2 GLU 50 41.411 17.772 26.570 389 HB3 GLU 50 HB3 GLU 50 41.422 19.374 25.843 390 HG2 GLU 50 HG2 GLU 50 43.881 19.320 25.817 391 HG3 GLU 50 HG3 GLU 50 43.832 17.686 26.476 392 H LEU 51 H LEU 51 39.841 18.583 28.849 393 HA LEU 51 HA LEU 51 37.828 19.513 29.351 394 HB2 LEU 51 HB2 LEU 51 39.585 20.960 30.680 395 HB3 LEU 51 HB3 LEU 51 39.058 22.217 29.563 396 HG LEU 51 HG LEU 51 36.702 21.766 30.361 397 HD11 LEU 51 HD11 LEU 51 37.286 20.793 32.922 398 HD12 LEU 51 HD12 LEU 51 38.086 19.701 31.793 399 HD13 LEU 51 HD13 LEU 51 36.354 19.999 31.653 400 HD21 LEU 51 HD21 LEU 51 38.262 22.626 32.725 401 HD22 LEU 51 HD22 LEU 51 36.906 23.408 31.912 402 HD23 LEU 51 HD23 LEU 51 38.528 23.512 31.224 403 H LYS 52 H LYS 52 38.634 19.399 26.595 404 HA LYS 52 HA LYS 52 38.119 21.706 25.127 405 HB2 LYS 52 HB2 LYS 52 38.204 18.827 24.608 406 HB3 LYS 52 HB3 LYS 52 37.085 19.685 23.556 407 HG2 LYS 52 HG2 LYS 52 39.436 21.221 23.630 408 HG3 LYS 52 HG3 LYS 52 39.935 19.541 23.431 409 HD2 LYS 52 HD2 LYS 52 39.579 20.022 21.244 410 HD3 LYS 52 HD3 LYS 52 37.918 19.603 21.671 411 HE2 LYS 52 HE2 LYS 52 37.298 21.626 20.995 412 HE3 LYS 52 3HE LYS 52 38.219 22.308 22.334 413 HZ1 LYS 52 1HZ LYS 52 39.290 21.742 19.622 414 HZ2 LYS 52 2HZ LYS 52 40.158 22.419 20.906 415 HZ3 LYS 52 3HZ LYS 52 38.872 23.270 20.213 416 H THR 53 H THR 53 35.829 19.082 25.905 417 HA THR 53 HA THR 53 33.619 20.928 25.328 418 HB THR 53 HB THR 53 33.527 18.821 24.100 419 HG1 THR 53 HG1 THR 53 31.580 19.873 25.169 420 HG21 THR 53 HG21 THR 53 33.225 16.690 25.263 421 HG22 THR 53 HG22 THR 53 33.424 17.503 26.816 422 HG23 THR 53 HG23 THR 53 34.772 17.423 25.682 Start of MODEL 10 1 H1 ALA 1 H ALA 1 7.251 -24.660 -4.829 2 HA ALA 1 HA ALA 1 8.428 -24.919 -2.605 3 HB1 ALA 1 HB1 ALA 1 10.631 -25.213 -3.019 4 HB2 ALA 1 HB2 ALA 1 10.611 -24.189 -4.455 5 HB3 ALA 1 HB3 ALA 1 10.662 -23.457 -2.851 6 H LEU 2 H LEU 2 7.987 -22.500 -5.050 7 HA LEU 2 HA LEU 2 7.403 -20.514 -2.952 8 HB2 LEU 2 HB2 LEU 2 7.867 -18.799 -4.708 9 HB3 LEU 2 HB3 LEU 2 9.268 -19.734 -4.187 10 HG LEU 2 HG LEU 2 7.843 -20.687 -6.604 11 HD11 LEU 2 HD11 LEU 2 7.820 -18.352 -7.088 12 HD12 LEU 2 HD12 LEU 2 9.146 -19.075 -7.998 13 HD13 LEU 2 HD13 LEU 2 9.482 -18.161 -6.527 14 HD21 LEU 2 HD21 LEU 2 10.770 -20.280 -6.453 15 HD22 LEU 2 HD22 LEU 2 9.841 -21.634 -7.099 16 HD23 LEU 2 HD23 LEU 2 10.073 -21.471 -5.357 17 H PHE 3 H PHE 3 5.440 -19.561 -2.949 18 HA PHE 3 HA PHE 3 3.499 -20.527 -4.913 19 HB2 PHE 3 HB2 PHE 3 3.180 -20.648 -2.343 20 HB3 PHE 3 HB3 PHE 3 2.817 -18.928 -2.460 21 HD1 PHE 3 HD1 PHE 3 0.567 -18.558 -2.263 22 HD2 PHE 3 HD2 PHE 3 1.913 -21.898 -4.533 23 HE1 PHE 3 HE1 PHE 3 -1.761 -19.089 -2.856 24 HE2 PHE 3 HE2 PHE 3 -0.412 -22.434 -5.130 25 HZ PHE 3 HZ PHE 3 -2.253 -21.029 -4.293 26 H GLY 4 H GLY 4 5.183 -18.696 -6.009 27 HA2 GLY 4 HA2 GLY 4 5.136 -16.777 -7.269 28 HA3 GLY 4 HA3 GLY 4 3.407 -16.721 -6.965 29 H LEU 5 H LEU 5 5.489 -16.772 -4.228 30 HA LEU 5 HA LEU 5 4.521 -14.261 -3.308 31 HB2 LEU 5 HB2 LEU 5 6.894 -15.766 -2.234 32 HB3 LEU 5 HB3 LEU 5 5.867 -14.619 -1.379 33 HG LEU 5 HG LEU 5 4.773 -17.214 -2.416 34 HD11 LEU 5 HD11 LEU 5 5.541 -17.070 0.422 35 HD12 LEU 5 HD12 LEU 5 6.871 -17.225 -0.725 36 HD13 LEU 5 HD13 LEU 5 5.582 -18.428 -0.703 37 HD21 LEU 5 HD21 LEU 5 3.737 -16.244 0.081 38 HD22 LEU 5 HD22 LEU 5 2.898 -16.530 -1.444 39 HD23 LEU 5 HD23 LEU 5 3.672 -14.974 -1.141 40 H GLY 6 H GLY 6 6.392 -12.768 -2.270 41 HA2 GLY 6 HA2 GLY 6 8.356 -12.221 -4.402 42 HA3 GLY 6 HA3 GLY 6 7.344 -10.933 -3.765 43 H VAL 7 H VAL 7 10.296 -11.314 -3.774 44 HA VAL 7 HA VAL 7 11.029 -11.756 -1.023 45 HB VAL 7 HB VAL 7 13.289 -11.189 -1.704 46 HG11 VAL 7 HG11 VAL 7 12.586 -12.753 -4.067 47 HG12 VAL 7 HG12 VAL 7 13.597 -13.178 -2.684 48 HG13 VAL 7 HG13 VAL 7 11.844 -13.345 -2.581 49 HG21 VAL 7 HG21 VAL 7 13.855 -10.394 -3.883 50 HG22 VAL 7 HG22 VAL 7 12.187 -10.551 -4.435 51 HG23 VAL 7 HG23 VAL 7 12.606 -9.329 -3.236 52 HA PRO 8 HA PRO 8 11.384 -6.903 -1.500 53 HB2 PRO 8 HB2 PRO 8 9.349 -5.849 -2.956 54 HB3 PRO 8 HB3 PRO 8 10.906 -6.293 -3.664 55 HG2 PRO 8 HG2 PRO 8 8.325 -7.811 -3.660 56 HG3 PRO 8 HG3 PRO 8 9.482 -7.573 -4.984 57 HD2 PRO 8 HD2 PRO 8 9.385 -9.853 -3.526 58 HD3 PRO 8 HD3 PRO 8 10.895 -9.221 -4.213 59 H GLU 9 H GLU 9 8.097 -8.269 -1.733 60 HA GLU 9 HA GLU 9 6.936 -6.499 0.138 61 HB2 GLU 9 HB2 GLU 9 5.025 -7.967 0.106 62 HB3 GLU 9 HB3 GLU 9 5.656 -7.823 -1.529 63 HG2 GLU 9 HG2 GLU 9 6.763 -9.983 -1.299 64 HG3 GLU 9 HG3 GLU 9 6.147 -10.127 0.346 65 H LEU 10 H LEU 10 8.526 -9.612 0.454 66 HA LEU 10 HA LEU 10 7.770 -10.287 3.045 67 HB2 LEU 10 HB2 LEU 10 9.681 -11.154 1.132 68 HB3 LEU 10 HB3 LEU 10 10.500 -10.987 2.683 69 HG LEU 10 HG LEU 10 9.686 -13.273 2.271 70 HD11 LEU 10 HD11 LEU 10 8.403 -13.496 4.422 71 HD12 LEU 10 HD12 LEU 10 8.444 -11.736 4.540 72 HD13 LEU 10 HD13 LEU 10 9.949 -12.654 4.544 73 HD21 LEU 10 HD21 LEU 10 7.725 -12.761 0.937 74 HD22 LEU 10 HD22 LEU 10 6.961 -11.980 2.322 75 HD23 LEU 10 HD23 LEU 10 7.271 -13.716 2.348 76 H ALA 11 H ALA 11 10.254 -8.077 1.902 77 HA ALA 11 HA ALA 11 11.684 -7.657 4.238 78 HB1 ALA 11 HB1 ALA 11 11.159 -5.242 2.640 79 HB2 ALA 11 HB2 ALA 11 12.688 -5.981 3.119 80 HB3 ALA 11 HB3 ALA 11 11.791 -6.625 1.745 81 H VAL 12 H VAL 12 8.554 -6.405 3.270 82 HA VAL 12 HA VAL 12 8.349 -4.450 5.332 83 HB VAL 12 HB VAL 12 6.145 -5.783 3.754 84 HG11 VAL 12 HG11 VAL 12 6.203 -3.452 5.631 85 HG12 VAL 12 HG12 VAL 12 5.013 -3.530 4.329 86 HG13 VAL 12 HG13 VAL 12 5.065 -4.797 5.556 87 HG21 VAL 12 HG21 VAL 12 7.447 -4.741 2.142 88 HG22 VAL 12 HG22 VAL 12 6.266 -3.496 2.546 89 HG23 VAL 12 HG23 VAL 12 7.895 -3.415 3.215 90 H ILE 13 H ILE 13 6.429 -7.425 4.905 91 HA ILE 13 HA ILE 13 5.372 -7.546 7.451 92 HB ILE 13 HB ILE 13 4.576 -8.992 5.671 93 HG12 ILE 13 HG12 ILE 13 5.691 -10.628 7.959 94 HG13 ILE 13 HG13 ILE 13 4.221 -9.662 8.033 95 HG21 ILE 13 HG21 ILE 13 5.803 -10.792 4.762 96 HG22 ILE 13 HG22 ILE 13 6.895 -9.409 4.748 97 HG23 ILE 13 HG23 ILE 13 7.063 -10.651 5.987 98 HD11 ILE 13 HD11 ILE 13 3.013 -11.249 7.055 99 HD12 ILE 13 HD12 ILE 13 4.233 -11.534 5.812 100 HD13 ILE 13 HD13 ILE 13 4.376 -12.317 7.385 101 H ALA 14 H ALA 14 8.537 -8.518 6.327 102 HA ALA 14 HA ALA 14 9.223 -9.927 8.740 103 HB1 ALA 14 HB1 ALA 14 11.412 -10.176 7.768 104 HB2 ALA 14 HB2 ALA 14 10.191 -10.504 6.537 105 HB3 ALA 14 HB3 ALA 14 11.045 -8.962 6.542 106 H GLY 15 H GLY 15 9.664 -6.694 7.446 107 HA2 GLY 15 HA2 GLY 15 11.533 -5.882 9.474 108 HA3 GLY 15 HA3 GLY 15 10.731 -4.834 8.313 109 H VAL 16 H VAL 16 8.062 -5.831 9.111 110 HA VAL 16 HA VAL 16 7.627 -3.965 11.258 111 HB VAL 16 HB VAL 16 6.030 -4.239 9.364 112 HG11 VAL 16 HG11 VAL 16 6.121 -6.650 9.122 113 HG12 VAL 16 HG12 VAL 16 5.407 -6.860 10.722 114 HG13 VAL 16 HG13 VAL 16 4.462 -6.133 9.421 115 HG21 VAL 16 HG21 VAL 16 4.333 -4.914 11.650 116 HG22 VAL 16 HG22 VAL 16 5.526 -3.659 11.984 117 HG23 VAL 16 HG23 VAL 16 4.377 -3.455 10.662 118 H ALA 17 H ALA 17 7.915 -7.412 10.919 119 HA ALA 17 HA ALA 17 6.860 -7.919 13.584 120 HB1 ALA 17 HB1 ALA 17 6.977 -10.213 13.069 121 HB2 ALA 17 HB2 ALA 17 6.448 -9.424 11.582 122 HB3 ALA 17 HB3 ALA 17 8.125 -9.942 11.758 123 H ALA 18 H ALA 18 9.924 -7.722 11.910 124 HA ALA 18 HA ALA 18 11.595 -9.008 13.722 125 HB1 ALA 18 HB1 ALA 18 12.021 -6.765 11.788 126 HB2 ALA 18 HB2 ALA 18 13.323 -7.291 12.856 127 HB3 ALA 18 HB3 ALA 18 12.602 -8.428 11.716 128 H LEU 19 H LEU 19 9.984 -5.950 13.956 129 HA LEU 19 HA LEU 19 11.637 -4.784 15.948 130 HB2 LEU 19 HB2 LEU 19 8.758 -4.289 15.211 131 HB3 LEU 19 HB3 LEU 19 9.674 -3.303 16.350 132 HG LEU 19 HG LEU 19 10.531 -3.663 13.489 133 HD11 LEU 19 HD11 LEU 19 9.236 -1.922 12.772 134 HD12 LEU 19 HD12 LEU 19 9.078 -1.227 14.384 135 HD13 LEU 19 HD13 LEU 19 8.145 -2.657 13.945 136 HD21 LEU 19 HD21 LEU 19 11.170 -1.672 15.657 137 HD22 LEU 19 HD22 LEU 19 11.643 -1.477 13.969 138 HD23 LEU 19 HD23 LEU 19 12.262 -2.836 14.909 139 H LEU 20 H LEU 20 8.371 -6.202 16.220 140 HA LEU 20 HA LEU 20 8.198 -6.217 18.983 141 HB2 LEU 20 HB2 LEU 20 7.069 -8.304 17.126 142 HB3 LEU 20 HB3 LEU 20 6.494 -7.914 18.745 143 HG LEU 20 HG LEU 20 4.933 -6.785 17.554 144 HD11 LEU 20 HD11 LEU 20 5.335 -4.496 17.635 145 HD12 LEU 20 HD12 LEU 20 7.034 -4.678 17.201 146 HD13 LEU 20 HD13 LEU 20 6.478 -5.152 18.806 147 HD21 LEU 20 HD21 LEU 20 6.853 -7.115 15.411 148 HD22 LEU 20 HD22 LEU 20 6.060 -5.540 15.345 149 HD23 LEU 20 HD23 LEU 20 5.093 -7.016 15.346 150 H PHE 21 H PHE 21 9.133 -8.972 16.914 151 HA PHE 21 HA PHE 21 9.889 -10.681 18.992 152 HB2 PHE 21 HB2 PHE 21 10.464 -10.540 16.068 153 HB3 PHE 21 HB3 PHE 21 11.435 -11.629 17.054 154 HD1 PHE 21 HD1 PHE 21 10.014 -13.149 18.696 155 HD2 PHE 21 HD2 PHE 21 8.549 -11.364 15.120 156 HE1 PHE 21 HE1 PHE 21 8.229 -14.839 18.587 157 HE2 PHE 21 HE2 PHE 21 6.762 -13.051 15.006 158 HZ PHE 21 HZ PHE 21 6.600 -14.792 16.741 159 H GLY 22 H GLY 22 11.888 -8.518 16.990 160 HA2 GLY 22 HA2 GLY 22 13.904 -7.507 17.433 161 HA3 GLY 22 HA3 GLY 22 13.629 -7.870 19.131 162 HA PRO 23 HA PRO 23 15.850 -11.757 17.300 163 HB2 PRO 23 HB2 PRO 23 16.768 -11.551 14.753 164 HB3 PRO 23 HB3 PRO 23 15.157 -12.161 15.147 165 HG2 PRO 23 HG2 PRO 23 15.977 -9.432 14.231 166 HG3 PRO 23 HG3 PRO 23 14.591 -10.413 13.720 167 HD2 PRO 23 HD2 PRO 23 14.364 -8.386 15.501 168 HD3 PRO 23 HD3 PRO 23 13.342 -9.837 15.570 169 H LYS 24 H LYS 24 17.485 -11.185 18.707 170 HA LYS 24 HA LYS 24 19.588 -10.613 19.359 171 HB2 LYS 24 HB2 LYS 24 20.086 -11.813 17.146 172 HB3 LYS 24 HB3 LYS 24 20.281 -10.207 16.455 173 HG2 LYS 24 HG2 LYS 24 21.804 -10.410 18.872 174 HG3 LYS 24 HG3 LYS 24 22.198 -11.752 17.795 175 HD2 LYS 24 HD2 LYS 24 22.327 -9.902 15.971 176 HD3 LYS 24 HD3 LYS 24 22.495 -8.807 17.346 177 HE2 LYS 24 HE2 LYS 24 24.208 -11.152 17.546 178 HE3 LYS 24 3HE LYS 24 24.532 -10.192 16.102 179 HZ1 LYS 24 1HZ LYS 24 25.692 -8.839 17.396 180 HZ2 LYS 24 2HZ LYS 24 25.194 -9.636 18.803 181 HZ3 LYS 24 3HZ LYS 24 24.255 -8.383 18.164 182 H LYS 25 H LYS 25 18.775 -8.679 20.298 183 HA LYS 25 HA LYS 25 20.005 -6.310 19.222 184 HB2 LYS 25 HB2 LYS 25 17.454 -6.740 18.363 185 HB3 LYS 25 HB3 LYS 25 17.164 -5.800 19.821 186 HG2 LYS 25 HG2 LYS 25 18.894 -4.163 18.874 187 HG3 LYS 25 HG3 LYS 25 18.659 -5.015 17.347 188 HD2 LYS 25 HD2 LYS 25 16.375 -4.418 17.253 189 HD3 LYS 25 HD3 LYS 25 16.366 -3.892 18.938 190 HE2 LYS 25 HE2 LYS 25 18.283 -2.522 17.163 191 HE3 LYS 25 3HE LYS 25 16.578 -2.214 16.838 192 HZ1 LYS 25 1HZ LYS 25 16.325 -1.611 19.199 193 HZ2 LYS 25 2HZ LYS 25 17.396 -0.593 18.377 194 HZ3 LYS 25 3HZ LYS 25 17.993 -1.789 19.413 195 H LEU 26 H LEU 26 20.158 -7.977 21.616 196 HA LEU 26 HA LEU 26 20.377 -7.770 23.869 197 HB2 LEU 26 HB2 LEU 26 20.357 -4.855 23.114 198 HB3 LEU 26 HB3 LEU 26 20.728 -5.448 24.731 199 HG LEU 26 HG LEU 26 22.317 -6.148 22.265 200 HD11 LEU 26 HD11 LEU 26 22.488 -3.769 22.683 201 HD12 LEU 26 HD12 LEU 26 23.990 -4.573 23.133 202 HD13 LEU 26 HD13 LEU 26 22.852 -4.069 24.382 203 HD21 LEU 26 HD21 LEU 26 22.393 -7.754 24.159 204 HD22 LEU 26 HD22 LEU 26 22.989 -6.453 25.189 205 HD23 LEU 26 HD23 LEU 26 23.947 -6.997 23.812 206 HA PRO 27 HA PRO 27 15.806 -7.072 24.316 207 HB2 PRO 27 HB2 PRO 27 15.299 -9.524 25.368 208 HB3 PRO 27 HB3 PRO 27 15.335 -9.213 23.627 209 HG2 PRO 27 HG2 PRO 27 17.455 -10.385 25.386 210 HG3 PRO 27 HG3 PRO 27 16.931 -10.898 23.772 211 HD2 PRO 27 HD2 PRO 27 19.163 -9.420 24.178 212 HD3 PRO 27 HD3 PRO 27 18.170 -9.267 22.715 213 H GLU 28 H GLU 28 18.435 -7.947 26.363 214 HA GLU 28 HA GLU 28 17.274 -8.182 28.856 215 HB2 GLU 28 HB2 GLU 28 19.385 -7.571 29.787 216 HB3 GLU 28 HB3 GLU 28 19.708 -8.453 28.302 217 HG2 GLU 28 HG2 GLU 28 19.921 -6.205 27.167 218 HG3 GLU 28 HG3 GLU 28 19.922 -5.500 28.784 219 H ILE 29 H ILE 29 17.761 -5.327 26.911 220 HA ILE 29 HA ILE 29 17.487 -3.330 28.825 221 HB ILE 29 HB ILE 29 16.761 -1.860 27.041 222 HG12 ILE 29 HG12 ILE 29 16.452 -4.371 25.380 223 HG13 ILE 29 HG13 ILE 29 15.130 -3.385 25.994 224 HG21 ILE 29 HG21 ILE 29 19.111 -3.390 27.037 225 HG22 ILE 29 HG22 ILE 29 18.592 -3.285 25.356 226 HG23 ILE 29 HG23 ILE 29 18.850 -1.813 26.292 227 HD11 ILE 29 HD11 ILE 29 15.216 -2.206 24.130 228 HD12 ILE 29 HD12 ILE 29 16.825 -1.646 24.590 229 HD13 ILE 29 HD13 ILE 29 16.645 -3.090 23.594 230 H GLY 30 H GLY 30 15.099 -5.437 27.415 231 HA2 GLY 30 HA2 GLY 30 12.848 -3.872 28.330 232 HA3 GLY 30 HA3 GLY 30 12.783 -5.465 27.591 233 H LYS 31 H LYS 31 14.679 -6.638 29.471 234 HA LYS 31 HA LYS 31 12.807 -7.365 31.509 235 HB2 LYS 31 HB2 LYS 31 15.390 -8.301 30.536 236 HB3 LYS 31 HB3 LYS 31 15.273 -8.373 32.289 237 HG2 LYS 31 HG2 LYS 31 13.043 -9.563 31.909 238 HG3 LYS 31 HG3 LYS 31 13.584 -9.763 30.240 239 HD2 LYS 31 HD2 LYS 31 15.714 -10.761 31.234 240 HD3 LYS 31 HD3 LYS 31 14.825 -10.847 32.757 241 HE2 LYS 31 HE2 LYS 31 13.030 -11.976 31.100 242 HE3 LYS 31 3HE LYS 31 14.523 -12.429 30.280 243 HZ1 LYS 31 1HZ LYS 31 14.900 -13.976 31.800 244 HZ2 LYS 31 2HZ LYS 31 13.384 -13.655 32.478 245 HZ3 LYS 31 3HZ LYS 31 14.759 -12.863 33.066 246 H SER 32 H SER 32 15.566 -5.231 31.299 247 HA SER 32 HA SER 32 16.129 -4.886 34.010 248 HB2 SER 32 HB2 SER 32 17.387 -3.991 31.933 249 HB3 SER 32 HB3 SER 32 16.284 -2.618 32.036 250 HG SER 32 HG SER 32 17.030 -2.303 34.188 251 H ILE 33 H ILE 33 13.981 -2.966 31.913 252 HA ILE 33 HA ILE 33 13.027 -1.292 33.982 253 HB ILE 33 HB ILE 33 11.165 -0.766 32.394 254 HG12 ILE 33 HG12 ILE 33 12.632 -2.511 30.425 255 HG13 ILE 33 HG13 ILE 33 11.273 -3.119 31.364 256 HG21 ILE 33 HG21 ILE 33 14.043 -0.590 31.594 257 HG22 ILE 33 HG22 ILE 33 12.780 0.092 30.571 258 HG23 ILE 33 HG23 ILE 33 12.982 0.669 32.225 259 HD11 ILE 33 HD11 ILE 33 9.999 -1.097 30.422 260 HD12 ILE 33 HD12 ILE 33 11.305 -1.020 29.239 261 HD13 ILE 33 HD13 ILE 33 10.311 -2.472 29.363 262 H GLY 34 H GLY 34 12.396 -4.539 33.250 263 HA2 GLY 34 HA2 GLY 34 9.714 -4.534 34.391 264 HA3 GLY 34 HA3 GLY 34 10.562 -5.924 33.728 265 H LYS 35 H LYS 35 12.970 -5.567 35.253 266 HA LYS 35 HA LYS 35 12.172 -6.925 37.638 267 HB2 LYS 35 HB2 LYS 35 14.361 -7.142 36.209 268 HB3 LYS 35 HB3 LYS 35 14.933 -5.835 37.236 269 HG2 LYS 35 HG2 LYS 35 14.421 -7.233 39.216 270 HG3 LYS 35 HG3 LYS 35 13.996 -8.554 38.126 271 HD2 LYS 35 HD2 LYS 35 16.136 -9.134 37.980 272 HD3 LYS 35 HD3 LYS 35 16.539 -7.533 37.354 273 HE2 LYS 35 HE2 LYS 35 17.788 -7.374 39.215 274 HE3 LYS 35 3HE LYS 35 16.254 -7.005 40.000 275 HZ1 LYS 35 1HZ LYS 35 17.763 -9.537 39.992 276 HZ2 LYS 35 2HZ LYS 35 16.097 -9.538 40.282 277 HZ3 LYS 35 3HZ LYS 35 17.133 -8.678 41.306 278 H THR 36 H THR 36 12.797 -3.646 36.803 279 HA THR 36 HA THR 36 13.242 -2.806 39.547 280 HB THR 36 HB THR 36 12.785 -0.955 37.217 281 HG1 THR 36 HG1 THR 36 14.540 -1.777 36.373 282 HG21 THR 36 HG21 THR 36 14.728 -0.518 39.439 283 HG22 THR 36 HG22 THR 36 13.007 -0.295 39.753 284 HG23 THR 36 HG23 THR 36 13.806 0.657 38.502 285 H VAL 37 H VAL 37 10.661 -2.933 37.208 286 HA VAL 37 HA VAL 37 8.909 -1.273 38.835 287 HB VAL 37 HB VAL 37 8.843 -1.084 36.367 288 HG11 VAL 37 HG11 VAL 37 9.213 -3.611 36.085 289 HG12 VAL 37 HG12 VAL 37 7.465 -3.747 36.294 290 HG13 VAL 37 HG13 VAL 37 8.125 -2.799 34.960 291 HG21 VAL 37 HG21 VAL 37 6.690 -0.484 36.474 292 HG22 VAL 37 HG22 VAL 37 6.157 -2.120 36.860 293 HG23 VAL 37 HG23 VAL 37 6.750 -1.062 38.140 294 H LYS 38 H LYS 38 9.371 -4.644 37.970 295 HA LYS 38 HA LYS 38 6.963 -5.498 39.326 296 HB2 LYS 38 HB2 LYS 38 9.237 -7.086 38.123 297 HB3 LYS 38 HB3 LYS 38 7.755 -7.781 38.766 298 HG2 LYS 38 HG2 LYS 38 7.771 -5.774 36.531 299 HG3 LYS 38 HG3 LYS 38 7.877 -7.515 36.261 300 HD2 LYS 38 HD2 LYS 38 5.746 -7.839 37.388 301 HD3 LYS 38 HD3 LYS 38 5.648 -6.111 37.737 302 HE2 LYS 38 HE2 LYS 38 5.559 -5.618 35.357 303 HE3 LYS 38 3HE LYS 38 5.729 -7.332 34.978 304 HZ1 LYS 38 1HZ LYS 38 3.523 -7.400 35.000 305 HZ2 LYS 38 2HZ LYS 38 3.389 -5.860 35.687 306 HZ3 LYS 38 3HZ LYS 38 3.594 -7.215 36.680 307 H SER 39 H SER 39 10.213 -4.872 40.151 308 HA SER 39 HA SER 39 10.777 -6.687 42.151 309 HB2 SER 39 HB2 SER 39 12.594 -5.352 41.908 310 HB3 SER 39 HB3 SER 39 11.623 -3.936 41.505 311 HG SER 39 HG SER 39 12.477 -4.870 43.992 312 H PHE 40 H PHE 40 8.786 -3.780 42.301 313 HA PHE 40 HA PHE 40 8.369 -3.818 45.100 314 HB2 PHE 40 HB2 PHE 40 7.913 -1.943 43.319 315 HB3 PHE 40 HB3 PHE 40 6.328 -2.702 43.214 316 HD1 PHE 40 HD1 PHE 40 8.354 -0.382 44.971 317 HD2 PHE 40 HD2 PHE 40 5.033 -3.008 45.412 318 HE1 PHE 40 HE1 PHE 40 7.627 0.878 46.955 319 HE2 PHE 40 HE2 PHE 40 4.300 -1.752 47.397 320 HZ PHE 40 HZ PHE 40 5.597 0.194 48.171 321 H GLN 41 H GLN 41 6.685 -5.292 42.387 322 HA GLN 41 HA GLN 41 4.444 -6.193 43.898 323 HB2 GLN 41 HB2 GLN 41 5.356 -6.327 41.160 324 HB3 GLN 41 HB3 GLN 41 4.738 -7.888 41.682 325 HG2 GLN 41 HG2 GLN 41 2.994 -5.751 42.518 326 HG3 GLN 41 HG3 GLN 41 3.270 -5.710 40.777 327 HE21 GLN 41 HE21 GLN 41 1.151 -6.313 40.340 328 HE22 GLN 41 HE22 GLN 41 0.584 -7.925 40.593 329 H GLN 42 H GLN 42 7.506 -7.652 42.913 330 HA GLN 42 HA GLN 42 6.907 -10.241 43.932 331 HB2 GLN 42 HB2 GLN 42 9.072 -8.969 42.544 332 HB3 GLN 42 HB3 GLN 42 9.709 -9.872 43.912 333 HG2 GLN 42 HG2 GLN 42 7.852 -11.576 42.733 334 HG3 GLN 42 HG3 GLN 42 8.705 -10.821 41.387 335 HE21 GLN 42 HE21 GLN 42 11.207 -10.495 42.391 336 HE22 GLN 42 HE22 GLN 42 11.919 -12.034 42.724 337 H ALA 43 H ALA 43 8.525 -7.394 45.230 338 HA ALA 43 HA ALA 43 9.661 -8.457 47.522 339 HB1 ALA 43 HB1 ALA 43 9.011 -6.064 48.455 340 HB2 ALA 43 HB2 ALA 43 10.274 -6.282 47.242 341 HB3 ALA 43 HB3 ALA 43 8.659 -5.772 46.750 342 H ALA 44 H ALA 44 6.346 -7.302 47.012 343 HA ALA 44 HA ALA 44 5.390 -7.506 49.609 344 HB1 ALA 44 HB1 ALA 44 4.119 -6.476 47.806 345 HB2 ALA 44 HB2 ALA 44 3.900 -8.052 47.044 346 HB3 ALA 44 HB3 ALA 44 3.164 -7.722 48.613 347 H LYS 45 H LYS 45 6.089 -10.001 47.288 348 HA LYS 45 HA LYS 45 4.670 -12.051 48.759 349 HB2 LYS 45 HB2 LYS 45 6.037 -11.831 46.172 350 HB3 LYS 45 HB3 LYS 45 6.287 -13.376 46.975 351 HG2 LYS 45 HG2 LYS 45 3.601 -13.028 47.271 352 HG3 LYS 45 HG3 LYS 45 3.896 -12.283 45.699 353 HD2 LYS 45 HD2 LYS 45 3.712 -14.384 44.920 354 HD3 LYS 45 HD3 LYS 45 5.373 -14.556 45.494 355 HE2 LYS 45 HE2 LYS 45 4.514 -16.324 46.602 356 HE3 LYS 45 3HE LYS 45 4.031 -15.091 47.766 357 HZ1 LYS 45 1HZ LYS 45 2.208 -15.681 45.554 358 HZ2 LYS 45 2HZ LYS 45 1.862 -15.219 47.144 359 HZ3 LYS 45 3HZ LYS 45 2.319 -16.812 46.807 360 H GLU 46 H GLU 46 8.025 -11.080 48.190 361 HA GLU 46 HA GLU 46 9.218 -13.213 49.610 362 HB2 GLU 46 HB2 GLU 46 10.078 -10.794 48.291 363 HB3 GLU 46 HB3 GLU 46 10.923 -10.990 49.819 364 HG2 GLU 46 HG2 GLU 46 10.760 -13.090 47.672 365 HG3 GLU 46 HG3 GLU 46 12.111 -11.982 47.900 366 H PHE 47 H PHE 47 8.055 -10.037 50.576 367 HA PHE 47 HA PHE 47 9.166 -9.960 53.151 368 HB2 PHE 47 HB2 PHE 47 7.226 -8.450 51.630 369 HB3 PHE 47 HB3 PHE 47 6.696 -8.638 53.299 370 HD1 PHE 47 HD1 PHE 47 7.699 -7.419 55.041 371 HD2 PHE 47 HD2 PHE 47 9.458 -7.429 51.165 372 HE1 PHE 47 HE1 PHE 47 9.214 -5.607 55.728 373 HE2 PHE 47 HE2 PHE 47 10.976 -5.618 51.847 374 HZ PHE 47 HZ PHE 47 10.856 -4.704 54.131 375 H GLU 48 H GLU 48 6.406 -11.633 51.866 376 HA GLU 48 HA GLU 48 5.161 -12.174 54.382 377 HB2 GLU 48 HB2 GLU 48 4.226 -12.265 51.902 378 HB3 GLU 48 HB3 GLU 48 4.727 -13.947 52.024 379 HG2 GLU 48 HG2 GLU 48 3.034 -14.479 53.378 380 HG3 GLU 48 HG3 GLU 48 3.192 -12.999 54.321 381 H SER 49 H SER 49 7.602 -13.722 52.429 382 HA SER 49 HA SER 49 7.529 -16.211 53.868 383 HB2 SER 49 HB2 SER 49 8.621 -15.338 51.441 384 HB3 SER 49 HB3 SER 49 10.013 -15.732 52.450 385 HG SER 49 HG SER 49 8.647 -17.430 51.121 386 H GLU 50 H GLU 50 9.368 -13.230 54.008 387 HA GLU 50 HA GLU 50 11.305 -14.243 55.875 388 HB2 GLU 50 HB2 GLU 50 10.674 -11.543 54.734 389 HB3 GLU 50 HB3 GLU 50 11.750 -11.683 56.118 390 HG2 GLU 50 HG2 GLU 50 13.394 -12.723 54.912 391 HG3 GLU 50 HG3 GLU 50 12.265 -13.371 53.724 392 H LEU 51 H LEU 51 8.303 -12.426 56.044 393 HA LEU 51 HA LEU 51 6.947 -11.860 57.779 394 HB2 LEU 51 HB2 LEU 51 7.942 -14.392 58.354 395 HB3 LEU 51 HB3 LEU 51 8.162 -13.481 59.846 396 HG LEU 51 HG LEU 51 5.540 -13.801 58.388 397 HD11 LEU 51 HD11 LEU 51 6.883 -15.713 59.860 398 HD12 LEU 51 HD12 LEU 51 5.155 -15.682 59.512 399 HD13 LEU 51 HD13 LEU 51 5.762 -14.997 61.020 400 HD21 LEU 51 HD21 LEU 51 4.579 -12.874 60.438 401 HD22 LEU 51 HD22 LEU 51 5.683 -11.734 59.667 402 HD23 LEU 51 HD23 LEU 51 6.200 -12.638 61.092 403 H LYS 52 H LYS 52 9.534 -10.509 57.380 404 HA LYS 52 HA LYS 52 10.431 -9.789 60.036 405 HB2 LYS 52 HB2 LYS 52 11.317 -9.286 57.263 406 HB3 LYS 52 HB3 LYS 52 11.640 -7.989 58.405 407 HG2 LYS 52 HG2 LYS 52 13.171 -9.195 59.561 408 HG3 LYS 52 HG3 LYS 52 12.363 -10.733 59.245 409 HD2 LYS 52 HD2 LYS 52 13.988 -11.104 57.754 410 HD3 LYS 52 HD3 LYS 52 13.164 -9.919 56.738 411 HE2 LYS 52 HE2 LYS 52 15.005 -8.850 58.788 412 HE3 LYS 52 3HE LYS 52 15.746 -9.723 57.448 413 HZ1 LYS 52 1HZ LYS 52 14.198 -7.224 57.405 414 HZ2 LYS 52 2HZ LYS 52 14.209 -8.211 56.031 415 HZ3 LYS 52 3HZ LYS 52 15.661 -7.591 56.640 416 H THR 53 H THR 53 10.746 -7.313 60.384 417 HA THR 53 HA THR 53 8.232 -5.943 59.680 418 HB THR 53 HB THR 53 8.273 -6.679 62.062 419 HG1 THR 53 HG1 THR 53 8.019 -4.325 62.825 420 HG21 THR 53 HG21 THR 53 10.852 -6.172 62.146 421 HG22 THR 53 HG22 THR 53 9.852 -5.983 63.587 422 HG23 THR 53 HG23 THR 53 10.305 -4.570 62.635
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