NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
526224 | 2lf1 | 17311 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 THR 1 HT1 THR 1 -5.519 9.495 5.525 2 H2 THR 1 HT2 THR 1 -3.961 10.193 5.702 3 H3 THR 1 HT3 THR 1 -4.224 8.555 6.139 4 HA THR 1 HA THR 1 -4.705 8.007 3.876 5 HB THR 1 HB THR 1 -3.703 10.678 3.008 6 HG1 THR 1 HG1 THR 1 -6.401 10.211 3.743 7 HG21 THR 1 HG21 THR 1 -5.116 10.342 1.117 8 HG22 THR 1 HG22 THR 1 -5.879 8.944 1.873 9 HG23 THR 1 HG23 THR 1 -4.186 8.868 1.385 10 H ALA 2 H ALA 2 -2.949 6.718 4.584 11 HA ALA 2 HA ALA 2 -0.308 7.781 3.817 12 HB1 ALA 2 HB1 ALA 2 -0.556 5.609 5.848 13 HB2 ALA 2 HB2 ALA 2 -0.822 7.284 6.330 14 HB3 ALA 2 HB3 ALA 2 0.723 6.804 5.628 15 H PHE 3 H PHE 3 1.048 6.442 2.653 16 HA PHE 3 HA PHE 3 -0.242 4.065 1.499 17 HB2 PHE 3 HB3 PHE 3 2.044 5.765 0.491 18 HB3 PHE 3 HB2 PHE 3 1.481 4.301 -0.300 19 HD1 PHE 3 HD1 PHE 3 -1.411 5.687 0.935 20 HD2 PHE 3 HD2 PHE 3 1.551 6.392 -2.039 21 HE1 PHE 3 HE1 PHE 3 -3.026 7.017 -0.355 22 HE2 PHE 3 HE2 PHE 3 -0.060 7.722 -3.333 23 HZ PHE 3 HZ PHE 3 -2.348 8.037 -2.490 24 H LEU 4 H LEU 4 0.612 2.073 1.754 25 HA LEU 4 HA LEU 4 3.313 1.862 2.892 26 HB2 LEU 4 HB3 LEU 4 1.754 1.568 4.721 27 HB3 LEU 4 HB2 LEU 4 0.853 0.376 3.804 28 HG LEU 4 HG LEU 4 2.866 -1.100 3.845 29 HD11 LEU 4 HD11 LEU 4 4.430 -0.393 5.846 30 HD12 LEU 4 HD12 LEU 4 3.939 1.227 5.352 31 HD13 LEU 4 HD13 LEU 4 4.738 0.157 4.199 32 HD21 LEU 4 HD21 LEU 4 0.915 -1.020 5.564 33 HD22 LEU 4 HD22 LEU 4 2.154 -0.411 6.663 34 HD23 LEU 4 HD23 LEU 4 2.346 -1.993 5.907 35 H TRP 5 H TRP 5 4.525 0.808 1.457 36 HA TRP 5 HA TRP 5 3.650 -1.756 0.465 37 HB2 TRP 5 HB3 TRP 5 3.583 -1.311 -1.835 38 HB3 TRP 5 HB2 TRP 5 2.703 0.032 -1.119 39 HD1 TRP 5 HD1 TRP 5 5.940 -0.784 -2.971 40 HE1 TRP 5 HE1 TRP 5 6.994 1.409 -3.807 41 HE3 TRP 5 HE3 TRP 5 2.864 2.546 -0.608 42 HZ2 TRP 5 HZ2 TRP 5 6.578 4.183 -3.504 43 HZ3 TRP 5 HZ3 TRP 5 3.262 4.953 -0.937 44 HH2 TRP 5 HH2 TRP 5 5.079 5.752 -2.354 45 H ALA 6 H ALA 6 5.336 -2.931 -0.682 46 HA ALA 6 HA ALA 6 7.995 -2.086 0.245 47 HB1 ALA 6 HB1 ALA 6 7.346 -4.253 1.039 48 HB2 ALA 6 HB2 ALA 6 8.627 -4.461 -0.155 49 HB3 ALA 6 HB3 ALA 6 6.950 -4.786 -0.594 50 H GLN 7 H GLN 7 9.830 -2.204 -1.155 51 HA GLN 7 HA GLN 7 9.405 -2.686 -3.973 52 HB2 GLN 7 HB3 GLN 7 10.236 -0.402 -4.611 53 HB3 GLN 7 HB2 GLN 7 8.619 -0.439 -3.923 54 HG2 GLN 7 HG3 GLN 7 10.383 -0.079 -1.769 55 HG3 GLN 7 HG2 GLN 7 10.931 1.000 -3.050 56 HE21 GLN 7 HE21 GLN 7 8.289 0.172 -0.929 57 HE22 GLN 7 HE22 GLN 7 7.417 1.652 -1.113 58 H ASP 8 H ASP 8 11.369 -2.532 -5.253 59 HA ASP 8 HA ASP 8 13.738 -3.168 -3.641 60 HB2 ASP 8 HB3 ASP 8 14.583 -4.335 -5.585 61 HB3 ASP 8 HB2 ASP 8 12.932 -4.861 -5.287 62 H ARG 9 H ARG 9 15.724 -2.741 -5.560 63 HA ARG 9 HA ARG 9 16.235 0.012 -5.236 64 HB2 ARG 9 HB3 ARG 9 17.607 -2.302 -6.248 65 HB3 ARG 9 HB2 ARG 9 17.836 -0.955 -7.355 66 HG2 ARG 9 HG3 ARG 9 18.228 -0.492 -4.444 67 HG3 ARG 9 HG2 ARG 9 19.472 -1.358 -5.350 68 HD2 ARG 9 HD3 ARG 9 19.878 0.463 -6.756 69 HD3 ARG 9 HD2 ARG 9 18.358 1.247 -6.327 70 HE ARG 9 HE ARG 9 19.664 1.229 -3.983 71 HH11 ARG 9 HH11 ARG 9 20.650 2.214 -7.185 72 HH12 ARG 9 HH12 ARG 9 21.755 3.416 -6.609 73 HH21 ARG 9 HH21 ARG 9 21.116 2.811 -3.227 74 HH22 ARG 9 HH22 ARG 9 22.020 3.755 -4.363 75 H ASP 10 H ASP 10 14.863 -1.864 -7.850 76 HA ASP 10 HA ASP 10 14.870 0.327 -9.730 77 HB2 ASP 10 HB3 ASP 10 14.126 -2.533 -9.764 78 HB3 ASP 10 HB2 ASP 10 13.186 -1.495 -10.833 79 H GLY 11 H GLY 11 13.161 -0.105 -7.041 80 HA2 GLY 11 HA3 GLY 11 11.286 1.041 -6.281 81 HA3 GLY 11 HA2 GLY 11 11.015 1.607 -7.922 82 H LEU 12 H LEU 12 11.432 -1.696 -7.964 83 HA LEU 12 HA LEU 12 8.955 -2.378 -8.919 84 HB2 LEU 12 HB3 LEU 12 11.231 -3.712 -8.567 85 HB3 LEU 12 HB2 LEU 12 10.368 -4.341 -7.179 86 HG LEU 12 HG LEU 12 8.638 -5.266 -8.611 87 HD11 LEU 12 HD11 LEU 12 8.207 -4.402 -10.607 88 HD12 LEU 12 HD12 LEU 12 9.770 -4.969 -11.191 89 HD13 LEU 12 HD13 LEU 12 9.625 -3.361 -10.483 90 HD21 LEU 12 HD21 LEU 12 11.244 -6.142 -8.430 91 HD22 LEU 12 HD22 LEU 12 10.903 -6.225 -10.160 92 HD23 LEU 12 HD23 LEU 12 9.868 -7.078 -9.015 93 H ILE 13 H ILE 13 7.555 -4.142 -7.704 94 HA ILE 13 HA ILE 13 7.163 -3.642 -4.914 95 HB ILE 13 HB ILE 13 4.863 -2.913 -5.010 96 HG12 ILE 13 HG13 ILE 13 5.033 -2.415 -7.962 97 HG13 ILE 13 HG12 ILE 13 4.544 -3.999 -7.377 98 HG21 ILE 13 HG21 ILE 13 5.181 -0.641 -5.769 99 HG22 ILE 13 HG22 ILE 13 6.572 -1.131 -6.736 100 HG23 ILE 13 HG23 ILE 13 6.645 -1.223 -4.976 101 HD11 ILE 13 HD11 ILE 13 2.614 -3.170 -6.376 102 HD12 ILE 13 HD12 ILE 13 2.716 -2.319 -7.918 103 HD13 ILE 13 HD13 ILE 13 3.195 -1.505 -6.429 104 H GLY 14 H GLY 14 6.071 -5.092 -7.912 105 HA2 GLY 14 HA3 GLY 14 5.713 -7.633 -6.538 106 HA3 GLY 14 HA2 GLY 14 4.305 -6.974 -7.355 107 H LYS 15 H LYS 15 4.853 -9.273 -8.308 108 HA LYS 15 HA LYS 15 6.240 -8.768 -10.842 109 HB2 LYS 15 HB3 LYS 15 7.163 -11.041 -10.818 110 HB3 LYS 15 HB2 LYS 15 7.754 -10.099 -9.456 111 HG2 LYS 15 HG3 LYS 15 7.082 -11.694 -8.087 112 HG3 LYS 15 HG2 LYS 15 5.416 -11.408 -8.587 113 HD2 LYS 15 HD3 LYS 15 6.106 -12.898 -10.634 114 HD3 LYS 15 HD2 LYS 15 7.362 -13.465 -9.531 115 HE2 LYS 15 HE3 LYS 15 4.822 -13.387 -8.188 116 HE3 LYS 15 HE2 LYS 15 4.690 -14.316 -9.681 117 HZ1 LYS 15 HZ1 LYS 15 7.011 -14.854 -8.005 118 HZ2 LYS 15 HZ2 LYS 15 6.061 -15.919 -8.911 119 HZ3 LYS 15 HZ3 LYS 15 5.514 -15.371 -7.408 120 H ASP 16 H ASP 16 3.829 -8.326 -11.173 121 HA ASP 16 HA ASP 16 1.977 -8.901 -12.371 122 HB2 ASP 16 HB3 ASP 16 3.815 -11.005 -12.993 123 HB3 ASP 16 HB2 ASP 16 2.219 -11.711 -12.762 124 H GLY 17 H GLY 17 2.222 -9.098 -9.471 125 HA2 GLY 17 HA3 GLY 17 -0.316 -10.161 -8.873 126 HA3 GLY 17 HA2 GLY 17 0.910 -11.329 -8.404 127 H HIS 18 H HIS 18 2.838 -10.138 -7.207 128 HA HIS 18 HA HIS 18 2.275 -7.878 -5.620 129 HB2 HIS 18 HB3 HIS 18 1.919 -8.964 -3.447 130 HB3 HIS 18 HB2 HIS 18 0.634 -9.369 -4.579 131 HD1 HIS 18 HD1 HIS 18 -0.059 -11.668 -3.980 132 HD2 HIS 18 HD2 HIS 18 4.075 -11.265 -4.066 133 HE1 HIS 18 HE1 HIS 18 0.851 -13.981 -3.599 134 HE2 HIS 18 HE2 HIS 18 3.353 -13.696 -3.564 135 H LEU 19 H LEU 19 3.754 -8.274 -3.391 136 HA LEU 19 HA LEU 19 6.396 -8.258 -4.382 137 HB2 LEU 19 HB3 LEU 19 7.050 -8.191 -1.978 138 HB3 LEU 19 HB2 LEU 19 5.900 -6.958 -2.455 139 HG LEU 19 HG LEU 19 4.197 -8.855 -1.560 140 HD11 LEU 19 HD11 LEU 19 6.818 -9.555 -0.516 141 HD12 LEU 19 HD12 LEU 19 5.309 -10.467 -0.497 142 HD13 LEU 19 HD13 LEU 19 5.630 -9.270 0.756 143 HD21 LEU 19 HD21 LEU 19 4.311 -6.463 -0.930 144 HD22 LEU 19 HD22 LEU 19 5.604 -6.855 0.203 145 HD23 LEU 19 HD23 LEU 19 3.990 -7.527 0.439 146 HA PRO 20 HA PRO 20 6.817 -12.749 -4.204 147 HB2 PRO 20 HB3 PRO 20 8.985 -12.954 -5.758 148 HB3 PRO 20 HB2 PRO 20 7.396 -12.573 -6.431 149 HG2 PRO 20 HG3 PRO 20 9.687 -10.748 -5.827 150 HG3 PRO 20 HG2 PRO 20 8.604 -10.757 -7.230 151 HD2 PRO 20 HD3 PRO 20 8.344 -9.065 -5.071 152 HD3 PRO 20 HD2 PRO 20 7.013 -9.523 -6.151 153 H TRP 21 H TRP 21 8.822 -10.367 -2.849 154 HA TRP 21 HA TRP 21 10.893 -12.200 -1.993 155 HB2 TRP 21 HB3 TRP 21 11.668 -10.161 -0.662 156 HB3 TRP 21 HB2 TRP 21 11.697 -10.025 -2.417 157 HD1 TRP 21 HD1 TRP 21 9.190 -9.136 0.418 158 HE1 TRP 21 HE1 TRP 21 8.121 -6.869 -0.163 159 HE3 TRP 21 HE3 TRP 21 11.476 -8.294 -4.071 160 HZ2 TRP 21 HZ2 TRP 21 8.227 -4.977 -2.257 161 HZ3 TRP 21 HZ3 TRP 21 10.937 -6.233 -5.302 162 HH2 TRP 21 HH2 TRP 21 9.346 -4.610 -4.412 163 H HIS 22 H HIS 22 11.169 -13.044 0.020 164 HA HIS 22 HA HIS 22 8.809 -13.161 1.688 165 HB2 HIS 22 HB3 HIS 22 11.282 -14.720 1.365 166 HB3 HIS 22 HB2 HIS 22 10.726 -14.588 3.030 167 HD1 HIS 22 HD1 HIS 22 8.404 -14.840 0.071 168 HD2 HIS 22 HD2 HIS 22 9.747 -17.156 3.249 169 HE1 HIS 22 HE1 HIS 22 6.950 -16.892 0.069 170 HE2 HIS 22 HE2 HIS 22 7.839 -18.318 1.946 171 H LEU 23 H LEU 23 8.682 -11.067 2.535 172 HA LEU 23 HA LEU 23 10.861 -10.267 4.337 173 HB2 LEU 23 HB3 LEU 23 9.014 -8.820 2.604 174 HB3 LEU 23 HB2 LEU 23 9.071 -8.158 4.227 175 HG LEU 23 HG LEU 23 11.652 -8.224 3.892 176 HD11 LEU 23 HD11 LEU 23 11.168 -7.698 1.049 177 HD12 LEU 23 HD12 LEU 23 10.990 -9.386 1.530 178 HD13 LEU 23 HD13 LEU 23 12.503 -8.535 1.842 179 HD21 LEU 23 HD21 LEU 23 9.885 -6.240 2.466 180 HD22 LEU 23 HD22 LEU 23 11.575 -5.979 2.898 181 HD23 LEU 23 HD23 LEU 23 10.363 -6.186 4.163 182 HA PRO 24 HA PRO 24 7.727 -11.848 7.304 183 HB2 PRO 24 HB3 PRO 24 9.555 -12.279 9.289 184 HB3 PRO 24 HB2 PRO 24 9.182 -13.459 8.028 185 HG2 PRO 24 HG3 PRO 24 11.465 -11.534 8.206 186 HG3 PRO 24 HG2 PRO 24 11.468 -13.231 7.690 187 HD2 PRO 24 HD3 PRO 24 11.524 -11.197 5.923 188 HD3 PRO 24 HD2 PRO 24 10.682 -12.722 5.578 189 H ASP 25 H ASP 25 10.366 -9.550 7.853 190 HA ASP 25 HA ASP 25 9.298 -8.371 10.178 191 HB2 ASP 25 HB3 ASP 25 10.855 -6.469 9.521 192 HB3 ASP 25 HB2 ASP 25 11.604 -8.038 9.763 193 H ASP 26 H ASP 26 8.727 -7.879 6.772 194 HA ASP 26 HA ASP 26 7.446 -5.338 7.041 195 HB2 ASP 26 HB3 ASP 26 8.509 -6.379 4.931 196 HB3 ASP 26 HB2 ASP 26 6.987 -7.247 4.761 197 H LEU 27 H LEU 27 6.259 -8.661 6.594 198 HA LEU 27 HA LEU 27 3.523 -8.050 6.607 199 HB2 LEU 27 HB3 LEU 27 4.678 -10.597 7.708 200 HB3 LEU 27 HB2 LEU 27 3.131 -10.363 6.918 201 HG LEU 27 HG LEU 27 5.467 -9.720 5.245 202 HD11 LEU 27 HD11 LEU 27 6.483 -11.718 5.158 203 HD12 LEU 27 HD12 LEU 27 4.980 -12.610 5.391 204 HD13 LEU 27 HD13 LEU 27 5.822 -11.922 6.780 205 HD21 LEU 27 HD21 LEU 27 2.784 -10.965 4.994 206 HD22 LEU 27 HD22 LEU 27 4.012 -11.391 3.802 207 HD23 LEU 27 HD23 LEU 27 3.546 -9.705 4.023 208 H HIS 28 H HIS 28 5.585 -9.235 9.261 209 HA HIS 28 HA HIS 28 3.741 -9.235 11.305 210 HB2 HIS 28 HB3 HIS 28 6.668 -8.486 11.444 211 HB3 HIS 28 HB2 HIS 28 5.667 -8.881 12.837 212 HD1 HIS 28 HD1 HIS 28 8.242 -10.433 11.430 213 HD2 HIS 28 HD2 HIS 28 4.261 -11.603 11.648 214 HE1 HIS 28 HE1 HIS 28 8.261 -12.933 11.164 215 HE2 HIS 28 HE2 HIS 28 5.850 -13.628 11.393 216 H TYR 29 H TYR 29 5.829 -6.524 10.320 217 HA TYR 29 HA TYR 29 4.689 -4.694 12.180 218 HB2 TYR 29 HB3 TYR 29 6.969 -4.447 11.213 219 HB3 TYR 29 HB2 TYR 29 6.238 -4.090 9.652 220 HD1 TYR 29 HD1 TYR 29 5.401 -2.919 13.099 221 HD2 TYR 29 HD2 TYR 29 6.648 -1.863 9.171 222 HE1 TYR 29 HE1 TYR 29 5.282 -0.539 13.707 223 HE2 TYR 29 HE2 TYR 29 6.532 0.519 9.768 224 HH TYR 29 HH TYR 29 6.609 1.921 11.772 225 H PHE 30 H PHE 30 3.977 -5.617 8.888 226 HA PHE 30 HA PHE 30 2.370 -3.449 8.135 227 HB2 PHE 30 HB3 PHE 30 3.160 -5.106 6.525 228 HB3 PHE 30 HB2 PHE 30 2.194 -6.354 7.302 229 HD1 PHE 30 HD1 PHE 30 0.890 -2.964 6.844 230 HD2 PHE 30 HD2 PHE 30 1.042 -6.911 5.260 231 HE1 PHE 30 HE1 PHE 30 -0.989 -2.432 5.349 232 HE2 PHE 30 HE2 PHE 30 -0.837 -6.386 3.762 233 HZ PHE 30 HZ PHE 30 -1.855 -4.144 3.805 234 H ARG 31 H ARG 31 1.456 -6.571 9.583 235 HA ARG 31 HA ARG 31 -1.298 -5.870 9.835 236 HB2 ARG 31 HB3 ARG 31 -0.067 -8.221 9.817 237 HB3 ARG 31 HB2 ARG 31 -0.077 -7.975 11.558 238 HG2 ARG 31 HG3 ARG 31 -2.348 -8.159 11.714 239 HG3 ARG 31 HG2 ARG 31 -2.617 -7.594 10.064 240 HD2 ARG 31 HD3 ARG 31 -3.100 -9.821 9.826 241 HD3 ARG 31 HD2 ARG 31 -1.380 -9.821 9.437 242 HE ARG 31 HE ARG 31 -1.781 -10.252 12.208 243 HH11 ARG 31 HH11 ARG 31 -2.021 -11.851 9.116 244 HH12 ARG 31 HH12 ARG 31 -1.767 -13.433 9.773 245 HH21 ARG 31 HH21 ARG 31 -1.446 -12.332 13.075 246 HH22 ARG 31 HH22 ARG 31 -1.441 -13.706 12.021 247 H ALA 32 H ALA 32 1.513 -5.678 11.921 248 HA ALA 32 HA ALA 32 0.182 -5.173 14.349 249 HB1 ALA 32 HB1 ALA 32 2.919 -5.018 13.344 250 HB2 ALA 32 HB2 ALA 32 2.313 -5.559 14.908 251 HB3 ALA 32 HB3 ALA 32 2.559 -3.840 14.606 252 H GLN 33 H GLN 33 0.740 -3.186 11.586 253 HA GLN 33 HA GLN 33 0.119 -0.751 13.094 254 HB2 GLN 33 HB3 GLN 33 1.627 -1.346 10.668 255 HB3 GLN 33 HB2 GLN 33 0.507 -0.008 10.452 256 HG2 GLN 33 HG3 GLN 33 1.960 0.213 12.939 257 HG3 GLN 33 HG2 GLN 33 3.045 0.099 11.554 258 HE21 GLN 33 HE21 GLN 33 2.139 1.477 9.624 259 HE22 GLN 33 HE22 GLN 33 1.739 3.104 10.042 260 H THR 34 H THR 34 -1.137 -2.882 10.620 261 HA THR 34 HA THR 34 -3.395 -1.125 10.088 262 HB THR 34 HB THR 34 -4.064 -2.943 8.491 263 HG1 THR 34 HG1 THR 34 -1.523 -4.040 9.068 264 HG21 THR 34 HG21 THR 34 -1.299 -2.494 7.681 265 HG22 THR 34 HG22 THR 34 -2.170 -1.028 8.131 266 HG23 THR 34 HG23 THR 34 -2.808 -2.080 6.868 267 H VAL 35 H VAL 35 -3.093 -2.285 12.757 268 HA VAL 35 HA VAL 35 -5.232 -4.254 12.899 269 HB VAL 35 HB VAL 35 -4.673 -3.861 15.480 270 HG11 VAL 35 HG11 VAL 35 -4.260 -5.836 13.679 271 HG12 VAL 35 HG12 VAL 35 -3.806 -5.930 15.381 272 HG13 VAL 35 HG13 VAL 35 -2.604 -5.481 14.172 273 HG21 VAL 35 HG21 VAL 35 -2.404 -3.337 15.912 274 HG22 VAL 35 HG22 VAL 35 -3.024 -2.053 14.873 275 HG23 VAL 35 HG23 VAL 35 -2.009 -3.324 14.193 276 H GLY 36 H GLY 36 -7.259 -3.589 12.995 277 HA2 GLY 36 HA3 GLY 36 -9.121 -2.493 13.828 278 HA3 GLY 36 HA2 GLY 36 -8.064 -1.573 14.887 279 H LYS 37 H LYS 37 -7.220 -1.585 11.559 280 HA LYS 37 HA LYS 37 -8.396 1.103 11.260 281 HB2 LYS 37 HB3 LYS 37 -5.845 0.160 9.955 282 HB3 LYS 37 HB2 LYS 37 -6.473 1.800 10.025 283 HG2 LYS 37 HG3 LYS 37 -6.237 1.040 12.683 284 HG3 LYS 37 HG2 LYS 37 -4.800 0.379 11.902 285 HD2 LYS 37 HD3 LYS 37 -3.934 2.425 11.468 286 HD3 LYS 37 HD2 LYS 37 -5.516 3.146 11.165 287 HE2 LYS 37 HE3 LYS 37 -4.677 4.160 13.135 288 HE3 LYS 37 HE2 LYS 37 -5.922 3.022 13.647 289 HZ1 LYS 37 HZ1 LYS 37 -4.166 1.425 14.173 290 HZ2 LYS 37 HZ2 LYS 37 -3.993 2.853 15.063 291 HZ3 LYS 37 HZ3 LYS 37 -2.990 2.559 13.734 292 H ILE 38 H ILE 38 -7.907 1.585 8.639 293 HA ILE 38 HA ILE 38 -9.280 -0.609 7.228 294 HB ILE 38 HB ILE 38 -9.880 1.872 5.947 295 HG12 ILE 38 HG13 ILE 38 -10.860 1.826 8.802 296 HG13 ILE 38 HG12 ILE 38 -9.459 2.765 8.301 297 HG21 ILE 38 HG21 ILE 38 -12.118 1.117 6.107 298 HG22 ILE 38 HG22 ILE 38 -11.753 0.115 7.510 299 HG23 ILE 38 HG23 ILE 38 -11.115 -0.323 5.925 300 HD11 ILE 38 HD11 ILE 38 -10.994 4.382 8.052 301 HD12 ILE 38 HD12 ILE 38 -12.321 3.240 7.842 302 HD13 ILE 38 HD13 ILE 38 -11.250 3.607 6.489 303 H MET 39 H MET 39 -8.269 -1.325 5.474 304 HA MET 39 HA MET 39 -6.176 0.376 4.284 305 HB2 MET 39 HB3 MET 39 -5.179 -1.547 5.310 306 HB3 MET 39 HB2 MET 39 -6.344 -2.625 4.561 307 HG2 MET 39 HG3 MET 39 -5.282 -1.589 2.351 308 HG3 MET 39 HG2 MET 39 -3.913 -1.368 3.438 309 HE1 MET 39 HE1 MET 39 -6.655 -3.776 2.405 310 HE2 MET 39 HE2 MET 39 -6.362 -4.616 3.928 311 HE3 MET 39 HE3 MET 39 -5.902 -5.371 2.401 312 H VAL 40 H VAL 40 -6.342 0.906 2.200 313 HA VAL 40 HA VAL 40 -8.593 -0.146 0.667 314 HB VAL 40 HB VAL 40 -6.697 2.073 -0.104 315 HG11 VAL 40 HG11 VAL 40 -9.466 2.015 -1.095 316 HG12 VAL 40 HG12 VAL 40 -8.417 0.731 -1.695 317 HG13 VAL 40 HG13 VAL 40 -7.967 2.420 -1.931 318 HG21 VAL 40 HG21 VAL 40 -8.360 2.160 2.052 319 HG22 VAL 40 HG22 VAL 40 -9.400 2.792 0.777 320 HG23 VAL 40 HG23 VAL 40 -7.852 3.565 1.116 321 H VAL 41 H VAL 41 -8.395 -1.491 -1.025 322 HA VAL 41 HA VAL 41 -5.711 -1.934 -2.133 323 HB VAL 41 HB VAL 41 -6.841 -3.725 -0.448 324 HG11 VAL 41 HG11 VAL 41 -8.689 -4.092 -2.132 325 HG12 VAL 41 HG12 VAL 41 -7.847 -5.538 -1.573 326 HG13 VAL 41 HG13 VAL 41 -7.476 -4.859 -3.158 327 HG21 VAL 41 HG21 VAL 41 -5.351 -5.424 -1.721 328 HG22 VAL 41 HG22 VAL 41 -4.614 -4.007 -0.974 329 HG23 VAL 41 HG23 VAL 41 -4.919 -4.030 -2.710 330 H GLY 42 H GLY 42 -5.621 -2.623 -4.307 331 HA2 GLY 42 HA3 GLY 42 -7.769 -1.609 -5.925 332 HA3 GLY 42 HA2 GLY 42 -6.263 -2.304 -6.507 333 H ARG 43 H ARG 43 -8.294 -2.982 -7.983 334 HA ARG 43 HA ARG 43 -9.904 -5.124 -7.151 335 HB2 ARG 43 HB3 ARG 43 -10.408 -3.802 -9.137 336 HB3 ARG 43 HB2 ARG 43 -8.952 -4.394 -9.923 337 HG2 ARG 43 HG3 ARG 43 -10.123 -6.736 -9.404 338 HG3 ARG 43 HG2 ARG 43 -11.560 -5.718 -9.509 339 HD2 ARG 43 HD3 ARG 43 -9.434 -6.131 -11.602 340 HD3 ARG 43 HD2 ARG 43 -11.132 -6.598 -11.683 341 HE ARG 43 HE ARG 43 -10.626 -3.761 -11.373 342 HH11 ARG 43 HH11 ARG 43 -11.219 -6.394 -13.593 343 HH12 ARG 43 HH12 ARG 43 -11.783 -5.360 -14.861 344 HH21 ARG 43 HH21 ARG 43 -11.365 -2.406 -13.044 345 HH22 ARG 43 HH22 ARG 43 -11.865 -3.098 -14.551 346 H ARG 44 H ARG 44 -7.061 -5.277 -9.319 347 HA ARG 44 HA ARG 44 -6.832 -8.038 -9.389 348 HB2 ARG 44 HB3 ARG 44 -4.971 -5.777 -9.876 349 HB3 ARG 44 HB2 ARG 44 -4.253 -7.365 -9.659 350 HG2 ARG 44 HG3 ARG 44 -4.537 -7.237 -11.945 351 HG3 ARG 44 HG2 ARG 44 -5.965 -8.135 -11.426 352 HD2 ARG 44 HD3 ARG 44 -6.983 -6.611 -12.771 353 HD3 ARG 44 HD2 ARG 44 -6.974 -5.684 -11.271 354 HE ARG 44 HE ARG 44 -5.665 -4.169 -12.338 355 HH11 ARG 44 HH11 ARG 44 -5.137 -7.276 -13.843 356 HH12 ARG 44 HH12 ARG 44 -4.020 -6.658 -15.013 357 HH21 ARG 44 HH21 ARG 44 -4.197 -3.357 -13.878 358 HH22 ARG 44 HH22 ARG 44 -3.487 -4.434 -15.034 359 H THR 45 H THR 45 -6.078 -5.885 -6.810 360 HA THR 45 HA THR 45 -4.165 -7.523 -5.496 361 HB THR 45 HB THR 45 -5.582 -5.906 -3.615 362 HG1 THR 45 HG1 THR 45 -4.696 -4.265 -5.686 363 HG21 THR 45 HG21 THR 45 -3.462 -5.719 -3.012 364 HG22 THR 45 HG22 THR 45 -3.278 -4.541 -4.311 365 HG23 THR 45 HG23 THR 45 -2.893 -6.237 -4.598 366 H TYR 46 H TYR 46 -7.583 -6.832 -4.663 367 HA TYR 46 HA TYR 46 -7.904 -8.627 -2.626 368 HB2 TYR 46 HB3 TYR 46 -10.261 -8.567 -3.015 369 HB3 TYR 46 HB2 TYR 46 -9.628 -6.989 -3.462 370 HD1 TYR 46 HD2 TYR 46 -10.303 -10.294 -5.109 371 HD2 TYR 46 HD1 TYR 46 -10.497 -6.048 -5.386 372 HE1 TYR 46 HE2 TYR 46 -11.363 -10.493 -7.307 373 HE2 TYR 46 HE1 TYR 46 -11.576 -6.244 -7.584 374 HH TYR 46 HH TYR 46 -11.496 -8.315 -9.501 375 H GLU 47 H GLU 47 -7.846 -9.292 -6.063 376 HA GLU 47 HA GLU 47 -8.532 -12.089 -5.656 377 HB2 GLU 47 HB3 GLU 47 -7.829 -12.035 -8.238 378 HB3 GLU 47 HB2 GLU 47 -9.426 -11.560 -7.680 379 HG2 GLU 47 HG3 GLU 47 -8.907 -9.265 -7.867 380 HG3 GLU 47 HG2 GLU 47 -7.187 -9.597 -8.063 381 H SER 48 H SER 48 -5.735 -10.111 -6.169 382 HA SER 48 HA SER 48 -4.042 -12.506 -6.381 383 HB2 SER 48 HB3 SER 48 -3.901 -10.587 -8.093 384 HB3 SER 48 HB2 SER 48 -3.080 -9.688 -6.817 385 HG SER 48 HG SER 48 -1.981 -11.349 -8.471 386 H PHE 49 H PHE 49 -5.203 -11.620 -3.852 387 HA PHE 49 HA PHE 49 -2.757 -10.827 -2.415 388 HB2 PHE 49 HB3 PHE 49 -5.299 -9.722 -2.261 389 HB3 PHE 49 HB2 PHE 49 -5.210 -10.749 -0.837 390 HD1 PHE 49 HD1 PHE 49 -2.978 -8.355 -2.647 391 HD2 PHE 49 HD2 PHE 49 -4.517 -9.721 1.079 392 HE1 PHE 49 HE1 PHE 49 -1.679 -6.623 -1.480 393 HE2 PHE 49 HE2 PHE 49 -3.222 -7.989 2.252 394 HZ PHE 49 HZ PHE 49 -1.800 -6.438 0.973 395 HA PRO 50 HA PRO 50 -2.726 -14.919 -0.692 396 HB2 PRO 50 HB3 PRO 50 -0.918 -14.552 1.268 397 HB3 PRO 50 HB2 PRO 50 -0.459 -14.557 -0.439 398 HG2 PRO 50 HG3 PRO 50 -0.916 -12.235 1.393 399 HG3 PRO 50 HG2 PRO 50 0.371 -12.481 0.199 400 HD2 PRO 50 HD3 PRO 50 -1.837 -10.943 -0.264 401 HD3 PRO 50 HD2 PRO 50 -0.948 -11.787 -1.546 402 H LYS 51 H LYS 51 -3.393 -12.090 1.253 403 HA LYS 51 HA LYS 51 -4.942 -13.778 3.104 404 HB2 LYS 51 HB3 LYS 51 -2.723 -12.561 3.921 405 HB3 LYS 51 HB2 LYS 51 -3.814 -11.190 4.063 406 HG2 LYS 51 HG3 LYS 51 -3.700 -12.272 6.180 407 HG3 LYS 51 HG2 LYS 51 -5.291 -12.594 5.488 408 HD2 LYS 51 HD3 LYS 51 -4.868 -14.742 5.961 409 HD3 LYS 51 HD2 LYS 51 -3.802 -14.700 4.555 410 HE2 LYS 51 HE3 LYS 51 -1.941 -14.792 5.812 411 HE3 LYS 51 HE2 LYS 51 -2.593 -13.699 7.032 412 HZ1 LYS 51 HZ1 LYS 51 -2.609 -15.566 8.260 413 HZ2 LYS 51 HZ2 LYS 51 -2.652 -16.599 6.922 414 HZ3 LYS 51 HZ3 LYS 51 -4.074 -15.863 7.467 415 H ARG 52 H ARG 52 -6.676 -13.318 1.579 416 HA ARG 52 HA ARG 52 -7.817 -10.636 1.984 417 HB2 ARG 52 HB3 ARG 52 -9.034 -11.110 -0.218 418 HB3 ARG 52 HB2 ARG 52 -7.321 -10.723 -0.304 419 HG2 ARG 52 HG3 ARG 52 -6.974 -12.589 -1.436 420 HG3 ARG 52 HG2 ARG 52 -7.511 -13.523 -0.041 421 HD2 ARG 52 HD3 ARG 52 -9.792 -13.456 -0.808 422 HD3 ARG 52 HD2 ARG 52 -9.353 -12.382 -2.135 423 HE ARG 52 HE ARG 52 -7.803 -14.528 -2.597 424 HH11 ARG 52 HH11 ARG 52 -11.218 -14.205 -1.948 425 HH12 ARG 52 HH12 ARG 52 -11.651 -15.610 -2.862 426 HH21 ARG 52 HH21 ARG 52 -8.373 -16.375 -3.799 427 HH22 ARG 52 HH22 ARG 52 -10.037 -16.842 -3.913 428 HA PRO 53 HA PRO 53 -9.017 -9.708 2.929 429 HB2 PRO 53 HB3 PRO 53 -10.605 -9.140 4.997 430 HB3 PRO 53 HB2 PRO 53 -11.238 -9.212 3.349 431 HG2 PRO 53 HG3 PRO 53 -11.506 -11.171 5.568 432 HG3 PRO 53 HG2 PRO 53 -12.650 -10.767 4.277 433 HD2 PRO 53 HD3 PRO 53 -10.900 -12.978 4.346 434 HD3 PRO 53 HD2 PRO 53 -11.834 -12.412 2.949 435 H LEU 54 H LEU 54 -7.924 -8.639 4.708 436 HA LEU 54 HA LEU 54 -6.201 -10.373 6.145 437 HB2 LEU 54 HB3 LEU 54 -6.657 -7.403 6.196 438 HB3 LEU 54 HB2 LEU 54 -5.520 -8.175 7.286 439 HG LEU 54 HG LEU 54 -5.202 -8.805 4.411 440 HD11 LEU 54 HD11 LEU 54 -3.935 -6.277 5.228 441 HD12 LEU 54 HD12 LEU 54 -5.671 -6.203 4.926 442 HD13 LEU 54 HD13 LEU 54 -4.580 -6.774 3.664 443 HD21 LEU 54 HD21 LEU 54 -3.776 -9.450 6.533 444 HD22 LEU 54 HD22 LEU 54 -3.040 -7.876 6.229 445 HD23 LEU 54 HD23 LEU 54 -3.011 -9.119 4.978 446 HA PRO 55 HA PRO 55 -8.778 -11.005 9.706 447 HB2 PRO 55 HB3 PRO 55 -6.972 -12.186 11.320 448 HB3 PRO 55 HB2 PRO 55 -7.655 -13.004 9.909 449 HG2 PRO 55 HG3 PRO 55 -5.015 -11.623 10.203 450 HG3 PRO 55 HG2 PRO 55 -5.386 -13.172 9.424 451 HD2 PRO 55 HD3 PRO 55 -5.040 -10.854 8.039 452 HD3 PRO 55 HD2 PRO 55 -6.097 -12.167 7.484 453 H GLU 56 H GLU 56 -9.252 -10.066 11.624 454 HA GLU 56 HA GLU 56 -9.258 -8.541 13.299 455 HB2 GLU 56 HB3 GLU 56 -6.951 -9.931 13.585 456 HB3 GLU 56 HB2 GLU 56 -6.321 -8.296 13.440 457 HG2 GLU 56 HG3 GLU 56 -6.899 -7.817 15.520 458 HG3 GLU 56 HG2 GLU 56 -8.557 -8.348 15.242 459 H ARG 57 H ARG 57 -9.087 -7.594 10.496 460 HA ARG 57 HA ARG 57 -8.497 -4.834 11.150 461 HB2 ARG 57 HB3 ARG 57 -6.888 -4.414 9.504 462 HB3 ARG 57 HB2 ARG 57 -6.369 -5.922 10.234 463 HG2 ARG 57 HG3 ARG 57 -6.090 -6.378 8.008 464 HG3 ARG 57 HG2 ARG 57 -7.709 -7.015 8.289 465 HD2 ARG 57 HD3 ARG 57 -7.234 -5.497 6.218 466 HD3 ARG 57 HD2 ARG 57 -8.728 -5.311 7.130 467 HE ARG 57 HE ARG 57 -8.047 -3.220 7.751 468 HH11 ARG 57 HH11 ARG 57 -5.297 -4.975 6.514 469 HH12 ARG 57 HH12 ARG 57 -4.245 -3.600 6.554 470 HH21 ARG 57 HH21 ARG 57 -6.668 -1.414 7.809 471 HH22 ARG 57 HH22 ARG 57 -5.023 -1.577 7.291 472 H THR 58 H THR 58 -9.194 -3.332 9.400 473 HA THR 58 HA THR 58 -11.639 -4.367 8.169 474 HB THR 58 HB THR 58 -10.839 -1.473 8.201 475 HG1 THR 58 HG1 THR 58 -12.079 -2.873 10.332 476 HG21 THR 58 HG21 THR 58 -13.538 -2.768 8.488 477 HG22 THR 58 HG22 THR 58 -12.873 -2.150 6.975 478 HG23 THR 58 HG23 THR 58 -13.192 -1.047 8.314 479 H ASN 59 H ASN 59 -11.537 -4.992 6.120 480 HA ASN 59 HA ASN 59 -9.400 -3.988 4.413 481 HB2 ASN 59 HB3 ASN 59 -11.337 -6.280 4.171 482 HB3 ASN 59 HB2 ASN 59 -10.317 -5.775 2.827 483 HD21 ASN 59 HD21 ASN 59 -10.154 -6.689 6.236 484 HD22 ASN 59 HD22 ASN 59 -8.639 -7.509 6.126 485 H VAL 60 H VAL 60 -9.729 -3.155 2.353 486 HA VAL 60 HA VAL 60 -12.439 -2.302 1.646 487 HB VAL 60 HB VAL 60 -10.047 -0.461 1.812 488 HG11 VAL 60 HG11 VAL 60 -12.614 -0.224 0.330 489 HG12 VAL 60 HG12 VAL 60 -11.002 0.343 -0.104 490 HG13 VAL 60 HG13 VAL 60 -11.951 1.219 1.097 491 HG21 VAL 60 HG21 VAL 60 -12.312 -0.992 3.539 492 HG22 VAL 60 HG22 VAL 60 -12.221 0.706 3.069 493 HG23 VAL 60 HG23 VAL 60 -10.844 -0.067 3.854 494 H VAL 61 H VAL 61 -12.857 -2.632 -0.454 495 HA VAL 61 HA VAL 61 -10.593 -3.312 -2.203 496 HB VAL 61 HB VAL 61 -13.495 -4.126 -2.413 497 HG11 VAL 61 HG11 VAL 61 -11.373 -4.130 -4.365 498 HG12 VAL 61 HG12 VAL 61 -13.079 -4.539 -4.556 499 HG13 VAL 61 HG13 VAL 61 -11.930 -5.770 -4.034 500 HG21 VAL 61 HG21 VAL 61 -11.456 -6.197 -2.106 501 HG22 VAL 61 HG22 VAL 61 -13.007 -6.000 -1.290 502 HG23 VAL 61 HG23 VAL 61 -11.591 -5.118 -0.718 503 H LEU 62 H LEU 62 -10.368 -2.408 -4.199 504 HA LEU 62 HA LEU 62 -12.310 -0.341 -4.979 505 HB2 LEU 62 HB3 LEU 62 -10.070 0.476 -3.960 506 HB3 LEU 62 HB2 LEU 62 -9.371 -0.025 -5.489 507 HG LEU 62 HG LEU 62 -11.119 1.492 -6.594 508 HD11 LEU 62 HD11 LEU 62 -11.953 1.757 -3.928 509 HD12 LEU 62 HD12 LEU 62 -12.550 2.631 -5.340 510 HD13 LEU 62 HD13 LEU 62 -11.234 3.304 -4.377 511 HD21 LEU 62 HD21 LEU 62 -9.701 3.572 -5.773 512 HD22 LEU 62 HD22 LEU 62 -9.016 2.334 -6.826 513 HD23 LEU 62 HD23 LEU 62 -8.689 2.298 -5.093 514 H THR 63 H THR 63 -13.284 -1.413 -6.605 515 HA THR 63 HA THR 63 -11.602 -2.190 -8.885 516 HB THR 63 HB THR 63 -12.318 -4.241 -7.793 517 HG1 THR 63 HG1 THR 63 -12.435 -4.012 -10.158 518 HG21 THR 63 HG21 THR 63 -14.942 -2.893 -7.702 519 HG22 THR 63 HG22 THR 63 -14.199 -4.025 -6.571 520 HG23 THR 63 HG23 THR 63 -14.940 -4.621 -8.056 521 H HIS 64 H HIS 64 -12.612 -1.967 -10.956 522 HA HIS 64 HA HIS 64 -14.320 0.309 -11.128 523 HB2 HIS 64 HB3 HIS 64 -13.162 -1.594 -13.148 524 HB3 HIS 64 HB2 HIS 64 -14.336 -0.372 -13.626 525 HD1 HIS 64 HD1 HIS 64 -13.575 2.110 -13.518 526 HD2 HIS 64 HD2 HIS 64 -10.607 -0.638 -12.569 527 HE1 HIS 64 HE1 HIS 64 -11.420 3.404 -13.570 528 HE2 HIS 64 HE2 HIS 64 -9.629 1.701 -13.078 529 H GLN 65 H GLN 65 -14.801 -3.146 -11.296 530 HA GLN 65 HA GLN 65 -17.248 -3.352 -12.535 531 HB2 GLN 65 HB3 GLN 65 -15.919 -4.911 -10.358 532 HB3 GLN 65 HB2 GLN 65 -17.588 -5.279 -10.773 533 HG2 GLN 65 HG3 GLN 65 -16.993 -6.364 -12.616 534 HG3 GLN 65 HG2 GLN 65 -15.900 -5.075 -13.119 535 HE21 GLN 65 HE21 GLN 65 -13.888 -4.973 -11.596 536 HE22 GLN 65 HE22 GLN 65 -13.096 -6.489 -11.353 537 H GLU 66 H GLU 66 -19.265 -2.741 -12.092 538 HA GLU 66 HA GLU 66 -19.780 -1.247 -9.672 539 HB2 GLU 66 HB3 GLU 66 -22.037 -0.891 -10.709 540 HB3 GLU 66 HB2 GLU 66 -20.687 -0.327 -11.684 541 HG2 GLU 66 HG3 GLU 66 -21.095 -1.792 -13.334 542 HG3 GLU 66 HG2 GLU 66 -21.550 -3.081 -12.222 543 H ASP 67 H ASP 67 -20.614 -4.341 -11.065 544 HA ASP 67 HA ASP 67 -22.418 -4.940 -8.849 545 HB2 ASP 67 HB3 ASP 67 -21.776 -6.433 -11.395 546 HB3 ASP 67 HB2 ASP 67 -22.850 -7.053 -10.144 547 H TYR 68 H TYR 68 -19.370 -4.773 -8.675 548 HA TYR 68 HA TYR 68 -18.481 -7.447 -8.195 549 HB2 TYR 68 HB3 TYR 68 -16.902 -5.658 -8.780 550 HB3 TYR 68 HB2 TYR 68 -17.299 -4.812 -7.288 551 HD1 TYR 68 HD1 TYR 68 -16.142 -8.198 -8.382 552 HD2 TYR 68 HD2 TYR 68 -15.847 -5.067 -5.517 553 HE1 TYR 68 HE1 TYR 68 -14.373 -9.443 -7.212 554 HE2 TYR 68 HE2 TYR 68 -14.076 -6.303 -4.341 555 HH TYR 68 HH TYR 68 -13.344 -9.577 -5.041 556 H GLN 69 H GLN 69 -18.423 -8.601 -6.324 557 HA GLN 69 HA GLN 69 -19.585 -7.322 -3.937 558 HB2 GLN 69 HB3 GLN 69 -19.995 -10.134 -4.959 559 HB3 GLN 69 HB2 GLN 69 -20.516 -9.579 -3.374 560 HG2 GLN 69 HG3 GLN 69 -21.462 -8.533 -6.032 561 HG3 GLN 69 HG2 GLN 69 -22.364 -9.571 -4.929 562 HE21 GLN 69 HE21 GLN 69 -21.858 -6.449 -5.909 563 HE22 GLN 69 HE22 GLN 69 -22.534 -5.618 -4.553 564 H ALA 70 H ALA 70 -17.936 -7.003 -2.585 565 HA ALA 70 HA ALA 70 -15.940 -9.136 -2.250 566 HB1 ALA 70 HB1 ALA 70 -15.647 -6.369 -1.140 567 HB2 ALA 70 HB2 ALA 70 -15.291 -6.708 -2.833 568 HB3 ALA 70 HB3 ALA 70 -14.397 -7.539 -1.560 569 H GLN 71 H GLN 71 -16.920 -10.494 -0.806 570 HA GLN 71 HA GLN 71 -18.338 -9.589 1.488 571 HB2 GLN 71 HB3 GLN 71 -17.155 -12.322 0.970 572 HB3 GLN 71 HB2 GLN 71 -18.407 -11.929 2.141 573 HG2 GLN 71 HG3 GLN 71 -19.851 -12.532 0.567 574 HG3 GLN 71 HG2 GLN 71 -19.469 -10.995 -0.206 575 HE21 GLN 71 HE21 GLN 71 -20.283 -13.570 -1.356 576 HE22 GLN 71 HE22 GLN 71 -19.048 -13.989 -2.489 577 H GLY 72 H GLY 72 -17.579 -8.939 3.383 578 HA2 GLY 72 HA3 GLY 72 -16.181 -9.254 5.301 579 HA3 GLY 72 HA2 GLY 72 -14.927 -9.874 4.239 580 H ALA 73 H ALA 73 -15.401 -7.608 2.309 581 HA ALA 73 HA ALA 73 -14.191 -5.452 3.916 582 HB1 ALA 73 HB1 ALA 73 -12.668 -4.968 2.099 583 HB2 ALA 73 HB2 ALA 73 -13.376 -6.258 1.128 584 HB3 ALA 73 HB3 ALA 73 -12.489 -6.649 2.600 585 H VAL 74 H VAL 74 -14.208 -3.320 2.688 586 HA VAL 74 HA VAL 74 -16.920 -2.822 1.808 587 HB VAL 74 HB VAL 74 -14.718 -0.772 1.864 588 HG11 VAL 74 HG11 VAL 74 -17.129 -0.440 0.922 589 HG12 VAL 74 HG12 VAL 74 -16.396 0.803 1.935 590 HG13 VAL 74 HG13 VAL 74 -17.568 -0.319 2.626 591 HG21 VAL 74 HG21 VAL 74 -16.340 -1.788 4.195 592 HG22 VAL 74 HG22 VAL 74 -15.413 -0.288 4.208 593 HG23 VAL 74 HG23 VAL 74 -14.586 -1.833 4.012 594 H VAL 75 H VAL 75 -17.573 -2.237 -0.219 595 HA VAL 75 HA VAL 75 -15.536 -2.458 -2.335 596 HB VAL 75 HB VAL 75 -18.494 -3.007 -2.577 597 HG11 VAL 75 HG11 VAL 75 -16.220 -3.004 -4.493 598 HG12 VAL 75 HG12 VAL 75 -17.901 -2.523 -4.730 599 HG13 VAL 75 HG13 VAL 75 -17.471 -4.233 -4.682 600 HG21 VAL 75 HG21 VAL 75 -16.661 -4.570 -1.275 601 HG22 VAL 75 HG22 VAL 75 -16.632 -5.235 -2.908 602 HG23 VAL 75 HG23 VAL 75 -18.153 -5.148 -2.018 603 H VAL 76 H VAL 76 -15.285 -0.909 -3.792 604 HA VAL 76 HA VAL 76 -17.297 1.071 -4.345 605 HB VAL 76 HB VAL 76 -15.977 3.028 -3.763 606 HG11 VAL 76 HG11 VAL 76 -17.538 1.979 -2.101 607 HG12 VAL 76 HG12 VAL 76 -16.283 3.006 -1.407 608 HG13 VAL 76 HG13 VAL 76 -16.125 1.251 -1.338 609 HG21 VAL 76 HG21 VAL 76 -13.857 1.126 -3.524 610 HG22 VAL 76 HG22 VAL 76 -14.021 2.007 -2.004 611 HG23 VAL 76 HG23 VAL 76 -13.778 2.888 -3.514 612 H HIS 77 H HIS 77 -16.539 2.569 -6.108 613 HA HIS 77 HA HIS 77 -14.369 1.334 -7.670 614 HB2 HIS 77 HB3 HIS 77 -16.611 2.479 -9.216 615 HB3 HIS 77 HB2 HIS 77 -15.653 1.032 -9.516 616 HD1 HIS 77 HD1 HIS 77 -16.255 -0.870 -7.425 617 HD2 HIS 77 HD2 HIS 77 -19.170 1.776 -8.753 618 HE1 HIS 77 HE1 HIS 77 -18.450 -1.904 -6.767 619 HE2 HIS 77 HE2 HIS 77 -20.203 -0.327 -7.657 620 H ASP 78 H ASP 78 -15.672 4.217 -6.417 621 HA ASP 78 HA ASP 78 -14.029 5.787 -8.284 622 HB2 ASP 78 HB3 ASP 78 -16.673 6.122 -7.844 623 HB3 ASP 78 HB2 ASP 78 -16.022 7.191 -6.605 624 H VAL 79 H VAL 79 -12.813 7.548 -7.447 625 HA VAL 79 HA VAL 79 -11.503 6.962 -5.007 626 HB VAL 79 HB VAL 79 -10.444 9.267 -5.445 627 HG11 VAL 79 HG11 VAL 79 -8.822 8.296 -6.783 628 HG12 VAL 79 HG12 VAL 79 -10.000 7.338 -7.680 629 HG13 VAL 79 HG13 VAL 79 -9.589 6.902 -6.021 630 HG21 VAL 79 HG21 VAL 79 -12.331 9.942 -7.000 631 HG22 VAL 79 HG22 VAL 79 -11.587 8.875 -8.190 632 HG23 VAL 79 HG23 VAL 79 -10.691 10.257 -7.562 633 H ALA 80 H ALA 80 -13.868 9.365 -6.013 634 HA ALA 80 HA ALA 80 -13.836 10.830 -3.574 635 HB1 ALA 80 HB1 ALA 80 -15.056 11.088 -6.107 636 HB2 ALA 80 HB2 ALA 80 -15.023 12.260 -4.790 637 HB3 ALA 80 HB3 ALA 80 -16.348 11.102 -4.907 638 H ALA 81 H ALA 81 -15.798 8.183 -4.841 639 HA ALA 81 HA ALA 81 -17.796 8.087 -2.918 640 HB1 ALA 81 HB1 ALA 81 -16.717 5.481 -3.801 641 HB2 ALA 81 HB2 ALA 81 -17.210 6.595 -5.077 642 HB3 ALA 81 HB3 ALA 81 -18.369 6.101 -3.843 643 H VAL 82 H VAL 82 -14.915 5.987 -2.948 644 HA VAL 82 HA VAL 82 -15.119 4.955 -0.420 645 HB VAL 82 HB VAL 82 -13.431 4.428 -2.302 646 HG11 VAL 82 HG11 VAL 82 -11.427 5.520 -2.424 647 HG12 VAL 82 HG12 VAL 82 -11.508 6.085 -0.755 648 HG13 VAL 82 HG13 VAL 82 -12.489 6.861 -1.997 649 HG21 VAL 82 HG21 VAL 82 -13.615 3.306 -0.067 650 HG22 VAL 82 HG22 VAL 82 -12.358 4.401 0.507 651 HG23 VAL 82 HG23 VAL 82 -12.010 3.265 -0.796 652 H PHE 83 H PHE 83 -13.829 8.105 -1.368 653 HA PHE 83 HA PHE 83 -12.568 8.762 1.041 654 HB2 PHE 83 HB3 PHE 83 -13.368 10.144 -1.372 655 HB3 PHE 83 HB2 PHE 83 -13.633 11.158 0.044 656 HD1 PHE 83 HD2 PHE 83 -11.543 10.821 1.816 657 HD2 PHE 83 HD1 PHE 83 -11.385 10.541 -2.427 658 HE1 PHE 83 HE2 PHE 83 -9.146 11.372 1.874 659 HE2 PHE 83 HE1 PHE 83 -8.985 11.090 -2.377 660 HZ PHE 83 HZ PHE 83 -7.864 11.506 -0.223 661 H ALA 84 H ALA 84 -15.945 9.099 0.044 662 HA ALA 84 HA ALA 84 -16.837 10.581 2.260 663 HB1 ALA 84 HB1 ALA 84 -18.341 8.564 0.588 664 HB2 ALA 84 HB2 ALA 84 -18.222 10.297 0.281 665 HB3 ALA 84 HB3 ALA 84 -19.077 9.711 1.709 666 H TYR 85 H TYR 85 -16.482 7.134 1.700 667 HA TYR 85 HA TYR 85 -17.618 6.219 4.099 668 HB2 TYR 85 HB3 TYR 85 -17.126 4.219 3.210 669 HB3 TYR 85 HB2 TYR 85 -16.297 5.047 1.901 670 HD1 TYR 85 HD1 TYR 85 -15.640 3.925 5.416 671 HD2 TYR 85 HD2 TYR 85 -14.117 4.455 1.483 672 HE1 TYR 85 HE1 TYR 85 -13.521 2.881 6.101 673 HE2 TYR 85 HE2 TYR 85 -11.994 3.414 2.155 674 HH TYR 85 HH TYR 85 -11.013 2.114 3.782 675 H ALA 86 H ALA 86 -14.139 6.618 3.343 676 HA ALA 86 HA ALA 86 -13.052 6.256 5.796 677 HB1 ALA 86 HB1 ALA 86 -12.310 8.001 3.512 678 HB2 ALA 86 HB2 ALA 86 -11.445 6.639 4.223 679 HB3 ALA 86 HB3 ALA 86 -11.438 8.206 5.031 680 H LYS 87 H LYS 87 -14.819 9.094 4.722 681 HA LYS 87 HA LYS 87 -14.155 10.733 6.954 682 HB2 LYS 87 HB3 LYS 87 -15.528 11.090 4.572 683 HB3 LYS 87 HB2 LYS 87 -16.795 11.214 5.783 684 HG2 LYS 87 HG3 LYS 87 -16.202 13.356 5.926 685 HG3 LYS 87 HG2 LYS 87 -14.820 12.771 6.855 686 HD2 LYS 87 HD3 LYS 87 -13.708 13.987 5.279 687 HD3 LYS 87 HD2 LYS 87 -13.805 12.446 4.425 688 HE2 LYS 87 HE3 LYS 87 -16.106 14.250 4.070 689 HE3 LYS 87 HE2 LYS 87 -14.585 14.813 3.380 690 HZ1 LYS 87 HZ1 LYS 87 -14.610 13.224 1.813 691 HZ2 LYS 87 HZ2 LYS 87 -16.272 13.182 2.120 692 HZ3 LYS 87 HZ3 LYS 87 -15.251 12.043 2.841 693 H GLN 88 H GLN 88 -16.872 8.653 6.144 694 HA GLN 88 HA GLN 88 -18.399 9.023 8.458 695 HB2 GLN 88 HB3 GLN 88 -18.905 7.754 6.211 696 HB3 GLN 88 HB2 GLN 88 -18.322 6.356 7.104 697 HG2 GLN 88 HG3 GLN 88 -20.524 6.194 7.593 698 HG3 GLN 88 HG2 GLN 88 -20.034 7.261 8.909 699 HE21 GLN 88 HE21 GLN 88 -20.761 7.737 5.466 700 HE22 GLN 88 HE22 GLN 88 -21.923 8.992 5.710 701 H HIS 89 H HIS 89 -15.446 7.342 7.998 702 HA HIS 89 HA HIS 89 -15.767 5.955 10.571 703 HB2 HIS 89 HB3 HIS 89 -14.278 5.331 8.077 704 HB3 HIS 89 HB2 HIS 89 -13.526 4.854 9.597 705 HD1 HIS 89 HD1 HIS 89 -16.053 3.950 11.127 706 HD2 HIS 89 HD2 HIS 89 -15.193 2.921 7.194 707 HE1 HIS 89 HE1 HIS 89 -17.341 1.835 10.689 708 HE2 HIS 89 HE2 HIS 89 -16.872 1.278 8.277 709 HA PRO 90 HA PRO 90 -12.761 9.409 11.377 710 HB2 PRO 90 HB3 PRO 90 -13.907 10.336 13.627 711 HB3 PRO 90 HB2 PRO 90 -14.475 10.815 12.023 712 HG2 PRO 90 HG3 PRO 90 -15.594 8.757 13.890 713 HG3 PRO 90 HG2 PRO 90 -16.450 9.980 12.933 714 HD2 PRO 90 HD3 PRO 90 -16.229 7.374 12.169 715 HD3 PRO 90 HD2 PRO 90 -16.368 8.717 11.017 716 H ASP 91 H ASP 91 -13.650 6.510 12.802 717 HA ASP 91 HA ASP 91 -11.750 6.792 15.020 718 HB2 ASP 91 HB3 ASP 91 -14.208 5.811 15.169 719 HB3 ASP 91 HB2 ASP 91 -13.400 4.335 14.651 720 H GLN 92 H GLN 92 -11.505 6.035 11.911 721 HA GLN 92 HA GLN 92 -9.447 3.997 12.416 722 HB2 GLN 92 HB3 GLN 92 -11.253 4.029 9.995 723 HB3 GLN 92 HB2 GLN 92 -10.040 2.820 10.394 724 HG2 GLN 92 HG3 GLN 92 -11.338 2.184 12.371 725 HG3 GLN 92 HG2 GLN 92 -12.562 3.376 11.939 726 HE21 GLN 92 HE21 GLN 92 -11.491 0.205 11.551 727 HE22 GLN 92 HE22 GLN 92 -12.584 -0.278 10.303 728 H GLU 93 H GLU 93 -7.997 3.783 10.384 729 HA GLU 93 HA GLU 93 -7.438 6.483 9.342 730 HB2 GLU 93 HB3 GLU 93 -5.834 5.171 11.077 731 HB3 GLU 93 HB2 GLU 93 -5.191 4.570 9.556 732 HG2 GLU 93 HG3 GLU 93 -5.177 7.099 8.903 733 HG3 GLU 93 HG2 GLU 93 -5.199 7.338 10.650 734 H LEU 94 H LEU 94 -6.230 6.510 7.285 735 HA LEU 94 HA LEU 94 -7.196 4.367 5.532 736 HB2 LEU 94 HB3 LEU 94 -6.717 7.256 5.231 737 HB3 LEU 94 HB2 LEU 94 -6.224 6.286 3.856 738 HG LEU 94 HG LEU 94 -8.929 5.727 4.908 739 HD11 LEU 94 HD11 LEU 94 -8.084 8.411 4.037 740 HD12 LEU 94 HD12 LEU 94 -9.449 7.916 5.037 741 HD13 LEU 94 HD13 LEU 94 -9.548 7.782 3.282 742 HD21 LEU 94 HD21 LEU 94 -9.307 5.021 2.800 743 HD22 LEU 94 HD22 LEU 94 -7.546 4.967 2.725 744 HD23 LEU 94 HD23 LEU 94 -8.414 6.358 2.077 745 H VAL 95 H VAL 95 -5.830 2.920 4.727 746 HA VAL 95 HA VAL 95 -2.998 3.636 4.426 747 HB VAL 95 HB VAL 95 -3.904 0.983 5.542 748 HG11 VAL 95 HG11 VAL 95 -1.313 2.151 4.735 749 HG12 VAL 95 HG12 VAL 95 -1.859 0.475 4.716 750 HG13 VAL 95 HG13 VAL 95 -1.323 1.210 6.227 751 HG21 VAL 95 HG21 VAL 95 -4.308 2.979 7.054 752 HG22 VAL 95 HG22 VAL 95 -2.556 3.177 7.096 753 HG23 VAL 95 HG23 VAL 95 -3.291 1.695 7.707 754 H ILE 96 H ILE 96 -2.562 3.454 2.330 755 HA ILE 96 HA ILE 96 -4.036 1.577 0.668 756 HB ILE 96 HB ILE 96 -1.829 3.404 -0.258 757 HG12 ILE 96 HG13 ILE 96 -3.380 4.835 0.906 758 HG13 ILE 96 HG12 ILE 96 -3.649 5.029 -0.823 759 HG21 ILE 96 HG21 ILE 96 -2.977 1.474 -1.633 760 HG22 ILE 96 HG22 ILE 96 -2.581 3.021 -2.381 761 HG23 ILE 96 HG23 ILE 96 -4.232 2.692 -1.856 762 HD11 ILE 96 HD11 ILE 96 -5.700 4.887 0.634 763 HD12 ILE 96 HD12 ILE 96 -5.302 3.184 0.868 764 HD13 ILE 96 HD13 ILE 96 -5.647 3.795 -0.751 765 H ALA 97 H ALA 97 -3.264 -0.304 -0.097 766 HA ALA 97 HA ALA 97 -0.444 -0.946 0.470 767 HB1 ALA 97 HB1 ALA 97 -1.023 -2.952 1.298 768 HB2 ALA 97 HB2 ALA 97 -2.294 -3.196 0.099 769 HB3 ALA 97 HB3 ALA 97 -2.602 -2.199 1.520 770 H GLY 98 H GLY 98 -3.019 -1.062 -1.900 771 HA2 GLY 98 HA3 GLY 98 -1.325 -1.043 -4.111 772 HA3 GLY 98 HA2 GLY 98 -1.709 -2.726 -3.785 773 H GLY 99 H GLY 99 -4.189 -1.726 -6.231 774 HA2 GLY 99 HA3 GLY 99 -1.416 -2.402 -5.845 775 HA3 GLY 99 HA2 GLY 99 -2.313 -2.442 -7.352 776 H ALA 100 H ALA 100 -0.610 -1.492 -8.477 777 HA ALA 100 HA ALA 100 0.663 0.906 -7.760 778 HB1 ALA 100 HB1 ALA 100 1.505 -0.738 -9.422 779 HB2 ALA 100 HB2 ALA 100 1.547 0.933 -9.985 780 HB3 ALA 100 HB3 ALA 100 0.282 -0.158 -10.552 781 H GLN 101 H GLN 101 -2.226 0.298 -9.733 782 HA GLN 101 HA GLN 101 -2.496 3.012 -10.557 783 HB2 GLN 101 HB3 GLN 101 -3.709 0.550 -11.174 784 HB3 GLN 101 HB2 GLN 101 -5.001 1.599 -10.603 785 HG2 GLN 101 HG3 GLN 101 -3.428 3.144 -12.333 786 HG3 GLN 101 HG2 GLN 101 -3.642 1.580 -13.115 787 HE21 GLN 101 HE21 GLN 101 -5.571 3.912 -11.256 788 HE22 GLN 101 HE22 GLN 101 -6.960 3.839 -12.280 789 H ILE 102 H ILE 102 -3.451 1.224 -7.748 790 HA ILE 102 HA ILE 102 -5.525 2.971 -6.885 791 HB ILE 102 HB ILE 102 -3.795 1.114 -5.243 792 HG12 ILE 102 HG13 ILE 102 -5.068 0.020 -7.086 793 HG13 ILE 102 HG12 ILE 102 -5.577 -0.503 -5.484 794 HG21 ILE 102 HG21 ILE 102 -4.927 1.722 -3.425 795 HG22 ILE 102 HG22 ILE 102 -6.475 1.593 -4.258 796 HG23 ILE 102 HG23 ILE 102 -5.542 3.085 -4.359 797 HD11 ILE 102 HD11 ILE 102 -7.396 -0.050 -7.181 798 HD12 ILE 102 HD12 ILE 102 -7.008 1.659 -6.986 799 HD13 ILE 102 HD13 ILE 102 -7.571 0.720 -5.605 800 H PHE 103 H PHE 103 -2.081 2.674 -6.061 801 HA PHE 103 HA PHE 103 -1.976 4.780 -4.213 802 HB2 PHE 103 HB3 PHE 103 0.125 3.579 -6.019 803 HB3 PHE 103 HB2 PHE 103 0.491 4.839 -4.846 804 HD1 PHE 103 HD1 PHE 103 -0.339 4.323 -2.395 805 HD2 PHE 103 HD2 PHE 103 0.383 1.388 -5.390 806 HE1 PHE 103 HE1 PHE 103 -0.049 2.617 -0.647 807 HE2 PHE 103 HE2 PHE 103 0.673 -0.325 -3.647 808 HZ PHE 103 HZ PHE 103 0.457 0.290 -1.272 809 H THR 104 H THR 104 -1.886 4.716 -7.704 810 HA THR 104 HA THR 104 -0.888 7.291 -8.185 811 HB THR 104 HB THR 104 -2.816 5.644 -9.829 812 HG1 THR 104 HG1 THR 104 -0.014 5.939 -10.097 813 HG21 THR 104 HG21 THR 104 -1.168 7.197 -11.480 814 HG22 THR 104 HG22 THR 104 -1.849 8.292 -10.277 815 HG23 THR 104 HG23 THR 104 -2.917 7.306 -11.277 816 H ALA 105 H ALA 105 -4.279 6.172 -8.003 817 HA ALA 105 HA ALA 105 -5.519 8.607 -8.469 818 HB1 ALA 105 HB1 ALA 105 -6.393 6.099 -7.909 819 HB2 ALA 105 HB2 ALA 105 -7.428 7.524 -7.990 820 HB3 ALA 105 HB3 ALA 105 -6.833 6.955 -6.431 821 H PHE 106 H PHE 106 -4.867 7.198 -5.229 822 HA PHE 106 HA PHE 106 -5.523 9.623 -3.918 823 HB2 PHE 106 HB3 PHE 106 -4.024 7.191 -2.925 824 HB3 PHE 106 HB2 PHE 106 -4.630 8.492 -1.906 825 HD1 PHE 106 HD2 PHE 106 -5.621 5.728 -4.137 826 HD2 PHE 106 HD1 PHE 106 -6.897 8.567 -1.236 827 HE1 PHE 106 HE2 PHE 106 -7.777 4.556 -3.947 828 HE2 PHE 106 HE1 PHE 106 -9.054 7.399 -1.038 829 HZ PHE 106 HZ PHE 106 -9.494 5.391 -2.397 830 H LYS 107 H LYS 107 -2.735 8.612 -5.594 831 HA LYS 107 HA LYS 107 -0.587 9.575 -4.227 832 HB2 LYS 107 HB3 LYS 107 0.547 9.546 -6.207 833 HB3 LYS 107 HB2 LYS 107 -0.888 8.673 -6.717 834 HG2 LYS 107 HG3 LYS 107 -1.809 10.874 -7.523 835 HG3 LYS 107 HG2 LYS 107 -0.210 11.557 -7.224 836 HD2 LYS 107 HD3 LYS 107 0.780 10.307 -8.906 837 HD3 LYS 107 HD2 LYS 107 -0.497 9.090 -8.891 838 HE2 LYS 107 HE3 LYS 107 -1.857 10.301 -10.247 839 HE3 LYS 107 HE2 LYS 107 -1.288 11.846 -9.617 840 HZ1 LYS 107 HZ1 LYS 107 0.339 11.969 -11.145 841 HZ2 LYS 107 HZ2 LYS 107 -0.648 10.912 -12.022 842 HZ3 LYS 107 HZ3 LYS 107 0.654 10.306 -11.129 843 H ASP 108 H ASP 108 -3.034 11.456 -5.892 844 HA ASP 108 HA ASP 108 -1.702 13.967 -5.279 845 HB2 ASP 108 HB3 ASP 108 -3.283 13.228 -7.362 846 HB3 ASP 108 HB2 ASP 108 -4.467 14.017 -6.324 847 H ASP 109 H ASP 109 -4.535 12.116 -4.311 848 HA ASP 109 HA ASP 109 -5.377 14.150 -2.415 849 HB2 ASP 109 HB3 ASP 109 -6.510 11.647 -3.514 850 HB3 ASP 109 HB2 ASP 109 -6.988 12.055 -1.870 851 H VAL 110 H VAL 110 -2.879 12.175 -2.243 852 HA VAL 110 HA VAL 110 -3.378 10.922 0.317 853 HB VAL 110 HB VAL 110 -2.008 9.796 -1.392 854 HG11 VAL 110 HG11 VAL 110 -0.882 12.188 -1.882 855 HG12 VAL 110 HG12 VAL 110 -0.144 10.651 -2.331 856 HG13 VAL 110 HG13 VAL 110 0.356 11.470 -0.852 857 HG21 VAL 110 HG21 VAL 110 -0.483 8.861 0.097 858 HG22 VAL 110 HG22 VAL 110 -1.733 9.517 1.154 859 HG23 VAL 110 HG23 VAL 110 -0.216 10.390 0.934 860 H ASP 111 H ASP 111 -1.950 11.233 2.163 861 HA ASP 111 HA ASP 111 -0.914 13.982 2.359 862 HB2 ASP 111 HB3 ASP 111 -2.756 12.485 4.164 863 HB3 ASP 111 HB2 ASP 111 -1.597 13.591 4.895 864 H THR 112 H THR 112 -0.694 10.661 3.601 865 HA THR 112 HA THR 112 2.054 11.271 4.461 866 HB THR 112 HB THR 112 0.345 9.024 5.522 867 HG1 THR 112 HG1 THR 112 -0.245 10.327 7.158 868 HG21 THR 112 HG21 THR 112 2.810 10.317 6.669 869 HG22 THR 112 HG22 THR 112 2.759 8.751 5.861 870 HG23 THR 112 HG23 THR 112 1.890 8.990 7.377 871 H LEU 113 H LEU 113 3.635 9.551 4.244 872 HA LEU 113 HA LEU 113 2.987 7.515 2.241 873 HB2 LEU 113 HB3 LEU 113 4.336 9.855 1.635 874 HB3 LEU 113 HB2 LEU 113 5.625 8.691 1.863 875 HG LEU 113 HG LEU 113 4.721 7.270 0.129 876 HD11 LEU 113 HD11 LEU 113 2.706 9.060 -0.913 877 HD12 LEU 113 HD12 LEU 113 2.300 8.510 0.711 878 HD13 LEU 113 HD13 LEU 113 2.610 7.335 -0.565 879 HD21 LEU 113 HD21 LEU 113 4.609 9.252 -1.695 880 HD22 LEU 113 HD22 LEU 113 6.108 8.650 -0.986 881 HD23 LEU 113 HD23 LEU 113 5.348 10.105 -0.340 882 H LEU 114 H LEU 114 3.895 5.588 2.626 883 HA LEU 114 HA LEU 114 6.202 5.409 4.429 884 HB2 LEU 114 HB3 LEU 114 3.707 3.717 4.660 885 HB3 LEU 114 HB2 LEU 114 5.180 3.485 5.580 886 HG LEU 114 HG LEU 114 3.615 6.049 5.724 887 HD11 LEU 114 HD11 LEU 114 3.327 4.071 7.891 888 HD12 LEU 114 HD12 LEU 114 2.464 3.717 6.394 889 HD13 LEU 114 HD13 LEU 114 2.166 5.231 7.247 890 HD21 LEU 114 HD21 LEU 114 4.788 5.688 8.121 891 HD22 LEU 114 HD22 LEU 114 5.539 6.557 6.783 892 HD23 LEU 114 HD23 LEU 114 5.949 4.867 7.078 893 H VAL 115 H VAL 115 7.721 4.592 3.126 894 HA VAL 115 HA VAL 115 6.965 2.291 1.438 895 HB VAL 115 HB VAL 115 8.668 2.999 -0.184 896 HG11 VAL 115 HG11 VAL 115 6.749 5.251 0.367 897 HG12 VAL 115 HG12 VAL 115 6.265 3.706 -0.332 898 HG13 VAL 115 HG13 VAL 115 7.404 4.744 -1.190 899 HG21 VAL 115 HG21 VAL 115 8.880 5.719 0.913 900 HG22 VAL 115 HG22 VAL 115 10.091 4.719 0.111 901 HG23 VAL 115 HG23 VAL 115 9.737 4.473 1.821 902 H THR 116 H THR 116 8.407 0.630 1.174 903 HA THR 116 HA THR 116 10.684 0.580 3.045 904 HB THR 116 HB THR 116 8.835 -1.652 2.172 905 HG1 THR 116 HG1 THR 116 8.356 -1.738 4.364 906 HG21 THR 116 HG21 THR 116 10.123 -3.074 3.757 907 HG22 THR 116 HG22 THR 116 11.365 -1.823 3.784 908 HG23 THR 116 HG23 THR 116 10.985 -2.657 2.276 909 H ARG 117 H ARG 117 12.327 1.132 1.685 910 HA ARG 117 HA ARG 117 12.501 -0.058 -0.954 911 HB2 ARG 117 HB3 ARG 117 13.142 2.383 -0.169 912 HB3 ARG 117 HB2 ARG 117 14.685 1.620 0.190 913 HG2 ARG 117 HG3 ARG 117 15.274 1.694 -1.941 914 HG3 ARG 117 HG2 ARG 117 13.812 0.828 -2.418 915 HD2 ARG 117 HD3 ARG 117 13.607 2.822 -3.573 916 HD3 ARG 117 HD2 ARG 117 12.653 3.127 -2.122 917 HE ARG 117 HE ARG 117 15.390 3.946 -1.869 918 HH11 ARG 117 HH11 ARG 117 12.234 4.893 -3.018 919 HH12 ARG 117 HH12 ARG 117 12.562 6.589 -2.900 920 HH21 ARG 117 HH21 ARG 117 15.823 6.177 -1.713 921 HH22 ARG 117 HH22 ARG 117 14.599 7.318 -2.160 922 H LEU 118 H LEU 118 13.184 -2.096 -1.033 923 HA LEU 118 HA LEU 118 14.920 -3.291 0.860 924 HB2 LEU 118 HB3 LEU 118 13.678 -4.068 -1.714 925 HB3 LEU 118 HB2 LEU 118 15.130 -4.942 -1.263 926 HG LEU 118 HG LEU 118 14.033 -5.516 0.911 927 HD11 LEU 118 HD11 LEU 118 12.306 -4.176 1.429 928 HD12 LEU 118 HD12 LEU 118 11.373 -5.319 0.464 929 HD13 LEU 118 HD13 LEU 118 11.943 -3.814 -0.258 930 HD21 LEU 118 HD21 LEU 118 13.238 -7.417 0.015 931 HD22 LEU 118 HD22 LEU 118 13.872 -6.751 -1.490 932 HD23 LEU 118 HD23 LEU 118 12.163 -6.568 -1.096 933 H ALA 119 H ALA 119 16.999 -4.411 0.110 934 HA ALA 119 HA ALA 119 18.713 -2.362 -1.052 935 HB1 ALA 119 HB1 ALA 119 19.041 -4.470 0.883 936 HB2 ALA 119 HB2 ALA 119 20.073 -3.079 0.553 937 HB3 ALA 119 HB3 ALA 119 20.282 -4.570 -0.366 938 H GLY 120 H GLY 120 17.783 -5.729 -1.610 939 HA2 GLY 120 HA3 GLY 120 19.484 -6.161 -3.828 940 HA3 GLY 120 HA2 GLY 120 18.062 -7.108 -3.422 941 H SER 121 H SER 121 19.084 -6.188 -6.017 942 HA SER 121 HA SER 121 16.940 -4.386 -6.888 943 HB2 SER 121 HB3 SER 121 19.598 -5.168 -8.043 944 HB3 SER 121 HB2 SER 121 18.336 -4.538 -9.101 945 HG SER 121 HG SER 121 18.763 -2.624 -8.376 946 H PHE 122 H PHE 122 15.138 -5.357 -7.535 947 HA PHE 122 HA PHE 122 15.340 -7.978 -8.855 948 HB2 PHE 122 HB3 PHE 122 12.982 -6.704 -7.452 949 HB3 PHE 122 HB2 PHE 122 12.972 -8.287 -8.222 950 HD1 PHE 122 HD2 PHE 122 14.544 -6.325 -5.502 951 HD2 PHE 122 HD1 PHE 122 13.678 -10.188 -7.062 952 HE1 PHE 122 HE2 PHE 122 15.321 -7.343 -3.401 953 HE2 PHE 122 HE1 PHE 122 14.452 -11.214 -4.964 954 HZ PHE 122 HZ PHE 122 15.275 -9.791 -3.130 955 H GLU 123 H GLU 123 13.690 -8.418 -10.536 956 HA GLU 123 HA GLU 123 12.988 -6.002 -12.063 957 HB2 GLU 123 HB3 GLU 123 13.610 -7.102 -14.131 958 HB3 GLU 123 HB2 GLU 123 14.987 -7.084 -13.037 959 HG2 GLU 123 HG3 GLU 123 13.741 -9.480 -12.473 960 HG3 GLU 123 HG2 GLU 123 13.577 -9.322 -14.221 961 H GLY 124 H GLY 124 10.977 -5.960 -12.916 962 HA2 GLY 124 HA3 GLY 124 9.454 -8.411 -13.244 963 HA3 GLY 124 HA2 GLY 124 8.866 -7.329 -11.990 964 H ASP 125 H ASP 125 6.922 -6.911 -13.038 965 HA ASP 125 HA ASP 125 7.173 -5.143 -15.372 966 HB2 ASP 125 HB3 ASP 125 5.516 -7.592 -15.070 967 HB3 ASP 125 HB2 ASP 125 4.776 -6.221 -15.890 968 H THR 126 H THR 126 6.797 -4.717 -12.428 969 HA THR 126 HA THR 126 4.580 -2.852 -12.676 970 HB THR 126 HB THR 126 4.664 -4.699 -10.299 971 HG1 THR 126 HG1 THR 126 4.275 -5.927 -12.195 972 HG21 THR 126 HG21 THR 126 2.062 -3.836 -10.969 973 HG22 THR 126 HG22 THR 126 3.113 -2.420 -10.959 974 HG23 THR 126 HG23 THR 126 3.013 -3.455 -9.534 975 H LYS 127 H LYS 127 5.690 -1.037 -12.301 976 HA LYS 127 HA LYS 127 7.457 -0.940 -9.946 977 HB2 LYS 127 HB3 LYS 127 7.452 0.939 -12.313 978 HB3 LYS 127 HB2 LYS 127 8.635 0.876 -11.015 979 HG2 LYS 127 HG3 LYS 127 9.850 -0.511 -12.234 980 HG3 LYS 127 HG2 LYS 127 8.552 -1.701 -12.132 981 HD2 LYS 127 HD3 LYS 127 7.575 -0.935 -14.157 982 HD3 LYS 127 HD2 LYS 127 8.604 0.499 -14.188 983 HE2 LYS 127 HE3 LYS 127 10.062 -2.043 -14.105 984 HE3 LYS 127 HE2 LYS 127 9.088 -1.811 -15.556 985 HZ1 LYS 127 HZ1 LYS 127 11.553 -0.892 -15.317 986 HZ2 LYS 127 HZ2 LYS 127 10.719 0.447 -14.708 987 HZ3 LYS 127 HZ3 LYS 127 10.383 -0.121 -16.265 988 H MET 128 H MET 128 7.551 1.235 -8.876 989 HA MET 128 HA MET 128 4.974 1.987 -8.011 990 HB2 MET 128 HB3 MET 128 7.106 2.167 -6.684 991 HB3 MET 128 HB2 MET 128 7.524 3.568 -7.660 992 HG2 MET 128 HG3 MET 128 6.558 4.162 -5.482 993 HG3 MET 128 HG2 MET 128 5.619 4.776 -6.840 994 HE1 MET 128 HE1 MET 128 3.834 5.378 -5.750 995 HE2 MET 128 HE2 MET 128 3.397 4.652 -4.203 996 HE3 MET 128 HE3 MET 128 2.420 4.330 -5.636 997 H ILE 129 H ILE 129 4.146 4.246 -8.035 998 HA ILE 129 HA ILE 129 4.366 5.339 -10.750 999 HB ILE 129 HB ILE 129 2.227 6.485 -10.259 1000 HG12 ILE 129 HG13 ILE 129 1.151 5.129 -8.118 1001 HG13 ILE 129 HG12 ILE 129 2.797 5.437 -7.577 1002 HG21 ILE 129 HG21 ILE 129 1.651 4.624 -11.384 1003 HG22 ILE 129 HG22 ILE 129 0.997 4.114 -9.826 1004 HG23 ILE 129 HG23 ILE 129 2.597 3.570 -10.333 1005 HD11 ILE 129 HD11 ILE 129 2.526 7.763 -7.769 1006 HD12 ILE 129 HD12 ILE 129 1.078 7.162 -6.963 1007 HD13 ILE 129 HD13 ILE 129 1.023 7.590 -8.674 1008 HA PRO 130 HA PRO 130 6.372 9.068 -9.529 1009 HB2 PRO 130 HB3 PRO 130 4.886 10.951 -10.898 1010 HB3 PRO 130 HB2 PRO 130 6.172 9.973 -11.610 1011 HG2 PRO 130 HG3 PRO 130 3.211 9.563 -11.694 1012 HG3 PRO 130 HG2 PRO 130 4.411 9.345 -12.982 1013 HD2 PRO 130 HD3 PRO 130 3.402 7.251 -11.653 1014 HD3 PRO 130 HD2 PRO 130 5.104 7.287 -12.159 1015 H LEU 131 H LEU 131 6.227 10.785 -8.092 1016 HA LEU 131 HA LEU 131 3.599 11.483 -7.015 1017 HB2 LEU 131 HB3 LEU 131 5.698 11.040 -4.979 1018 HB3 LEU 131 HB2 LEU 131 3.967 10.791 -4.879 1019 HG LEU 131 HG LEU 131 5.610 8.912 -6.526 1020 HD11 LEU 131 HD11 LEU 131 6.263 7.616 -4.696 1021 HD12 LEU 131 HD12 LEU 131 5.213 8.494 -3.584 1022 HD13 LEU 131 HD13 LEU 131 6.663 9.268 -4.225 1023 HD21 LEU 131 HD21 LEU 131 3.331 8.214 -4.730 1024 HD22 LEU 131 HD22 LEU 131 3.846 7.459 -6.238 1025 HD23 LEU 131 HD23 LEU 131 3.016 9.014 -6.270 1026 H ASN 132 H ASN 132 3.547 13.474 -5.872 1027 HA ASN 132 HA ASN 132 5.527 15.367 -6.779 1028 HB2 ASN 132 HB3 ASN 132 2.846 15.555 -6.233 1029 HB3 ASN 132 HB2 ASN 132 3.552 16.295 -4.800 1030 HD21 ASN 132 HD21 ASN 132 5.831 17.410 -5.981 1031 HD22 ASN 132 HD22 ASN 132 5.331 18.695 -7.022 1032 H TRP 133 H TRP 133 7.315 14.380 -5.639 1033 HA TRP 133 HA TRP 133 7.511 14.043 -2.902 1034 HB2 TRP 133 HB3 TRP 133 9.663 14.769 -4.892 1035 HB3 TRP 133 HB2 TRP 133 9.971 14.224 -3.244 1036 HD1 TRP 133 HD1 TRP 133 8.727 12.948 -6.634 1037 HE1 TRP 133 HE1 TRP 133 8.792 10.375 -6.620 1038 HE3 TRP 133 HE3 TRP 133 9.893 12.192 -1.713 1039 HZ2 TRP 133 HZ2 TRP 133 9.277 8.300 -4.770 1040 HZ3 TRP 133 HZ3 TRP 133 10.138 9.881 -0.902 1041 HH2 TRP 133 HH2 TRP 133 9.835 7.977 -2.400 1042 H ASP 134 H ASP 134 8.107 17.009 -4.799 1043 HA ASP 134 HA ASP 134 9.246 18.544 -2.787 1044 HB2 ASP 134 HB3 ASP 134 7.798 19.082 -5.310 1045 HB3 ASP 134 HB2 ASP 134 7.839 20.410 -4.154 1046 H ASP 135 H ASP 135 5.832 18.004 -3.553 1047 HA ASP 135 HA ASP 135 4.862 19.780 -1.545 1048 HB2 ASP 135 HB3 ASP 135 3.752 18.532 -3.722 1049 HB3 ASP 135 HB2 ASP 135 3.039 17.638 -2.382 1050 H PHE 136 H PHE 136 6.404 16.875 -1.219 1051 HA PHE 136 HA PHE 136 5.021 16.328 1.320 1052 HB2 PHE 136 HB3 PHE 136 6.151 14.388 -0.692 1053 HB3 PHE 136 HB2 PHE 136 5.817 13.927 0.975 1054 HD1 PHE 136 HD1 PHE 136 3.384 14.625 1.799 1055 HD2 PHE 136 HD2 PHE 136 4.524 13.985 -2.250 1056 HE1 PHE 136 HE1 PHE 136 1.035 14.194 1.211 1057 HE2 PHE 136 HE2 PHE 136 2.176 13.550 -2.847 1058 HZ PHE 136 HZ PHE 136 0.428 13.655 -1.115 1059 H THR 137 H THR 137 6.229 16.217 3.096 1060 HA THR 137 HA THR 137 9.150 16.444 2.774 1061 HB THR 137 HB THR 137 7.373 17.490 4.986 1062 HG1 THR 137 HG1 THR 137 7.179 18.989 3.506 1063 HG21 THR 137 HG21 THR 137 9.394 18.701 5.742 1064 HG22 THR 137 HG22 THR 137 10.349 17.718 4.632 1065 HG23 THR 137 HG23 THR 137 9.483 16.954 5.965 1066 H LYS 138 H LYS 138 10.447 15.011 3.718 1067 HA LYS 138 HA LYS 138 9.500 12.574 4.682 1068 HB2 LYS 138 HB3 LYS 138 11.800 13.121 3.732 1069 HB3 LYS 138 HB2 LYS 138 12.212 13.718 5.333 1070 HG2 LYS 138 HG3 LYS 138 12.531 11.665 6.129 1071 HG3 LYS 138 HG2 LYS 138 11.039 11.062 5.406 1072 HD2 LYS 138 HD3 LYS 138 12.459 9.854 4.134 1073 HD3 LYS 138 HD2 LYS 138 12.561 11.347 3.199 1074 HE2 LYS 138 HE3 LYS 138 14.691 11.704 3.789 1075 HE3 LYS 138 HE2 LYS 138 14.393 11.267 5.471 1076 HZ1 LYS 138 HZ1 LYS 138 15.013 9.469 3.202 1077 HZ2 LYS 138 HZ2 LYS 138 14.372 8.893 4.657 1078 HZ3 LYS 138 HZ3 LYS 138 15.874 9.669 4.644 1079 H VAL 139 H VAL 139 8.700 11.977 6.571 1080 HA VAL 139 HA VAL 139 8.864 13.810 8.834 1081 HB VAL 139 HB VAL 139 7.356 11.234 8.970 1082 HG11 VAL 139 HG11 VAL 139 7.669 13.252 10.720 1083 HG12 VAL 139 HG12 VAL 139 6.243 12.217 10.667 1084 HG13 VAL 139 HG13 VAL 139 6.217 13.795 9.880 1085 HG21 VAL 139 HG21 VAL 139 6.473 11.834 6.934 1086 HG22 VAL 139 HG22 VAL 139 6.685 13.560 7.226 1087 HG23 VAL 139 HG23 VAL 139 5.388 12.681 8.036 1088 H SER 140 H SER 140 9.862 10.588 7.854 1089 HA SER 140 HA SER 140 11.854 10.538 9.929 1090 HB2 SER 140 HB3 SER 140 9.414 9.560 10.705 1091 HB3 SER 140 HB2 SER 140 10.225 8.100 10.142 1092 HG SER 140 HG SER 140 12.038 8.891 11.514 1093 H SER 141 H SER 141 13.191 8.550 9.834 1094 HA SER 141 HA SER 141 12.966 6.881 7.499 1095 HB2 SER 141 HB3 SER 141 15.548 8.365 7.599 1096 HB3 SER 141 HB2 SER 141 14.691 7.690 6.214 1097 HG SER 141 HG SER 141 14.551 10.191 7.308 1098 H ARG 142 H ARG 142 13.653 4.927 8.065 1099 HA ARG 142 HA ARG 142 15.899 4.678 9.932 1100 HB2 ARG 142 HB3 ARG 142 13.664 4.474 11.124 1101 HB3 ARG 142 HB2 ARG 142 13.405 3.002 10.199 1102 HG2 ARG 142 HG3 ARG 142 14.974 1.825 11.360 1103 HG3 ARG 142 HG2 ARG 142 15.933 3.258 11.734 1104 HD2 ARG 142 HD3 ARG 142 15.034 3.153 13.774 1105 HD3 ARG 142 HD2 ARG 142 13.549 3.740 13.027 1106 HE ARG 142 HE ARG 142 12.630 1.656 13.285 1107 HH11 ARG 142 HH11 ARG 142 16.076 1.453 13.797 1108 HH12 ARG 142 HH12 ARG 142 16.021 -0.181 14.368 1109 HH21 ARG 142 HH21 ARG 142 12.556 -0.493 14.037 1110 HH22 ARG 142 HH22 ARG 142 14.023 -1.286 14.504 1111 H THR 143 H THR 143 17.396 3.404 9.087 1112 HA THR 143 HA THR 143 16.694 1.627 6.887 1113 HB THR 143 HB THR 143 19.429 2.283 7.993 1114 HG1 THR 143 HG1 THR 143 18.218 4.112 7.162 1115 HG21 THR 143 HG21 THR 143 19.116 1.643 5.157 1116 HG22 THR 143 HG22 THR 143 18.817 0.297 6.258 1117 HG23 THR 143 HG23 THR 143 20.359 1.152 6.309 1118 H VAL 144 H VAL 144 16.070 -0.359 7.401 1119 HA VAL 144 HA VAL 144 17.249 -1.676 9.746 1120 HB VAL 144 HB VAL 144 14.860 -2.595 8.145 1121 HG11 VAL 144 HG11 VAL 144 14.608 -4.263 9.648 1122 HG12 VAL 144 HG12 VAL 144 15.204 -3.289 10.992 1123 HG13 VAL 144 HG13 VAL 144 16.342 -4.031 9.867 1124 HG21 VAL 144 HG21 VAL 144 15.107 -0.531 10.234 1125 HG22 VAL 144 HG22 VAL 144 13.798 -1.693 10.455 1126 HG23 VAL 144 HG23 VAL 144 13.887 -0.737 8.976 1127 H GLU 145 H GLU 145 18.637 -3.319 9.517 1128 HA GLU 145 HA GLU 145 18.842 -4.596 6.869 1129 HB2 GLU 145 HB3 GLU 145 21.309 -4.921 7.517 1130 HB3 GLU 145 HB2 GLU 145 20.797 -3.320 6.999 1131 HG2 GLU 145 HG3 GLU 145 21.185 -2.398 9.007 1132 HG3 GLU 145 HG2 GLU 145 20.635 -3.823 9.888 1133 H ASP 146 H ASP 146 19.235 -6.780 6.790 1134 HA ASP 146 HA ASP 146 18.955 -8.220 9.346 1135 HB2 ASP 146 HB3 ASP 146 17.873 -8.826 6.596 1136 HB3 ASP 146 HB2 ASP 146 17.981 -10.064 7.844 1137 H THR 147 H THR 147 19.568 -10.752 8.622 1138 HA THR 147 HA THR 147 22.364 -10.773 8.582 1139 HB THR 147 HB THR 147 21.823 -13.279 7.769 1140 HG1 THR 147 HG1 THR 147 19.671 -13.069 7.408 1141 HG21 THR 147 HG21 THR 147 21.677 -11.999 10.428 1142 HG22 THR 147 HG22 THR 147 22.728 -13.287 9.839 1143 HG23 THR 147 HG23 THR 147 21.057 -13.643 10.279 1144 H ASN 148 H ASN 148 20.010 -11.279 5.990 1145 HA ASN 148 HA ASN 148 22.075 -11.693 4.015 1146 HB2 ASN 148 HB3 ASN 148 19.163 -11.948 4.141 1147 HB3 ASN 148 HB2 ASN 148 19.731 -11.274 2.616 1148 HD21 ASN 148 HD21 ASN 148 18.533 -13.892 3.317 1149 HD22 ASN 148 HD22 ASN 148 19.641 -15.071 2.711 1150 HA PRO 149 HA PRO 149 22.712 -7.397 3.074 1151 HB2 PRO 149 HB3 PRO 149 23.386 -8.300 0.345 1152 HB3 PRO 149 HB2 PRO 149 24.382 -7.440 1.522 1153 HG2 PRO 149 HG3 PRO 149 24.823 -10.016 0.938 1154 HG3 PRO 149 HG2 PRO 149 25.046 -9.381 2.577 1155 HD2 PRO 149 HD3 PRO 149 22.778 -10.978 1.459 1156 HD3 PRO 149 HD2 PRO 149 23.573 -11.100 3.043 1157 H ALA 150 H ALA 150 20.814 -9.487 1.008 1158 HA ALA 150 HA ALA 150 19.598 -7.289 -0.426 1159 HB1 ALA 150 HB1 ALA 150 19.799 -9.140 -1.788 1160 HB2 ALA 150 HB2 ALA 150 18.114 -9.243 -1.277 1161 HB3 ALA 150 HB3 ALA 150 19.332 -10.263 -0.511 1162 H LEU 151 H LEU 151 19.011 -8.969 2.500 1163 HA LEU 151 HA LEU 151 16.167 -8.429 2.523 1164 HB2 LEU 151 HB3 LEU 151 18.055 -9.651 4.519 1165 HB3 LEU 151 HB2 LEU 151 16.384 -9.298 4.915 1166 HG LEU 151 HG LEU 151 17.445 -11.307 2.944 1167 HD11 LEU 151 HD11 LEU 151 15.287 -11.864 4.892 1168 HD12 LEU 151 HD12 LEU 151 16.912 -11.617 5.534 1169 HD13 LEU 151 HD13 LEU 151 16.617 -12.885 4.345 1170 HD21 LEU 151 HD21 LEU 151 15.055 -11.731 2.352 1171 HD22 LEU 151 HD22 LEU 151 15.695 -10.203 1.746 1172 HD23 LEU 151 HD23 LEU 151 14.643 -10.219 3.161 1173 H THR 152 H THR 152 18.622 -6.392 2.753 1174 HA THR 152 HA THR 152 17.905 -4.995 5.176 1175 HB THR 152 HB THR 152 19.694 -4.072 2.919 1176 HG1 THR 152 HG1 THR 152 20.329 -5.503 5.282 1177 HG21 THR 152 HG21 THR 152 19.497 -2.175 4.154 1178 HG22 THR 152 HG22 THR 152 20.803 -2.969 5.035 1179 HG23 THR 152 HG23 THR 152 19.151 -3.047 5.648 1180 H HIS 153 H HIS 153 16.255 -3.629 5.334 1181 HA HIS 153 HA HIS 153 15.320 -2.277 2.886 1182 HB2 HIS 153 HB3 HIS 153 13.420 -2.674 5.138 1183 HB3 HIS 153 HB2 HIS 153 13.124 -2.667 3.404 1184 HD1 HIS 153 HD1 HIS 153 12.448 -4.862 5.820 1185 HD2 HIS 153 HD2 HIS 153 14.993 -5.214 2.556 1186 HE1 HIS 153 HE1 HIS 153 12.677 -7.332 5.410 1187 HE2 HIS 153 HE2 HIS 153 14.151 -7.518 3.376 1188 H THR 154 H THR 154 14.094 -0.243 3.335 1189 HA THR 154 HA THR 154 15.094 1.151 5.721 1190 HB THR 154 HB THR 154 15.010 2.397 2.972 1191 HG1 THR 154 HG1 THR 154 16.606 0.718 3.159 1192 HG21 THR 154 HG21 THR 154 16.477 3.316 5.427 1193 HG22 THR 154 HG22 THR 154 14.904 3.937 4.926 1194 HG23 THR 154 HG23 THR 154 16.312 4.160 3.887 1195 H TYR 155 H TYR 155 13.456 1.938 6.851 1196 HA TYR 155 HA TYR 155 10.864 2.320 5.572 1197 HB2 TYR 155 HB3 TYR 155 11.812 2.049 8.396 1198 HB3 TYR 155 HB2 TYR 155 10.275 2.850 8.089 1199 HD1 TYR 155 HD1 TYR 155 8.736 1.478 6.344 1200 HD2 TYR 155 HD2 TYR 155 11.727 -0.202 8.860 1201 HE1 TYR 155 HE1 TYR 155 7.624 -0.709 6.194 1202 HE2 TYR 155 HE2 TYR 155 10.624 -2.395 8.717 1203 HH TYR 155 HH TYR 155 9.100 -3.603 7.316 1204 H GLU 156 H GLU 156 10.251 4.252 4.862 1205 HA GLU 156 HA GLU 156 11.358 6.640 6.182 1206 HB2 GLU 156 HB3 GLU 156 10.944 6.119 3.243 1207 HB3 GLU 156 HB2 GLU 156 11.158 7.738 3.895 1208 HG2 GLU 156 HG3 GLU 156 13.341 7.462 3.708 1209 HG3 GLU 156 HG2 GLU 156 13.248 6.228 4.963 1210 H VAL 157 H VAL 157 10.000 8.299 6.605 1211 HA VAL 157 HA VAL 157 7.155 7.869 5.990 1212 HB VAL 157 HB VAL 157 8.192 9.580 8.243 1213 HG11 VAL 157 HG11 VAL 157 6.001 10.182 7.972 1214 HG12 VAL 157 HG12 VAL 157 5.798 8.806 9.055 1215 HG13 VAL 157 HG13 VAL 157 5.532 8.611 7.322 1216 HG21 VAL 157 HG21 VAL 157 9.025 7.393 8.715 1217 HG22 VAL 157 HG22 VAL 157 7.490 6.650 8.268 1218 HG23 VAL 157 HG23 VAL 157 7.598 7.645 9.720 1219 H TRP 158 H TRP 158 5.901 9.610 5.405 1220 HA TRP 158 HA TRP 158 7.191 12.165 4.836 1221 HB2 TRP 158 HB3 TRP 158 5.907 10.488 2.679 1222 HB3 TRP 158 HB2 TRP 158 6.343 12.181 2.489 1223 HD1 TRP 158 HD1 TRP 158 8.073 8.793 3.236 1224 HE1 TRP 158 HE1 TRP 158 10.450 8.885 2.253 1225 HE3 TRP 158 HE3 TRP 158 8.087 13.636 1.600 1226 HZ2 TRP 158 HZ2 TRP 158 12.111 10.764 0.956 1227 HZ3 TRP 158 HZ3 TRP 158 10.109 14.504 0.499 1228 HH2 TRP 158 HH2 TRP 158 12.079 13.096 0.185 1229 H GLN 159 H GLN 159 5.854 13.880 4.963 1230 HA GLN 159 HA GLN 159 2.959 13.426 4.979 1231 HB2 GLN 159 HB3 GLN 159 4.624 14.317 7.250 1232 HB3 GLN 159 HB2 GLN 159 3.176 15.271 6.962 1233 HG2 GLN 159 HG3 GLN 159 2.011 12.936 6.873 1234 HG3 GLN 159 HG2 GLN 159 3.437 12.418 7.770 1235 HE21 GLN 159 HE21 GLN 159 2.378 12.001 9.665 1236 HE22 GLN 159 HE22 GLN 159 1.672 13.233 10.649 1237 H LYS 160 H LYS 160 1.875 14.945 3.862 1238 HA LYS 160 HA LYS 160 3.190 16.867 2.337 1239 HB2 LYS 160 HB3 LYS 160 0.654 15.832 2.416 1240 HB3 LYS 160 HB2 LYS 160 0.383 17.487 2.946 1241 HG2 LYS 160 HG3 LYS 160 1.449 18.327 0.931 1242 HG3 LYS 160 HG2 LYS 160 1.782 16.676 0.405 1243 HD2 LYS 160 HD3 LYS 160 -0.147 17.071 -0.757 1244 HD3 LYS 160 HD2 LYS 160 -0.826 16.419 0.736 1245 HE2 LYS 160 HE3 LYS 160 -1.966 18.475 -0.060 1246 HE3 LYS 160 HE2 LYS 160 -1.287 18.625 1.560 1247 HZ1 LYS 160 HZ1 LYS 160 0.201 20.156 0.889 1248 HZ2 LYS 160 HZ2 LYS 160 -0.913 20.423 -0.356 1249 HZ3 LYS 160 HZ3 LYS 160 0.440 19.445 -0.629 1250 H LYS 161 H LYS 161 3.653 18.980 2.582 1251 HA LYS 161 HA LYS 161 3.943 20.062 5.152 1252 HB2 LYS 161 HB3 LYS 161 4.741 20.732 2.547 1253 HB3 LYS 161 HB2 LYS 161 3.828 22.120 3.123 1254 HG2 LYS 161 HG3 LYS 161 5.400 22.699 4.621 1255 HG3 LYS 161 HG2 LYS 161 5.782 21.024 5.027 1256 HD2 LYS 161 HD3 LYS 161 6.819 20.979 2.632 1257 HD3 LYS 161 HD2 LYS 161 6.846 22.734 2.817 1258 HE2 LYS 161 HE3 LYS 161 7.860 21.343 5.162 1259 HE3 LYS 161 HE2 LYS 161 8.772 20.962 3.702 1260 HZ1 LYS 161 HZ1 LYS 161 8.142 23.770 4.205 1261 HZ2 LYS 161 HZ2 LYS 161 9.517 23.080 3.503 1262 HZ3 LYS 161 HZ3 LYS 161 9.323 23.053 5.182 1263 H ALA 162 H ALA 162 2.835 21.665 6.261 1264 HA ALA 162 HA ALA 162 1.018 22.797 7.031 1265 HB1 ALA 162 HB1 ALA 162 0.416 23.084 4.089 1266 HB2 ALA 162 HB2 ALA 162 1.378 24.187 5.073 1267 HB3 ALA 162 HB3 ALA 162 -0.348 24.005 5.385 1268 H51A NDP 170 H51A NDP 170 -4.035 -1.345 -10.615 1269 H52A NDP 170 H52A NDP 170 -4.722 -0.027 -9.650 1270 H4B NDP 170 H4B NDP 170 -6.290 -2.239 -11.048 1271 H3B NDP 170 H3B NDP 170 -5.966 0.701 -11.672 1272 HO3A NDP 170 HO3A NDP 170 -4.849 -0.854 -12.957 1273 H2B NDP 170 H2B NDP 170 -8.238 0.679 -12.434 1274 H1B NDP 170 H1B NDP 170 -9.245 -0.728 -10.284 1275 H8A NDP 170 H8A NDP 170 -6.361 1.583 -9.359 1276 H61A NDP 170 H61A NDP 170 -10.762 5.811 -8.255 1277 H62A NDP 170 H62A NDP 170 -9.068 5.422 -8.066 1278 H2A NDP 170 H2A NDP 170 -12.716 2.225 -10.113 1279 H51N NDP 170 H51N NDP 170 0.020 -3.093 -9.501 1280 H52N NDP 170 H52N NDP 170 -0.853 -4.481 -10.174 1281 H4D NDP 170 H4D NDP 170 1.487 -5.098 -9.964 1282 H3D NDP 170 H3D NDP 170 -0.233 -6.408 -7.844 1283 HO3N NDP 170 HO3N NDP 170 -0.056 -8.094 -9.313 1284 H2D NDP 170 H2D NDP 170 1.754 -7.538 -7.108 1285 HO2N NDP 170 HO2N NDP 170 2.602 -7.100 -9.678 1286 H1D NDP 170 H1D NDP 170 3.406 -5.318 -7.270 1287 H2N NDP 170 H2N NDP 170 3.751 -5.002 -4.933 1288 H71N NDP 170 H71N NDP 170 5.352 -4.442 -2.179 1289 H72N NDP 170 H72N NDP 170 5.059 -5.064 -3.782 1290 H41N NDP 170 H41N NDP 170 0.478 -3.991 -2.894 1291 H42N NDP 170 H42N NDP 170 0.609 -5.760 -2.606 1292 H5N NDP 170 H5N NDP 170 -1.169 -5.247 -4.273 1293 H6N NDP 170 H6N NDP 170 -0.258 -5.560 -6.582 Start of MODEL 2 1 H1 THR 1 HT1 THR 1 -4.600 9.722 5.055 2 H2 THR 1 HT2 THR 1 -5.195 8.174 5.497 3 H3 THR 1 HT3 THR 1 -6.192 9.260 4.618 4 HA THR 1 HA THR 1 -5.169 7.407 3.347 5 HB THR 1 HB THR 1 -4.397 10.137 2.344 6 HG1 THR 1 HG1 THR 1 -7.015 9.115 2.700 7 HG21 THR 1 HG21 THR 1 -4.124 8.833 0.533 8 HG22 THR 1 HG22 THR 1 -5.868 9.053 0.399 9 HG23 THR 1 HG23 THR 1 -5.218 7.584 1.126 10 H ALA 2 H ALA 2 -3.395 6.204 3.624 11 HA ALA 2 HA ALA 2 -0.783 7.537 3.402 12 HB1 ALA 2 HB1 ALA 2 -1.699 5.619 5.501 13 HB2 ALA 2 HB2 ALA 2 -0.768 7.107 5.669 14 HB3 ALA 2 HB3 ALA 2 -0.002 5.656 5.024 15 H PHE 3 H PHE 3 0.815 6.397 2.320 16 HA PHE 3 HA PHE 3 -0.147 4.083 0.781 17 HB2 PHE 3 HB3 PHE 3 2.007 6.128 0.266 18 HB3 PHE 3 HB2 PHE 3 1.914 4.629 -0.646 19 HD1 PHE 3 HD1 PHE 3 -1.326 5.792 0.243 20 HD2 PHE 3 HD2 PHE 3 1.843 6.352 -2.542 21 HE1 PHE 3 HE1 PHE 3 -2.896 6.849 -1.328 22 HE2 PHE 3 HE2 PHE 3 0.278 7.409 -4.116 23 HZ PHE 3 HZ PHE 3 -2.092 7.660 -3.510 24 H LEU 4 H LEU 4 0.529 2.144 1.468 25 HA LEU 4 HA LEU 4 3.231 1.959 2.628 26 HB2 LEU 4 HB3 LEU 4 1.502 1.721 4.356 27 HB3 LEU 4 HB2 LEU 4 0.782 0.401 3.452 28 HG LEU 4 HG LEU 4 2.742 -0.977 3.813 29 HD11 LEU 4 HD11 LEU 4 4.594 0.399 3.815 30 HD12 LEU 4 HD12 LEU 4 4.441 -0.008 5.524 31 HD13 LEU 4 HD13 LEU 4 3.866 1.552 4.935 32 HD21 LEU 4 HD21 LEU 4 2.149 -1.583 5.902 33 HD22 LEU 4 HD22 LEU 4 0.883 -0.378 5.664 34 HD23 LEU 4 HD23 LEU 4 2.349 0.046 6.548 35 H TRP 5 H TRP 5 4.509 0.872 1.279 36 HA TRP 5 HA TRP 5 3.734 -1.731 0.347 37 HB2 TRP 5 HB3 TRP 5 3.615 -1.384 -1.945 38 HB3 TRP 5 HB2 TRP 5 2.796 0.042 -1.319 39 HD1 TRP 5 HD1 TRP 5 5.961 -1.035 -3.150 40 HE1 TRP 5 HE1 TRP 5 7.133 1.055 -4.087 41 HE3 TRP 5 HE3 TRP 5 3.118 2.561 -0.897 42 HZ2 TRP 5 HZ2 TRP 5 6.889 3.861 -3.890 43 HZ3 TRP 5 HZ3 TRP 5 3.652 4.929 -1.329 44 HH2 TRP 5 HH2 TRP 5 5.496 5.561 -2.795 45 H ALA 6 H ALA 6 5.487 -2.901 -0.659 46 HA ALA 6 HA ALA 6 8.100 -1.888 0.218 47 HB1 ALA 6 HB1 ALA 6 7.030 -4.228 0.836 48 HB2 ALA 6 HB2 ALA 6 8.764 -4.048 0.571 49 HB3 ALA 6 HB3 ALA 6 7.738 -4.691 -0.711 50 H GLN 7 H GLN 7 9.866 -1.790 -1.191 51 HA GLN 7 HA GLN 7 9.425 -2.525 -3.980 52 HB2 GLN 7 HB3 GLN 7 10.257 -0.254 -4.705 53 HB3 GLN 7 HB2 GLN 7 8.635 -0.288 -4.026 54 HG2 GLN 7 HG3 GLN 7 10.463 0.159 -1.905 55 HG3 GLN 7 HG2 GLN 7 10.866 1.261 -3.220 56 HE21 GLN 7 HE21 GLN 7 8.298 0.197 -1.069 57 HE22 GLN 7 HE22 GLN 7 7.361 1.644 -1.172 58 H ASP 8 H ASP 8 11.332 -2.601 -5.262 59 HA ASP 8 HA ASP 8 13.723 -3.139 -3.674 60 HB2 ASP 8 HB3 ASP 8 14.546 -4.333 -5.611 61 HB3 ASP 8 HB2 ASP 8 12.888 -4.835 -5.307 62 H ARG 9 H ARG 9 15.708 -2.746 -5.566 63 HA ARG 9 HA ARG 9 16.139 0.056 -5.341 64 HB2 ARG 9 HB3 ARG 9 17.696 -2.238 -5.895 65 HB3 ARG 9 HB2 ARG 9 17.910 -1.147 -7.257 66 HG2 ARG 9 HG3 ARG 9 18.220 -0.251 -4.409 67 HG3 ARG 9 HG2 ARG 9 19.552 -0.923 -5.351 68 HD2 ARG 9 HD3 ARG 9 17.917 1.352 -6.409 69 HD3 ARG 9 HD2 ARG 9 19.236 1.643 -5.275 70 HE ARG 9 HE ARG 9 20.136 0.020 -7.400 71 HH11 ARG 9 HH11 ARG 9 19.203 3.310 -6.706 72 HH12 ARG 9 HH12 ARG 9 20.207 3.988 -7.943 73 HH21 ARG 9 HH21 ARG 9 21.457 0.909 -9.028 74 HH22 ARG 9 HH22 ARG 9 21.487 2.625 -9.262 75 H ASP 10 H ASP 10 14.859 -2.001 -7.830 76 HA ASP 10 HA ASP 10 15.100 0.012 -9.900 77 HB2 ASP 10 HB3 ASP 10 14.309 -2.832 -9.763 78 HB3 ASP 10 HB2 ASP 10 13.486 -1.874 -10.990 79 H GLY 11 H GLY 11 13.118 -0.232 -7.330 80 HA2 GLY 11 HA3 GLY 11 11.259 1.140 -6.912 81 HA3 GLY 11 HA2 GLY 11 11.058 1.355 -8.644 82 H LEU 12 H LEU 12 11.428 -1.811 -8.501 83 HA LEU 12 HA LEU 12 8.898 -2.591 -9.143 84 HB2 LEU 12 HB3 LEU 12 11.063 -3.930 -9.185 85 HB3 LEU 12 HB2 LEU 12 10.762 -4.298 -7.501 86 HG LEU 12 HG LEU 12 8.636 -5.416 -8.150 87 HD11 LEU 12 HD11 LEU 12 8.289 -4.118 -10.239 88 HD12 LEU 12 HD12 LEU 12 8.146 -5.861 -10.457 89 HD13 LEU 12 HD13 LEU 12 9.609 -5.024 -10.977 90 HD21 LEU 12 HD21 LEU 12 9.738 -7.344 -8.401 91 HD22 LEU 12 HD22 LEU 12 11.196 -6.357 -8.284 92 HD23 LEU 12 HD23 LEU 12 10.555 -6.801 -9.867 93 H ILE 13 H ILE 13 7.480 -4.126 -7.848 94 HA ILE 13 HA ILE 13 7.347 -3.625 -5.005 95 HB ILE 13 HB ILE 13 5.057 -2.824 -4.990 96 HG12 ILE 13 HG13 ILE 13 4.990 -2.145 -7.868 97 HG13 ILE 13 HG12 ILE 13 4.792 -3.852 -7.495 98 HG21 ILE 13 HG21 ILE 13 7.024 -1.252 -5.141 99 HG22 ILE 13 HG22 ILE 13 5.458 -0.579 -5.597 100 HG23 ILE 13 HG23 ILE 13 6.615 -1.045 -6.844 101 HD11 ILE 13 HD11 ILE 13 3.140 -1.663 -6.267 102 HD12 ILE 13 HD12 ILE 13 2.880 -3.401 -6.138 103 HD13 ILE 13 HD13 ILE 13 2.667 -2.591 -7.689 104 H GLY 14 H GLY 14 6.145 -5.180 -7.904 105 HA2 GLY 14 HA3 GLY 14 5.551 -7.546 -6.293 106 HA3 GLY 14 HA2 GLY 14 4.281 -6.908 -7.322 107 H LYS 15 H LYS 15 4.742 -9.328 -7.884 108 HA LYS 15 HA LYS 15 6.418 -9.320 -10.297 109 HB2 LYS 15 HB3 LYS 15 7.081 -11.618 -9.876 110 HB3 LYS 15 HB2 LYS 15 7.532 -10.616 -8.504 111 HG2 LYS 15 HG3 LYS 15 6.194 -11.727 -7.093 112 HG3 LYS 15 HG2 LYS 15 4.887 -11.848 -8.270 113 HD2 LYS 15 HD3 LYS 15 6.780 -13.512 -9.338 114 HD3 LYS 15 HD2 LYS 15 7.002 -13.758 -7.605 115 HE2 LYS 15 HE3 LYS 15 4.490 -14.131 -9.221 116 HE3 LYS 15 HE2 LYS 15 5.404 -15.358 -8.345 117 HZ1 LYS 15 HZ1 LYS 15 4.850 -13.809 -6.330 118 HZ2 LYS 15 HZ2 LYS 15 3.726 -14.947 -6.878 119 HZ3 LYS 15 HZ3 LYS 15 3.565 -13.321 -7.316 120 H ASP 16 H ASP 16 3.875 -8.623 -10.547 121 HA ASP 16 HA ASP 16 2.076 -9.097 -11.882 122 HB2 ASP 16 HB3 ASP 16 3.716 -10.834 -12.928 123 HB3 ASP 16 HB2 ASP 16 2.804 -12.011 -11.988 124 H GLY 17 H GLY 17 2.220 -9.298 -8.982 125 HA2 GLY 17 HA3 GLY 17 -0.386 -10.136 -8.417 126 HA3 GLY 17 HA2 GLY 17 0.701 -11.448 -7.983 127 H HIS 18 H HIS 18 2.861 -10.174 -6.972 128 HA HIS 18 HA HIS 18 2.340 -8.056 -5.193 129 HB2 HIS 18 HB3 HIS 18 2.230 -9.229 -3.067 130 HB3 HIS 18 HB2 HIS 18 0.905 -9.759 -4.097 131 HD1 HIS 18 HD1 HIS 18 3.796 -10.991 -2.206 132 HD2 HIS 18 HD2 HIS 18 1.287 -12.403 -5.202 133 HE1 HIS 18 HE1 HIS 18 4.159 -13.479 -2.270 134 HE2 HIS 18 HE2 HIS 18 2.565 -14.322 -4.031 135 H LEU 19 H LEU 19 4.081 -8.402 -3.192 136 HA LEU 19 HA LEU 19 6.589 -8.238 -4.478 137 HB2 LEU 19 HB3 LEU 19 7.507 -8.183 -2.149 138 HB3 LEU 19 HB2 LEU 19 6.284 -6.978 -2.498 139 HG LEU 19 HG LEU 19 4.750 -8.966 -1.454 140 HD11 LEU 19 HD11 LEU 19 7.509 -9.378 -0.527 141 HD12 LEU 19 HD12 LEU 19 6.146 -10.495 -0.576 142 HD13 LEU 19 HD13 LEU 19 6.283 -9.328 0.739 143 HD21 LEU 19 HD21 LEU 19 5.304 -7.568 0.773 144 HD22 LEU 19 HD22 LEU 19 4.286 -6.958 -0.531 145 HD23 LEU 19 HD23 LEU 19 5.982 -6.484 -0.442 146 HA PRO 20 HA PRO 20 7.364 -12.665 -4.493 147 HB2 PRO 20 HB3 PRO 20 9.590 -12.622 -5.986 148 HB3 PRO 20 HB2 PRO 20 7.998 -12.316 -6.689 149 HG2 PRO 20 HG3 PRO 20 10.114 -10.362 -5.874 150 HG3 PRO 20 HG2 PRO 20 9.113 -10.379 -7.337 151 HD2 PRO 20 HD3 PRO 20 8.584 -8.815 -5.156 152 HD3 PRO 20 HD2 PRO 20 7.336 -9.390 -6.279 153 H TRP 21 H TRP 21 9.256 -10.207 -3.057 154 HA TRP 21 HA TRP 21 11.327 -12.016 -2.125 155 HB2 TRP 21 HB3 TRP 21 12.134 -9.939 -0.911 156 HB3 TRP 21 HB2 TRP 21 12.110 -9.839 -2.669 157 HD1 TRP 21 HD1 TRP 21 9.635 -8.935 0.192 158 HE1 TRP 21 HE1 TRP 21 8.550 -6.676 -0.391 159 HE3 TRP 21 HE3 TRP 21 11.900 -8.093 -4.311 160 HZ2 TRP 21 HZ2 TRP 21 8.641 -4.788 -2.490 161 HZ3 TRP 21 HZ3 TRP 21 11.343 -6.038 -5.545 162 HH2 TRP 21 HH2 TRP 21 9.747 -4.421 -4.652 163 H HIS 22 H HIS 22 11.656 -12.624 0.004 164 HA HIS 22 HA HIS 22 9.258 -12.737 1.622 165 HB2 HIS 22 HB3 HIS 22 11.055 -14.610 1.224 166 HB3 HIS 22 HB2 HIS 22 11.912 -13.795 2.528 167 HD1 HIS 22 HD1 HIS 22 8.168 -14.181 2.474 168 HD2 HIS 22 HD2 HIS 22 11.480 -15.765 4.420 169 HE1 HIS 22 HE1 HIS 22 7.241 -15.578 4.348 170 HE2 HIS 22 HE2 HIS 22 9.261 -16.595 5.459 171 H LEU 23 H LEU 23 8.798 -10.940 2.732 172 HA LEU 23 HA LEU 23 10.977 -9.612 4.194 173 HB2 LEU 23 HB3 LEU 23 8.866 -8.604 2.518 174 HB3 LEU 23 HB2 LEU 23 8.723 -7.930 4.130 175 HG LEU 23 HG LEU 23 11.164 -7.291 3.945 176 HD11 LEU 23 HD11 LEU 23 11.030 -8.826 1.630 177 HD12 LEU 23 HD12 LEU 23 12.364 -7.797 2.150 178 HD13 LEU 23 HD13 LEU 23 11.129 -7.158 1.065 179 HD21 LEU 23 HD21 LEU 23 10.183 -5.634 1.877 180 HD22 LEU 23 HD22 LEU 23 10.249 -5.299 3.607 181 HD23 LEU 23 HD23 LEU 23 8.815 -6.051 2.909 182 HA PRO 24 HA PRO 24 8.437 -11.622 7.493 183 HB2 PRO 24 HB3 PRO 24 10.979 -11.232 8.953 184 HB3 PRO 24 HB2 PRO 24 9.993 -12.687 8.780 185 HG2 PRO 24 HG3 PRO 24 12.326 -12.432 7.498 186 HG3 PRO 24 HG2 PRO 24 10.942 -13.251 6.749 187 HD2 PRO 24 HD3 PRO 24 11.998 -10.490 6.275 188 HD3 PRO 24 HD2 PRO 24 11.366 -11.673 5.111 189 H ASP 25 H ASP 25 10.730 -8.923 7.805 190 HA ASP 25 HA ASP 25 9.587 -7.823 10.133 191 HB2 ASP 25 HB3 ASP 25 10.865 -5.759 9.382 192 HB3 ASP 25 HB2 ASP 25 11.817 -7.214 9.629 193 H ASP 26 H ASP 26 8.871 -7.472 6.728 194 HA ASP 26 HA ASP 26 7.273 -5.120 7.008 195 HB2 ASP 26 HB3 ASP 26 8.415 -6.111 4.880 196 HB3 ASP 26 HB2 ASP 26 6.942 -7.066 4.749 197 H LEU 27 H LEU 27 6.419 -8.537 6.395 198 HA LEU 27 HA LEU 27 3.672 -8.262 6.554 199 HB2 LEU 27 HB3 LEU 27 3.726 -10.693 7.202 200 HB3 LEU 27 HB2 LEU 27 4.536 -10.279 5.711 201 HG LEU 27 HG LEU 27 6.629 -10.155 7.393 202 HD11 LEU 27 HD11 LEU 27 6.473 -11.387 9.263 203 HD12 LEU 27 HD12 LEU 27 5.415 -12.582 8.512 204 HD13 LEU 27 HD13 LEU 27 4.746 -11.064 9.110 205 HD21 LEU 27 HD21 LEU 27 6.896 -11.449 5.508 206 HD22 LEU 27 HD22 LEU 27 5.441 -12.395 5.820 207 HD23 LEU 27 HD23 LEU 27 6.896 -12.676 6.775 208 H HIS 28 H HIS 28 5.990 -9.035 9.141 209 HA HIS 28 HA HIS 28 4.115 -9.320 11.207 210 HB2 HIS 28 HB3 HIS 28 7.007 -9.085 10.973 211 HB3 HIS 28 HB2 HIS 28 6.400 -8.291 12.422 212 HD1 HIS 28 HD1 HIS 28 4.382 -10.078 13.555 213 HD2 HIS 28 HD2 HIS 28 7.747 -11.586 11.638 214 HE1 HIS 28 HE1 HIS 28 4.659 -12.422 14.425 215 HE2 HIS 28 HE2 HIS 28 6.654 -13.341 13.191 216 H TYR 29 H TYR 29 5.703 -6.495 9.860 217 HA TYR 29 HA TYR 29 4.696 -4.704 11.877 218 HB2 TYR 29 HB3 TYR 29 6.837 -4.302 10.680 219 HB3 TYR 29 HB2 TYR 29 5.932 -4.067 9.189 220 HD1 TYR 29 HD1 TYR 29 6.351 -2.714 12.629 221 HD2 TYR 29 HD2 TYR 29 5.090 -1.953 8.637 222 HE1 TYR 29 HE1 TYR 29 6.097 -0.329 13.170 223 HE2 TYR 29 HE2 TYR 29 4.833 0.434 9.168 224 HH TYR 29 HH TYR 29 5.745 2.060 10.830 225 H PHE 30 H PHE 30 3.708 -5.825 8.728 226 HA PHE 30 HA PHE 30 1.857 -3.804 8.093 227 HB2 PHE 30 HB3 PHE 30 2.520 -6.487 7.131 228 HB3 PHE 30 HB2 PHE 30 0.811 -6.099 6.963 229 HD1 PHE 30 HD2 PHE 30 3.845 -3.963 6.637 230 HD2 PHE 30 HD1 PHE 30 0.433 -5.655 4.737 231 HE1 PHE 30 HE2 PHE 30 4.344 -2.675 4.601 232 HE2 PHE 30 HE1 PHE 30 0.927 -4.371 2.697 233 HZ PHE 30 HZ PHE 30 2.884 -2.878 2.627 234 H ARG 31 H ARG 31 1.174 -7.085 9.314 235 HA ARG 31 HA ARG 31 -1.517 -6.522 9.963 236 HB2 ARG 31 HB3 ARG 31 0.355 -8.759 10.294 237 HB3 ARG 31 HB2 ARG 31 -0.866 -8.658 11.555 238 HG2 ARG 31 HG3 ARG 31 -2.037 -9.915 10.100 239 HG3 ARG 31 HG2 ARG 31 -2.434 -8.339 9.412 240 HD2 ARG 31 HD3 ARG 31 -1.653 -9.167 7.489 241 HD3 ARG 31 HD2 ARG 31 -0.052 -8.944 8.193 242 HE ARG 31 HE ARG 31 -1.198 -11.454 8.914 243 HH11 ARG 31 HH11 ARG 31 0.468 -9.769 6.352 244 HH12 ARG 31 HH12 ARG 31 1.145 -11.211 5.674 245 HH21 ARG 31 HH21 ARG 31 -0.308 -13.352 8.023 246 HH22 ARG 31 HH22 ARG 31 0.704 -13.245 6.622 247 H ALA 32 H ALA 32 1.458 -6.040 11.672 248 HA ALA 32 HA ALA 32 0.304 -5.863 14.284 249 HB1 ALA 32 HB1 ALA 32 2.576 -6.447 14.231 250 HB2 ALA 32 HB2 ALA 32 2.544 -4.790 14.833 251 HB3 ALA 32 HB3 ALA 32 2.981 -5.110 13.155 252 H GLN 33 H GLN 33 0.821 -3.634 11.657 253 HA GLN 33 HA GLN 33 0.197 -1.346 13.367 254 HB2 GLN 33 HB3 GLN 33 1.532 -1.723 10.776 255 HB3 GLN 33 HB2 GLN 33 0.471 -0.323 10.843 256 HG2 GLN 33 HG3 GLN 33 2.183 -0.562 13.181 257 HG3 GLN 33 HG2 GLN 33 3.083 -0.417 11.672 258 HE21 GLN 33 HE21 GLN 33 2.353 1.362 10.217 259 HE22 GLN 33 HE22 GLN 33 1.901 2.858 10.955 260 H THR 34 H THR 34 -1.185 -3.318 10.842 261 HA THR 34 HA THR 34 -3.463 -1.518 10.553 262 HB THR 34 HB THR 34 -4.128 -2.876 8.698 263 HG1 THR 34 HG1 THR 34 -2.066 -4.690 9.388 264 HG21 THR 34 HG21 THR 34 -1.550 -1.733 8.802 265 HG22 THR 34 HG22 THR 34 -2.581 -1.999 7.396 266 HG23 THR 34 HG23 THR 34 -1.434 -3.241 7.896 267 H VAL 35 H VAL 35 -3.185 -2.708 13.101 268 HA VAL 35 HA VAL 35 -5.184 -4.839 13.164 269 HB VAL 35 HB VAL 35 -4.356 -3.970 15.797 270 HG11 VAL 35 HG11 VAL 35 -4.641 -6.427 14.225 271 HG12 VAL 35 HG12 VAL 35 -5.051 -6.098 15.908 272 HG13 VAL 35 HG13 VAL 35 -3.389 -6.489 15.466 273 HG21 VAL 35 HG21 VAL 35 -1.973 -4.958 15.444 274 HG22 VAL 35 HG22 VAL 35 -2.274 -3.256 15.094 275 HG23 VAL 35 HG23 VAL 35 -2.198 -4.427 13.778 276 H GLY 36 H GLY 36 -7.152 -3.959 12.834 277 HA2 GLY 36 HA3 GLY 36 -9.127 -3.082 13.772 278 HA3 GLY 36 HA2 GLY 36 -8.153 -2.180 14.923 279 H LYS 37 H LYS 37 -7.003 -1.944 11.739 280 HA LYS 37 HA LYS 37 -8.214 0.727 11.492 281 HB2 LYS 37 HB3 LYS 37 -5.532 -0.379 10.808 282 HB3 LYS 37 HB2 LYS 37 -6.173 0.900 9.788 283 HG2 LYS 37 HG3 LYS 37 -6.588 2.128 12.039 284 HG3 LYS 37 HG2 LYS 37 -5.400 0.985 12.668 285 HD2 LYS 37 HD3 LYS 37 -4.181 1.846 10.387 286 HD3 LYS 37 HD2 LYS 37 -5.046 3.298 10.897 287 HE2 LYS 37 HE3 LYS 37 -3.534 1.792 12.961 288 HE3 LYS 37 HE2 LYS 37 -2.607 2.713 11.777 289 HZ1 LYS 37 HZ1 LYS 37 -3.775 4.698 12.402 290 HZ2 LYS 37 HZ2 LYS 37 -3.133 3.987 13.796 291 HZ3 LYS 37 HZ3 LYS 37 -4.783 3.838 13.455 292 H ILE 38 H ILE 38 -7.834 1.335 8.909 293 HA ILE 38 HA ILE 38 -9.232 -0.798 7.432 294 HB ILE 38 HB ILE 38 -9.918 1.599 6.170 295 HG12 ILE 38 HG13 ILE 38 -10.667 1.901 9.061 296 HG13 ILE 38 HG12 ILE 38 -9.169 2.599 8.456 297 HG21 ILE 38 HG21 ILE 38 -11.238 -0.509 6.495 298 HG22 ILE 38 HG22 ILE 38 -12.153 0.984 6.701 299 HG23 ILE 38 HG23 ILE 38 -11.628 0.071 8.113 300 HD11 ILE 38 HD11 ILE 38 -10.698 4.338 8.328 301 HD12 ILE 38 HD12 ILE 38 -11.986 3.289 7.736 302 HD13 ILE 38 HD13 ILE 38 -10.638 3.713 6.680 303 H MET 39 H MET 39 -8.076 -1.549 5.806 304 HA MET 39 HA MET 39 -6.101 0.227 4.534 305 HB2 MET 39 HB3 MET 39 -5.021 -1.664 5.531 306 HB3 MET 39 HB2 MET 39 -6.178 -2.778 4.818 307 HG2 MET 39 HG3 MET 39 -4.552 -1.089 2.997 308 HG3 MET 39 HG2 MET 39 -3.765 -2.437 3.817 309 HE1 MET 39 HE1 MET 39 -6.700 -4.729 3.490 310 HE2 MET 39 HE2 MET 39 -5.075 -4.567 4.156 311 HE3 MET 39 HE3 MET 39 -5.339 -5.522 2.697 312 H VAL 40 H VAL 40 -6.352 0.774 2.469 313 HA VAL 40 HA VAL 40 -8.618 -0.292 0.994 314 HB VAL 40 HB VAL 40 -6.681 1.846 0.104 315 HG11 VAL 40 HG11 VAL 40 -8.033 2.207 -1.662 316 HG12 VAL 40 HG12 VAL 40 -9.500 1.865 -0.745 317 HG13 VAL 40 HG13 VAL 40 -8.523 0.538 -1.373 318 HG21 VAL 40 HG21 VAL 40 -9.297 2.195 1.567 319 HG22 VAL 40 HG22 VAL 40 -8.261 3.484 0.954 320 HG23 VAL 40 HG23 VAL 40 -7.695 2.445 2.262 321 H VAL 41 H VAL 41 -8.495 -1.677 -0.674 322 HA VAL 41 HA VAL 41 -5.838 -2.256 -1.798 323 HB VAL 41 HB VAL 41 -6.807 -3.989 -0.134 324 HG11 VAL 41 HG11 VAL 41 -8.429 -4.667 -2.584 325 HG12 VAL 41 HG12 VAL 41 -9.054 -4.125 -1.026 326 HG13 VAL 41 HG13 VAL 41 -8.252 -5.689 -1.158 327 HG21 VAL 41 HG21 VAL 41 -5.168 -4.183 -2.415 328 HG22 VAL 41 HG22 VAL 41 -6.164 -5.638 -2.369 329 HG23 VAL 41 HG23 VAL 41 -5.167 -5.206 -0.980 330 H GLY 42 H GLY 42 -5.730 -2.637 -3.992 331 HA2 GLY 42 HA3 GLY 42 -7.921 -1.637 -5.559 332 HA3 GLY 42 HA2 GLY 42 -6.377 -2.207 -6.173 333 H ARG 43 H ARG 43 -8.440 -2.865 -7.693 334 HA ARG 43 HA ARG 43 -9.891 -5.146 -7.012 335 HB2 ARG 43 HB3 ARG 43 -10.541 -3.813 -8.903 336 HB3 ARG 43 HB2 ARG 43 -9.007 -4.121 -9.705 337 HG2 ARG 43 HG3 ARG 43 -9.749 -6.618 -9.557 338 HG3 ARG 43 HG2 ARG 43 -11.358 -5.922 -9.358 339 HD2 ARG 43 HD3 ARG 43 -9.477 -5.292 -11.627 340 HD3 ARG 43 HD2 ARG 43 -10.798 -6.458 -11.707 341 HE ARG 43 HE ARG 43 -11.460 -3.724 -10.947 342 HH11 ARG 43 HH11 ARG 43 -11.392 -6.170 -13.447 343 HH12 ARG 43 HH12 ARG 43 -12.613 -5.402 -14.402 344 HH21 ARG 43 HH21 ARG 43 -13.074 -2.731 -12.205 345 HH22 ARG 43 HH22 ARG 43 -13.564 -3.449 -13.702 346 H ARG 44 H ARG 44 -7.071 -4.985 -9.180 347 HA ARG 44 HA ARG 44 -6.659 -7.729 -9.384 348 HB2 ARG 44 HB3 ARG 44 -5.254 -5.315 -10.122 349 HB3 ARG 44 HB2 ARG 44 -4.121 -6.541 -9.570 350 HG2 ARG 44 HG3 ARG 44 -4.273 -6.897 -11.861 351 HG3 ARG 44 HG2 ARG 44 -5.340 -8.121 -11.171 352 HD2 ARG 44 HD3 ARG 44 -6.488 -7.158 -13.014 353 HD3 ARG 44 HD2 ARG 44 -7.246 -6.533 -11.550 354 HE ARG 44 HE ARG 44 -6.557 -4.429 -12.131 355 HH11 ARG 44 HH11 ARG 44 -4.798 -6.760 -14.042 356 HH12 ARG 44 HH12 ARG 44 -4.076 -5.563 -15.065 357 HH21 ARG 44 HH21 ARG 44 -5.609 -2.854 -13.475 358 HH22 ARG 44 HH22 ARG 44 -4.536 -3.345 -14.743 359 H THR 45 H THR 45 -5.951 -5.580 -6.789 360 HA THR 45 HA THR 45 -3.921 -7.221 -5.598 361 HB THR 45 HB THR 45 -5.488 -5.106 -4.154 362 HG1 THR 45 HG1 THR 45 -4.843 -3.759 -5.610 363 HG21 THR 45 HG21 THR 45 -3.314 -4.625 -3.120 364 HG22 THR 45 HG22 THR 45 -2.612 -5.975 -4.011 365 HG23 THR 45 HG23 THR 45 -3.864 -6.270 -2.805 366 H TYR 46 H TYR 46 -7.350 -6.528 -4.797 367 HA TYR 46 HA TYR 46 -7.547 -8.125 -2.549 368 HB2 TYR 46 HB3 TYR 46 -9.912 -8.121 -2.832 369 HB3 TYR 46 HB2 TYR 46 -9.338 -6.586 -3.464 370 HD1 TYR 46 HD2 TYR 46 -9.858 -10.044 -4.847 371 HD2 TYR 46 HD1 TYR 46 -10.506 -5.858 -5.320 372 HE1 TYR 46 HE2 TYR 46 -11.019 -10.470 -6.954 373 HE2 TYR 46 HE1 TYR 46 -11.692 -6.289 -7.427 374 HH TYR 46 HH TYR 46 -11.467 -8.932 -9.168 375 H GLU 47 H GLU 47 -7.491 -9.045 -5.907 376 HA GLU 47 HA GLU 47 -8.117 -11.826 -5.291 377 HB2 GLU 47 HB3 GLU 47 -7.496 -11.921 -7.894 378 HB3 GLU 47 HB2 GLU 47 -9.092 -11.469 -7.314 379 HG2 GLU 47 HG3 GLU 47 -8.739 -9.213 -7.751 380 HG3 GLU 47 HG2 GLU 47 -6.987 -9.400 -7.806 381 H SER 48 H SER 48 -5.418 -9.802 -5.994 382 HA SER 48 HA SER 48 -3.624 -12.084 -6.336 383 HB2 SER 48 HB3 SER 48 -3.095 -9.111 -6.529 384 HB3 SER 48 HB2 SER 48 -1.889 -10.366 -6.808 385 HG SER 48 HG SER 48 -3.071 -11.077 -8.568 386 H PHE 49 H PHE 49 -4.971 -11.146 -3.732 387 HA PHE 49 HA PHE 49 -2.583 -10.633 -2.121 388 HB2 PHE 49 HB3 PHE 49 -5.091 -9.558 -1.969 389 HB3 PHE 49 HB2 PHE 49 -5.179 -10.820 -0.745 390 HD1 PHE 49 HD1 PHE 49 -2.845 -8.124 -1.854 391 HD2 PHE 49 HD2 PHE 49 -4.579 -10.262 1.393 392 HE1 PHE 49 HE1 PHE 49 -1.665 -6.663 -0.266 393 HE2 PHE 49 HE2 PHE 49 -3.403 -8.803 2.986 394 HZ PHE 49 HZ PHE 49 -1.943 -7.000 2.158 395 HA PRO 50 HA PRO 50 -2.522 -14.903 -0.892 396 HB2 PRO 50 HB3 PRO 50 -0.641 -14.774 1.011 397 HB3 PRO 50 HB2 PRO 50 -0.248 -14.531 -0.695 398 HG2 PRO 50 HG3 PRO 50 -0.648 -12.500 1.465 399 HG3 PRO 50 HG2 PRO 50 0.585 -12.551 0.193 400 HD2 PRO 50 HD3 PRO 50 -1.691 -11.018 0.069 401 HD3 PRO 50 HD2 PRO 50 -0.804 -11.596 -1.355 402 H LYS 51 H LYS 51 -3.212 -12.319 1.354 403 HA LYS 51 HA LYS 51 -4.620 -14.254 3.068 404 HB2 LYS 51 HB3 LYS 51 -2.397 -12.991 3.902 405 HB3 LYS 51 HB2 LYS 51 -3.591 -11.774 4.329 406 HG2 LYS 51 HG3 LYS 51 -3.254 -13.138 6.236 407 HG3 LYS 51 HG2 LYS 51 -4.836 -13.553 5.572 408 HD2 LYS 51 HD3 LYS 51 -3.850 -15.620 6.066 409 HD3 LYS 51 HD2 LYS 51 -3.618 -15.428 4.327 410 HE2 LYS 51 HE3 LYS 51 -1.507 -14.494 6.226 411 HE3 LYS 51 HE2 LYS 51 -1.636 -16.208 5.832 412 HZ1 LYS 51 HZ1 LYS 51 -0.317 -15.651 4.129 413 HZ2 LYS 51 HZ2 LYS 51 -0.705 -14.007 4.206 414 HZ3 LYS 51 HZ3 LYS 51 -1.735 -15.081 3.402 415 H ARG 52 H ARG 52 -6.284 -13.515 1.408 416 HA ARG 52 HA ARG 52 -7.632 -11.101 2.420 417 HB2 ARG 52 HB3 ARG 52 -8.683 -10.993 0.103 418 HB3 ARG 52 HB2 ARG 52 -6.985 -10.557 0.221 419 HG2 ARG 52 HG3 ARG 52 -6.685 -11.947 -1.491 420 HG3 ARG 52 HG2 ARG 52 -6.863 -13.241 -0.308 421 HD2 ARG 52 HD3 ARG 52 -9.464 -12.421 -1.053 422 HD3 ARG 52 HD2 ARG 52 -8.528 -12.606 -2.536 423 HE ARG 52 HE ARG 52 -8.248 -14.802 -0.700 424 HH11 ARG 52 HH11 ARG 52 -10.144 -13.476 -3.313 425 HH12 ARG 52 HH12 ARG 52 -10.766 -15.014 -3.808 426 HH21 ARG 52 HH21 ARG 52 -9.065 -16.826 -1.350 427 HH22 ARG 52 HH22 ARG 52 -10.155 -16.916 -2.694 428 HA PRO 53 HA PRO 53 -9.400 -10.233 2.891 429 HB2 PRO 53 HB3 PRO 53 -11.075 -10.798 5.194 430 HB3 PRO 53 HB2 PRO 53 -11.433 -9.793 3.788 431 HG2 PRO 53 HG3 PRO 53 -12.686 -12.158 4.298 432 HG3 PRO 53 HG2 PRO 53 -12.461 -11.501 2.667 433 HD2 PRO 53 HD3 PRO 53 -10.902 -13.629 4.087 434 HD3 PRO 53 HD2 PRO 53 -11.434 -13.562 2.392 435 H LEU 54 H LEU 54 -8.764 -9.119 4.959 436 HA LEU 54 HA LEU 54 -6.739 -10.729 6.308 437 HB2 LEU 54 HB3 LEU 54 -7.228 -7.794 6.000 438 HB3 LEU 54 HB2 LEU 54 -6.154 -8.381 7.256 439 HG LEU 54 HG LEU 54 -5.699 -9.299 4.456 440 HD11 LEU 54 HD11 LEU 54 -4.636 -6.671 5.453 441 HD12 LEU 54 HD12 LEU 54 -6.076 -6.797 4.441 442 HD13 LEU 54 HD13 LEU 54 -4.518 -7.357 3.832 443 HD21 LEU 54 HD21 LEU 54 -3.294 -8.754 5.502 444 HD22 LEU 54 HD22 LEU 54 -4.125 -10.291 5.742 445 HD23 LEU 54 HD23 LEU 54 -4.199 -9.046 6.988 446 HA PRO 55 HA PRO 55 -9.652 -11.177 9.714 447 HB2 PRO 55 HB3 PRO 55 -7.348 -12.480 11.018 448 HB3 PRO 55 HB2 PRO 55 -8.964 -13.112 10.692 449 HG2 PRO 55 HG3 PRO 55 -6.833 -13.952 9.307 450 HG3 PRO 55 HG2 PRO 55 -8.421 -13.759 8.540 451 HD2 PRO 55 HD3 PRO 55 -6.031 -11.958 8.430 452 HD3 PRO 55 HD2 PRO 55 -7.156 -12.421 7.135 453 H GLU 56 H GLU 56 -9.815 -10.555 11.893 454 HA GLU 56 HA GLU 56 -9.677 -9.046 13.573 455 HB2 GLU 56 HB3 GLU 56 -7.189 -10.428 13.380 456 HB3 GLU 56 HB2 GLU 56 -6.870 -8.777 13.893 457 HG2 GLU 56 HG3 GLU 56 -9.052 -10.272 15.242 458 HG3 GLU 56 HG2 GLU 56 -7.382 -10.692 15.622 459 H ARG 57 H ARG 57 -9.543 -7.920 10.801 460 HA ARG 57 HA ARG 57 -8.764 -5.256 11.632 461 HB2 ARG 57 HB3 ARG 57 -7.288 -4.834 9.798 462 HB3 ARG 57 HB2 ARG 57 -6.719 -6.275 10.626 463 HG2 ARG 57 HG3 ARG 57 -6.989 -7.556 8.830 464 HG3 ARG 57 HG2 ARG 57 -8.577 -6.880 8.474 465 HD2 ARG 57 HD3 ARG 57 -5.904 -6.082 7.492 466 HD3 ARG 57 HD2 ARG 57 -7.442 -6.165 6.646 467 HE ARG 57 HE ARG 57 -7.966 -4.093 8.093 468 HH11 ARG 57 HH11 ARG 57 -4.871 -4.857 6.656 469 HH12 ARG 57 HH12 ARG 57 -4.367 -3.204 6.573 470 HH21 ARG 57 HH21 ARG 57 -7.301 -1.926 7.977 471 HH22 ARG 57 HH22 ARG 57 -5.744 -1.540 7.324 472 H THR 58 H THR 58 -9.178 -3.722 9.598 473 HA THR 58 HA THR 58 -11.862 -4.432 8.646 474 HB THR 58 HB THR 58 -10.738 -1.689 8.313 475 HG1 THR 58 HG1 THR 58 -10.728 -1.264 10.372 476 HG21 THR 58 HG21 THR 58 -12.966 -2.032 7.514 477 HG22 THR 58 HG22 THR 58 -13.031 -1.038 8.970 478 HG23 THR 58 HG23 THR 58 -13.453 -2.750 9.049 479 H ASN 59 H ASN 59 -12.092 -5.065 6.613 480 HA ASN 59 HA ASN 59 -9.901 -4.638 4.739 481 HB2 ASN 59 HB3 ASN 59 -12.376 -6.319 4.345 482 HB3 ASN 59 HB2 ASN 59 -10.879 -6.388 3.419 483 HD21 ASN 59 HD21 ASN 59 -9.087 -6.228 5.588 484 HD22 ASN 59 HD22 ASN 59 -9.187 -7.708 6.472 485 H VAL 60 H VAL 60 -9.991 -3.429 2.960 486 HA VAL 60 HA VAL 60 -12.565 -2.326 2.081 487 HB VAL 60 HB VAL 60 -10.068 -0.659 2.453 488 HG11 VAL 60 HG11 VAL 60 -12.621 -0.226 1.055 489 HG12 VAL 60 HG12 VAL 60 -11.041 0.513 0.795 490 HG13 VAL 60 HG13 VAL 60 -12.086 1.099 2.088 491 HG21 VAL 60 HG21 VAL 60 -12.123 0.427 3.972 492 HG22 VAL 60 HG22 VAL 60 -10.721 -0.457 4.573 493 HG23 VAL 60 HG23 VAL 60 -12.233 -1.309 4.261 494 H VAL 61 H VAL 61 -12.804 -2.444 -0.085 495 HA VAL 61 HA VAL 61 -10.375 -2.887 -1.695 496 HB VAL 61 HB VAL 61 -13.082 -4.138 -2.164 497 HG11 VAL 61 HG11 VAL 61 -11.806 -5.519 -3.814 498 HG12 VAL 61 HG12 VAL 61 -10.444 -4.422 -3.591 499 HG13 VAL 61 HG13 VAL 61 -11.964 -3.818 -4.249 500 HG21 VAL 61 HG21 VAL 61 -12.421 -5.997 -1.069 501 HG22 VAL 61 HG22 VAL 61 -11.367 -4.868 -0.217 502 HG23 VAL 61 HG23 VAL 61 -10.737 -5.819 -1.563 503 H LEU 62 H LEU 62 -10.405 -2.213 -3.862 504 HA LEU 62 HA LEU 62 -12.488 -0.282 -4.603 505 HB2 LEU 62 HB3 LEU 62 -10.389 0.815 -3.662 506 HB3 LEU 62 HB2 LEU 62 -9.551 0.209 -5.077 507 HG LEU 62 HG LEU 62 -11.350 1.478 -6.432 508 HD11 LEU 62 HD11 LEU 62 -12.493 1.896 -4.034 509 HD12 LEU 62 HD12 LEU 62 -12.715 2.957 -5.426 510 HD13 LEU 62 HD13 LEU 62 -11.531 3.367 -4.183 511 HD21 LEU 62 HD21 LEU 62 -10.049 3.549 -6.311 512 HD22 LEU 62 HD22 LEU 62 -9.005 2.127 -6.352 513 HD23 LEU 62 HD23 LEU 62 -9.279 2.976 -4.830 514 H THR 63 H THR 63 -13.402 -1.207 -6.327 515 HA THR 63 HA THR 63 -11.655 -2.140 -8.496 516 HB THR 63 HB THR 63 -12.501 -4.147 -7.512 517 HG1 THR 63 HG1 THR 63 -12.714 -4.496 -9.607 518 HG21 THR 63 HG21 THR 63 -14.349 -4.165 -6.305 519 HG22 THR 63 HG22 THR 63 -15.279 -4.049 -7.799 520 HG23 THR 63 HG23 THR 63 -14.825 -2.585 -6.927 521 H HIS 64 H HIS 64 -12.309 -1.591 -10.561 522 HA HIS 64 HA HIS 64 -13.980 0.655 -10.843 523 HB2 HIS 64 HB3 HIS 64 -12.465 -1.114 -12.653 524 HB3 HIS 64 HB2 HIS 64 -13.852 -0.316 -13.385 525 HD1 HIS 64 HD1 HIS 64 -13.516 2.374 -11.722 526 HD2 HIS 64 HD2 HIS 64 -10.552 0.434 -13.892 527 HE1 HIS 64 HE1 HIS 64 -11.814 4.143 -12.265 528 HE2 HIS 64 HE2 HIS 64 -10.075 2.965 -13.656 529 H GLN 65 H GLN 65 -14.603 -2.773 -11.080 530 HA GLN 65 HA GLN 65 -16.986 -2.798 -12.499 531 HB2 GLN 65 HB3 GLN 65 -15.863 -4.541 -10.336 532 HB3 GLN 65 HB2 GLN 65 -17.502 -4.814 -10.909 533 HG2 GLN 65 HG3 GLN 65 -16.814 -5.494 -12.988 534 HG3 GLN 65 HG2 GLN 65 -15.293 -4.606 -12.893 535 HE21 GLN 65 HE21 GLN 65 -14.109 -5.434 -10.689 536 HE22 GLN 65 HE22 GLN 65 -13.835 -7.140 -10.706 537 H GLU 66 H GLU 66 -19.002 -2.142 -12.100 538 HA GLU 66 HA GLU 66 -19.543 -0.734 -9.632 539 HB2 GLU 66 HB3 GLU 66 -21.725 -0.199 -10.754 540 HB3 GLU 66 HB2 GLU 66 -20.296 0.337 -11.626 541 HG2 GLU 66 HG3 GLU 66 -21.259 -2.332 -12.362 542 HG3 GLU 66 HG2 GLU 66 -22.366 -1.010 -12.729 543 H ASP 67 H ASP 67 -20.464 -3.744 -11.161 544 HA ASP 67 HA ASP 67 -22.409 -4.264 -9.034 545 HB2 ASP 67 HB3 ASP 67 -22.703 -4.667 -11.655 546 HB3 ASP 67 HB2 ASP 67 -21.980 -6.217 -11.234 547 H TYR 68 H TYR 68 -19.349 -4.431 -8.833 548 HA TYR 68 HA TYR 68 -18.844 -7.232 -8.426 549 HB2 TYR 68 HB3 TYR 68 -17.077 -5.562 -9.079 550 HB3 TYR 68 HB2 TYR 68 -17.175 -4.912 -7.446 551 HD1 TYR 68 HD1 TYR 68 -16.767 -8.222 -9.136 552 HD2 TYR 68 HD2 TYR 68 -15.630 -5.686 -5.915 553 HE1 TYR 68 HE1 TYR 68 -15.168 -9.924 -8.369 554 HE2 TYR 68 HE2 TYR 68 -14.025 -7.381 -5.140 555 HH TYR 68 HH TYR 68 -13.257 -10.188 -7.029 556 H GLN 69 H GLN 69 -18.623 -8.330 -6.490 557 HA GLN 69 HA GLN 69 -19.519 -6.915 -4.072 558 HB2 GLN 69 HB3 GLN 69 -20.359 -9.730 -4.758 559 HB3 GLN 69 HB2 GLN 69 -20.956 -8.718 -3.451 560 HG2 GLN 69 HG3 GLN 69 -21.295 -7.817 -6.270 561 HG3 GLN 69 HG2 GLN 69 -22.362 -9.060 -5.617 562 HE21 GLN 69 HE21 GLN 69 -21.058 -5.863 -4.815 563 HE22 GLN 69 HE22 GLN 69 -22.508 -5.260 -4.095 564 H ALA 70 H ALA 70 -17.771 -6.897 -2.807 565 HA ALA 70 HA ALA 70 -16.045 -9.263 -2.701 566 HB1 ALA 70 HB1 ALA 70 -15.480 -6.650 -1.337 567 HB2 ALA 70 HB2 ALA 70 -15.145 -6.890 -3.052 568 HB3 ALA 70 HB3 ALA 70 -14.347 -7.901 -1.847 569 H GLN 71 H GLN 71 -16.931 -10.705 -1.339 570 HA GLN 71 HA GLN 71 -18.367 -10.031 1.008 571 HB2 GLN 71 HB3 GLN 71 -17.265 -12.565 -0.144 572 HB3 GLN 71 HB2 GLN 71 -17.856 -12.555 1.512 573 HG2 GLN 71 HG3 GLN 71 -19.774 -13.145 0.486 574 HG3 GLN 71 HG2 GLN 71 -19.942 -11.396 0.339 575 HE21 GLN 71 HE21 GLN 71 -21.413 -12.347 -1.405 576 HE22 GLN 71 HE22 GLN 71 -20.714 -12.502 -2.977 577 H GLY 72 H GLY 72 -17.651 -9.496 2.955 578 HA2 GLY 72 HA3 GLY 72 -16.252 -9.891 4.857 579 HA3 GLY 72 HA2 GLY 72 -14.965 -10.374 3.763 580 H ALA 73 H ALA 73 -15.352 -8.064 1.968 581 HA ALA 73 HA ALA 73 -14.380 -5.932 3.758 582 HB1 ALA 73 HB1 ALA 73 -12.699 -5.337 2.184 583 HB2 ALA 73 HB2 ALA 73 -13.348 -6.449 0.979 584 HB3 ALA 73 HB3 ALA 73 -12.581 -7.079 2.437 585 H VAL 74 H VAL 74 -14.453 -3.742 2.706 586 HA VAL 74 HA VAL 74 -17.084 -3.342 1.556 587 HB VAL 74 HB VAL 74 -15.017 -1.214 2.108 588 HG11 VAL 74 HG11 VAL 74 -17.899 -1.263 1.433 589 HG12 VAL 74 HG12 VAL 74 -16.648 -0.101 0.992 590 HG13 VAL 74 HG13 VAL 74 -17.367 -0.054 2.602 591 HG21 VAL 74 HG21 VAL 74 -16.945 -2.541 3.995 592 HG22 VAL 74 HG22 VAL 74 -16.298 -0.926 4.286 593 HG23 VAL 74 HG23 VAL 74 -15.207 -2.308 4.185 594 H VAL 75 H VAL 75 -17.516 -2.461 -0.482 595 HA VAL 75 HA VAL 75 -15.205 -2.312 -2.305 596 HB VAL 75 HB VAL 75 -17.964 -3.248 -3.086 597 HG11 VAL 75 HG11 VAL 75 -15.319 -3.407 -4.528 598 HG12 VAL 75 HG12 VAL 75 -16.611 -2.259 -4.880 599 HG13 VAL 75 HG13 VAL 75 -16.873 -3.985 -5.129 600 HG21 VAL 75 HG21 VAL 75 -16.494 -5.461 -3.330 601 HG22 VAL 75 HG22 VAL 75 -17.379 -5.063 -1.858 602 HG23 VAL 75 HG23 VAL 75 -15.652 -4.720 -1.969 603 H VAL 76 H VAL 76 -15.056 -0.561 -3.584 604 HA VAL 76 HA VAL 76 -17.396 1.146 -3.966 605 HB VAL 76 HB VAL 76 -15.863 3.172 -3.552 606 HG11 VAL 76 HG11 VAL 76 -17.492 3.216 -2.016 607 HG12 VAL 76 HG12 VAL 76 -16.232 2.653 -0.918 608 HG13 VAL 76 HG13 VAL 76 -17.342 1.497 -1.653 609 HG21 VAL 76 HG21 VAL 76 -13.784 2.798 -2.879 610 HG22 VAL 76 HG22 VAL 76 -14.073 1.060 -2.871 611 HG23 VAL 76 HG23 VAL 76 -14.399 2.015 -1.424 612 H HIS 77 H HIS 77 -17.328 2.427 -5.803 613 HA HIS 77 HA HIS 77 -15.022 2.007 -7.582 614 HB2 HIS 77 HB3 HIS 77 -17.469 2.385 -9.078 615 HB3 HIS 77 HB2 HIS 77 -16.298 1.078 -9.175 616 HD1 HIS 77 HD1 HIS 77 -16.692 -0.917 -7.395 617 HD2 HIS 77 HD2 HIS 77 -19.870 1.690 -7.998 618 HE1 HIS 77 HE1 HIS 77 -18.719 -2.115 -6.517 619 HE2 HIS 77 HE2 HIS 77 -20.614 -0.479 -6.801 620 H ASP 78 H ASP 78 -14.819 4.164 -6.169 621 HA ASP 78 HA ASP 78 -14.991 6.261 -8.044 622 HB2 ASP 78 HB3 ASP 78 -17.222 5.987 -6.202 623 HB3 ASP 78 HB2 ASP 78 -16.403 7.532 -5.997 624 H VAL 79 H VAL 79 -13.638 7.974 -7.470 625 HA VAL 79 HA VAL 79 -11.721 7.396 -5.460 626 HB VAL 79 HB VAL 79 -11.178 9.982 -5.960 627 HG11 VAL 79 HG11 VAL 79 -10.302 7.430 -6.940 628 HG12 VAL 79 HG12 VAL 79 -9.367 8.893 -6.630 629 HG13 VAL 79 HG13 VAL 79 -10.139 8.658 -8.197 630 HG21 VAL 79 HG21 VAL 79 -12.382 9.074 -8.561 631 HG22 VAL 79 HG22 VAL 79 -11.741 10.664 -8.147 632 HG23 VAL 79 HG23 VAL 79 -13.247 10.105 -7.422 633 H ALA 80 H ALA 80 -14.170 9.918 -5.763 634 HA ALA 80 HA ALA 80 -13.782 10.924 -3.128 635 HB1 ALA 80 HB1 ALA 80 -14.751 12.572 -4.334 636 HB2 ALA 80 HB2 ALA 80 -16.240 11.826 -3.752 637 HB3 ALA 80 HB3 ALA 80 -15.634 11.445 -5.364 638 H ALA 81 H ALA 81 -15.553 8.278 -4.459 639 HA ALA 81 HA ALA 81 -17.624 8.003 -2.603 640 HB1 ALA 81 HB1 ALA 81 -17.264 5.471 -3.132 641 HB2 ALA 81 HB2 ALA 81 -16.121 6.079 -4.328 642 HB3 ALA 81 HB3 ALA 81 -17.815 6.564 -4.402 643 H VAL 82 H VAL 82 -14.669 6.011 -2.622 644 HA VAL 82 HA VAL 82 -14.851 5.053 -0.054 645 HB VAL 82 HB VAL 82 -13.222 4.363 -1.867 646 HG11 VAL 82 HG11 VAL 82 -11.148 5.438 -2.105 647 HG12 VAL 82 HG12 VAL 82 -11.423 6.459 -0.694 648 HG13 VAL 82 HG13 VAL 82 -12.354 6.721 -2.169 649 HG21 VAL 82 HG21 VAL 82 -11.946 4.752 0.830 650 HG22 VAL 82 HG22 VAL 82 -11.645 3.463 -0.335 651 HG23 VAL 82 HG23 VAL 82 -13.193 3.548 0.505 652 H PHE 83 H PHE 83 -13.299 8.072 -1.141 653 HA PHE 83 HA PHE 83 -12.122 8.827 1.251 654 HB2 PHE 83 HB3 PHE 83 -13.078 10.255 -1.160 655 HB3 PHE 83 HB2 PHE 83 -12.860 11.242 0.282 656 HD1 PHE 83 HD2 PHE 83 -10.550 10.113 1.569 657 HD2 PHE 83 HD1 PHE 83 -11.312 10.674 -2.580 658 HE1 PHE 83 HE2 PHE 83 -8.129 10.204 1.142 659 HE2 PHE 83 HE1 PHE 83 -8.891 10.763 -3.016 660 HZ PHE 83 HZ PHE 83 -7.297 10.528 -1.152 661 H ALA 84 H ALA 84 -15.472 9.289 0.191 662 HA ALA 84 HA ALA 84 -16.287 10.842 2.407 663 HB1 ALA 84 HB1 ALA 84 -17.736 10.838 0.542 664 HB2 ALA 84 HB2 ALA 84 -18.598 9.957 1.803 665 HB3 ALA 84 HB3 ALA 84 -17.804 9.076 0.498 666 H TYR 85 H TYR 85 -16.025 7.411 1.818 667 HA TYR 85 HA TYR 85 -17.348 6.487 4.124 668 HB2 TYR 85 HB3 TYR 85 -16.900 4.524 3.137 669 HB3 TYR 85 HB2 TYR 85 -15.848 5.338 1.990 670 HD1 TYR 85 HD1 TYR 85 -15.848 3.816 5.395 671 HD2 TYR 85 HD2 TYR 85 -13.578 4.847 1.953 672 HE1 TYR 85 HE1 TYR 85 -13.911 2.607 6.311 673 HE2 TYR 85 HE2 TYR 85 -11.640 3.646 2.855 674 HH TYR 85 HH TYR 85 -11.046 2.030 4.424 675 H ALA 86 H ALA 86 -13.827 6.791 3.558 676 HA ALA 86 HA ALA 86 -12.831 6.343 6.020 677 HB1 ALA 86 HB1 ALA 86 -11.718 8.764 4.747 678 HB2 ALA 86 HB2 ALA 86 -11.767 7.305 3.757 679 HB3 ALA 86 HB3 ALA 86 -10.911 7.296 5.300 680 H LYS 87 H LYS 87 -14.536 9.274 5.025 681 HA LYS 87 HA LYS 87 -13.951 10.835 7.306 682 HB2 LYS 87 HB3 LYS 87 -15.317 11.261 4.977 683 HB3 LYS 87 HB2 LYS 87 -16.639 11.169 6.133 684 HG2 LYS 87 HG3 LYS 87 -16.268 13.332 6.490 685 HG3 LYS 87 HG2 LYS 87 -14.845 12.816 7.398 686 HD2 LYS 87 HD3 LYS 87 -14.020 12.800 4.743 687 HD3 LYS 87 HD2 LYS 87 -15.021 14.246 4.884 688 HE2 LYS 87 HE3 LYS 87 -13.622 15.231 6.418 689 HE3 LYS 87 HE2 LYS 87 -12.998 13.687 6.998 690 HZ1 LYS 87 HZ1 LYS 87 -11.554 15.239 5.496 691 HZ2 LYS 87 HZ2 LYS 87 -12.406 14.491 4.241 692 HZ3 LYS 87 HZ3 LYS 87 -11.487 13.558 5.311 693 H GLN 88 H GLN 88 -16.631 8.701 6.520 694 HA GLN 88 HA GLN 88 -18.115 8.952 8.871 695 HB2 GLN 88 HB3 GLN 88 -18.494 7.583 6.596 696 HB3 GLN 88 HB2 GLN 88 -17.981 6.255 7.628 697 HG2 GLN 88 HG3 GLN 88 -19.789 6.571 9.105 698 HG3 GLN 88 HG2 GLN 88 -20.185 8.139 8.402 699 HE21 GLN 88 HE21 GLN 88 -21.095 8.190 6.288 700 HE22 GLN 88 HE22 GLN 88 -21.976 6.834 5.680 701 H HIS 89 H HIS 89 -15.126 7.359 8.285 702 HA HIS 89 HA HIS 89 -15.216 6.099 10.944 703 HB2 HIS 89 HB3 HIS 89 -14.053 5.287 8.348 704 HB3 HIS 89 HB2 HIS 89 -13.049 4.975 9.761 705 HD1 HIS 89 HD1 HIS 89 -15.098 4.050 11.790 706 HD2 HIS 89 HD2 HIS 89 -15.154 2.879 7.805 707 HE1 HIS 89 HE1 HIS 89 -16.391 1.893 11.742 708 HE2 HIS 89 HE2 HIS 89 -16.491 1.252 9.307 709 HA PRO 90 HA PRO 90 -12.315 9.711 11.210 710 HB2 PRO 90 HB3 PRO 90 -13.015 10.412 13.739 711 HB3 PRO 90 HB2 PRO 90 -13.885 10.967 12.305 712 HG2 PRO 90 HG3 PRO 90 -14.556 8.731 14.179 713 HG3 PRO 90 HG2 PRO 90 -15.624 9.961 13.477 714 HD2 PRO 90 HD3 PRO 90 -15.476 7.447 12.498 715 HD3 PRO 90 HD2 PRO 90 -15.780 8.854 11.458 716 H ASP 91 H ASP 91 -13.005 7.366 13.835 717 HA ASP 91 HA ASP 91 -10.465 7.667 15.048 718 HB2 ASP 91 HB3 ASP 91 -12.586 5.533 15.267 719 HB3 ASP 91 HB2 ASP 91 -11.104 5.510 16.218 720 H GLN 92 H GLN 92 -11.413 6.038 12.220 721 HA GLN 92 HA GLN 92 -9.143 4.189 12.381 722 HB2 GLN 92 HB3 GLN 92 -11.256 4.276 10.232 723 HB3 GLN 92 HB2 GLN 92 -10.135 2.969 10.588 724 HG2 GLN 92 HG3 GLN 92 -11.505 3.332 12.961 725 HG3 GLN 92 HG2 GLN 92 -12.736 3.546 11.717 726 HE21 GLN 92 HE21 GLN 92 -13.239 1.830 10.353 727 HE22 GLN 92 HE22 GLN 92 -12.789 0.203 10.720 728 H GLU 93 H GLU 93 -7.639 4.028 10.652 729 HA GLU 93 HA GLU 93 -7.322 6.547 9.161 730 HB2 GLU 93 HB3 GLU 93 -5.570 5.426 10.922 731 HB3 GLU 93 HB2 GLU 93 -4.988 4.762 9.402 732 HG2 GLU 93 HG3 GLU 93 -4.561 6.898 8.513 733 HG3 GLU 93 HG2 GLU 93 -5.482 7.696 9.788 734 H LEU 94 H LEU 94 -6.611 6.468 6.992 735 HA LEU 94 HA LEU 94 -7.332 3.969 5.637 736 HB2 LEU 94 HB3 LEU 94 -8.110 6.557 5.165 737 HB3 LEU 94 HB2 LEU 94 -6.838 6.336 3.978 738 HG LEU 94 HG LEU 94 -8.205 4.093 3.502 739 HD11 LEU 94 HD11 LEU 94 -10.262 4.005 4.326 740 HD12 LEU 94 HD12 LEU 94 -10.625 5.625 3.731 741 HD13 LEU 94 HD13 LEU 94 -9.880 5.414 5.315 742 HD21 LEU 94 HD21 LEU 94 -8.842 6.850 2.465 743 HD22 LEU 94 HD22 LEU 94 -9.392 5.351 1.716 744 HD23 LEU 94 HD23 LEU 94 -7.667 5.708 1.813 745 H VAL 95 H VAL 95 -5.855 2.761 4.643 746 HA VAL 95 HA VAL 95 -3.292 3.968 3.878 747 HB VAL 95 HB VAL 95 -3.471 1.312 5.300 748 HG11 VAL 95 HG11 VAL 95 -1.250 1.092 4.985 749 HG12 VAL 95 HG12 VAL 95 -0.947 2.821 5.157 750 HG13 VAL 95 HG13 VAL 95 -1.541 2.178 3.626 751 HG21 VAL 95 HG21 VAL 95 -2.106 2.868 7.015 752 HG22 VAL 95 HG22 VAL 95 -3.847 2.606 7.115 753 HG23 VAL 95 HG23 VAL 95 -3.217 4.061 6.342 754 H ILE 96 H ILE 96 -2.877 3.546 1.818 755 HA ILE 96 HA ILE 96 -4.313 1.417 0.456 756 HB ILE 96 HB ILE 96 -2.509 3.610 -0.576 757 HG12 ILE 96 HG13 ILE 96 -4.587 4.450 -1.601 758 HG13 ILE 96 HG12 ILE 96 -5.480 3.114 -0.881 759 HG21 ILE 96 HG21 ILE 96 -2.208 1.680 -1.998 760 HG22 ILE 96 HG22 ILE 96 -3.186 2.883 -2.838 761 HG23 ILE 96 HG23 ILE 96 -3.954 1.464 -2.126 762 HD11 ILE 96 HD11 ILE 96 -5.605 5.376 0.267 763 HD12 ILE 96 HD12 ILE 96 -3.949 5.070 0.792 764 HD13 ILE 96 HD13 ILE 96 -5.244 3.975 1.275 765 H ALA 97 H ALA 97 -3.461 -0.547 0.657 766 HA ALA 97 HA ALA 97 -0.612 -0.951 0.918 767 HB1 ALA 97 HB1 ALA 97 -2.509 -3.216 0.547 768 HB2 ALA 97 HB2 ALA 97 -2.591 -2.267 2.032 769 HB3 ALA 97 HB3 ALA 97 -1.093 -3.087 1.591 770 H GLY 98 H GLY 98 -3.015 -1.144 -1.594 771 HA2 GLY 98 HA3 GLY 98 -1.270 -1.088 -3.719 772 HA3 GLY 98 HA2 GLY 98 -1.487 -2.795 -3.365 773 H GLY 99 H GLY 99 -3.965 -1.966 -5.950 774 HA2 GLY 99 HA3 GLY 99 -1.117 -2.379 -5.405 775 HA3 GLY 99 HA2 GLY 99 -1.945 -2.703 -6.917 776 H ALA 100 H ALA 100 -0.451 -1.588 -8.160 777 HA ALA 100 HA ALA 100 0.469 1.014 -7.654 778 HB1 ALA 100 HB1 ALA 100 0.619 0.864 -10.350 779 HB2 ALA 100 HB2 ALA 100 0.486 -0.845 -9.933 780 HB3 ALA 100 HB3 ALA 100 1.787 0.131 -9.250 781 H GLN 101 H GLN 101 -2.290 -0.157 -9.543 782 HA GLN 101 HA GLN 101 -3.111 2.245 -10.670 783 HB2 GLN 101 HB3 GLN 101 -4.147 -0.383 -10.404 784 HB3 GLN 101 HB2 GLN 101 -5.419 0.726 -9.914 785 HG2 GLN 101 HG3 GLN 101 -3.928 1.258 -12.434 786 HG3 GLN 101 HG2 GLN 101 -5.156 -0.007 -12.408 787 HE21 GLN 101 HE21 GLN 101 -4.709 3.354 -11.356 788 HE22 GLN 101 HE22 GLN 101 -6.283 3.890 -11.825 789 H ILE 102 H ILE 102 -3.685 0.947 -7.451 790 HA ILE 102 HA ILE 102 -5.591 2.909 -6.670 791 HB ILE 102 HB ILE 102 -3.793 1.308 -4.851 792 HG12 ILE 102 HG13 ILE 102 -4.975 -0.168 -6.430 793 HG13 ILE 102 HG12 ILE 102 -5.577 -0.366 -4.788 794 HG21 ILE 102 HG21 ILE 102 -6.489 2.582 -4.406 795 HG22 ILE 102 HG22 ILE 102 -4.950 3.136 -3.749 796 HG23 ILE 102 HG23 ILE 102 -5.621 1.587 -3.237 797 HD11 ILE 102 HD11 ILE 102 -6.962 1.511 -6.640 798 HD12 ILE 102 HD12 ILE 102 -7.601 0.601 -5.271 799 HD13 ILE 102 HD13 ILE 102 -7.230 -0.226 -6.784 800 H PHE 103 H PHE 103 -2.095 2.707 -6.572 801 HA PHE 103 HA PHE 103 -1.737 4.974 -4.866 802 HB2 PHE 103 HB3 PHE 103 0.139 3.467 -6.689 803 HB3 PHE 103 HB2 PHE 103 0.651 4.842 -5.716 804 HD1 PHE 103 HD1 PHE 103 -0.573 4.487 -3.173 805 HD2 PHE 103 HD2 PHE 103 0.987 1.531 -5.807 806 HE1 PHE 103 HE1 PHE 103 -0.191 2.989 -1.259 807 HE2 PHE 103 HE2 PHE 103 1.371 0.027 -3.898 808 HZ PHE 103 HZ PHE 103 0.782 0.755 -1.620 809 H THR 104 H THR 104 -2.048 4.458 -8.304 810 HA THR 104 HA THR 104 -1.013 6.891 -9.230 811 HB THR 104 HB THR 104 -3.195 5.151 -10.392 812 HG1 THR 104 HG1 THR 104 -0.474 5.328 -11.141 813 HG21 THR 104 HG21 THR 104 -2.467 7.708 -11.232 814 HG22 THR 104 HG22 THR 104 -3.406 6.508 -12.121 815 HG23 THR 104 HG23 THR 104 -1.657 6.593 -12.334 816 H ALA 105 H ALA 105 -4.450 6.015 -8.752 817 HA ALA 105 HA ALA 105 -5.502 8.549 -9.205 818 HB1 ALA 105 HB1 ALA 105 -7.484 7.777 -7.986 819 HB2 ALA 105 HB2 ALA 105 -6.567 6.398 -7.378 820 HB3 ALA 105 HB3 ALA 105 -6.888 6.551 -9.105 821 H PHE 106 H PHE 106 -4.881 7.048 -6.013 822 HA PHE 106 HA PHE 106 -5.377 9.394 -4.557 823 HB2 PHE 106 HB3 PHE 106 -3.886 6.859 -3.897 824 HB3 PHE 106 HB2 PHE 106 -4.110 8.155 -2.729 825 HD1 PHE 106 HD2 PHE 106 -6.020 5.891 -4.982 826 HD2 PHE 106 HD1 PHE 106 -6.010 8.210 -1.414 827 HE1 PHE 106 HE2 PHE 106 -8.213 4.955 -4.374 828 HE2 PHE 106 HE1 PHE 106 -8.202 7.277 -0.799 829 HZ PHE 106 HZ PHE 106 -9.303 5.648 -2.282 830 H LYS 107 H LYS 107 -2.698 8.562 -6.501 831 HA LYS 107 HA LYS 107 -0.469 9.467 -5.251 832 HB2 LYS 107 HB3 LYS 107 0.491 9.834 -7.333 833 HB3 LYS 107 HB2 LYS 107 -0.817 8.725 -7.710 834 HG2 LYS 107 HG3 LYS 107 -2.199 10.745 -8.322 835 HG3 LYS 107 HG2 LYS 107 -0.715 11.690 -8.191 836 HD2 LYS 107 HD3 LYS 107 -0.527 9.253 -9.834 837 HD3 LYS 107 HD2 LYS 107 -1.577 10.518 -10.473 838 HE2 LYS 107 HE3 LYS 107 0.750 11.808 -9.567 839 HE3 LYS 107 HE2 LYS 107 1.290 10.375 -10.440 840 HZ1 LYS 107 HZ1 LYS 107 -0.487 11.231 -12.155 841 HZ2 LYS 107 HZ2 LYS 107 1.093 11.834 -12.153 842 HZ3 LYS 107 HZ3 LYS 107 -0.151 12.721 -11.427 843 H ASP 108 H ASP 108 -2.968 11.512 -6.696 844 HA ASP 108 HA ASP 108 -1.624 13.929 -5.797 845 HB2 ASP 108 HB3 ASP 108 -2.818 13.744 -8.025 846 HB3 ASP 108 HB2 ASP 108 -4.329 13.720 -7.122 847 H ASP 109 H ASP 109 -4.422 11.967 -5.013 848 HA ASP 109 HA ASP 109 -5.385 13.843 -3.027 849 HB2 ASP 109 HB3 ASP 109 -6.331 11.220 -4.109 850 HB3 ASP 109 HB2 ASP 109 -6.974 11.804 -2.579 851 H VAL 110 H VAL 110 -2.783 11.989 -2.907 852 HA VAL 110 HA VAL 110 -3.260 10.622 -0.399 853 HB VAL 110 HB VAL 110 -1.810 9.594 -2.095 854 HG11 VAL 110 HG11 VAL 110 0.460 11.383 -1.536 855 HG12 VAL 110 HG12 VAL 110 -0.819 12.064 -2.541 856 HG13 VAL 110 HG13 VAL 110 -0.010 10.575 -3.031 857 HG21 VAL 110 HG21 VAL 110 -0.353 10.334 0.441 858 HG22 VAL 110 HG22 VAL 110 0.034 8.973 -0.611 859 HG23 VAL 110 HG23 VAL 110 -1.503 9.011 0.254 860 H ASP 111 H ASP 111 -2.116 11.019 1.542 861 HA ASP 111 HA ASP 111 -1.082 13.766 1.798 862 HB2 ASP 111 HB3 ASP 111 -3.291 12.526 3.131 863 HB3 ASP 111 HB2 ASP 111 -2.040 12.878 4.320 864 H THR 112 H THR 112 -0.852 10.423 2.908 865 HA THR 112 HA THR 112 1.764 11.074 4.095 866 HB THR 112 HB THR 112 -0.005 8.727 4.796 867 HG1 THR 112 HG1 THR 112 -0.541 9.904 6.630 868 HG21 THR 112 HG21 THR 112 2.001 8.032 5.591 869 HG22 THR 112 HG22 THR 112 1.490 9.032 6.950 870 HG23 THR 112 HG23 THR 112 2.630 9.670 5.765 871 H LEU 113 H LEU 113 3.454 9.483 3.867 872 HA LEU 113 HA LEU 113 3.080 7.535 1.716 873 HB2 LEU 113 HB3 LEU 113 4.294 9.990 1.312 874 HB3 LEU 113 HB2 LEU 113 5.646 8.904 1.559 875 HG LEU 113 HG LEU 113 4.992 7.543 -0.304 876 HD11 LEU 113 HD11 LEU 113 2.857 9.065 -1.434 877 HD12 LEU 113 HD12 LEU 113 2.413 8.577 0.199 878 HD13 LEU 113 HD13 LEU 113 2.888 7.361 -0.984 879 HD21 LEU 113 HD21 LEU 113 4.728 9.589 -2.030 880 HD22 LEU 113 HD22 LEU 113 6.254 9.143 -1.266 881 HD23 LEU 113 HD23 LEU 113 5.284 10.457 -0.598 882 H LEU 114 H LEU 114 3.694 5.641 2.483 883 HA LEU 114 HA LEU 114 6.065 5.499 4.228 884 HB2 LEU 114 HB3 LEU 114 3.580 3.784 4.373 885 HB3 LEU 114 HB2 LEU 114 5.019 3.568 5.351 886 HG LEU 114 HG LEU 114 3.599 6.193 5.452 887 HD11 LEU 114 HD11 LEU 114 2.588 3.598 6.496 888 HD12 LEU 114 HD12 LEU 114 1.702 4.989 5.869 889 HD13 LEU 114 HD13 LEU 114 2.397 5.042 7.489 890 HD21 LEU 114 HD21 LEU 114 4.756 6.497 7.371 891 HD22 LEU 114 HD22 LEU 114 5.838 5.314 6.634 892 HD23 LEU 114 HD23 LEU 114 4.652 4.798 7.833 893 H VAL 115 H VAL 115 7.649 4.647 3.012 894 HA VAL 115 HA VAL 115 6.956 2.333 1.320 895 HB VAL 115 HB VAL 115 8.634 3.028 -0.298 896 HG11 VAL 115 HG11 VAL 115 6.231 3.843 -0.358 897 HG12 VAL 115 HG12 VAL 115 7.398 4.748 -1.321 898 HG13 VAL 115 HG13 VAL 115 6.851 5.386 0.229 899 HG21 VAL 115 HG21 VAL 115 9.653 5.270 -0.148 900 HG22 VAL 115 HG22 VAL 115 10.184 4.193 1.144 901 HG23 VAL 115 HG23 VAL 115 8.983 5.442 1.474 902 H THR 116 H THR 116 8.494 0.732 1.028 903 HA THR 116 HA THR 116 10.678 0.695 3.007 904 HB THR 116 HB THR 116 8.906 -1.551 2.024 905 HG1 THR 116 HG1 THR 116 8.366 -1.700 4.194 906 HG21 THR 116 HG21 THR 116 11.296 -1.790 3.835 907 HG22 THR 116 HG22 THR 116 11.193 -2.390 2.179 908 HG23 THR 116 HG23 THR 116 10.154 -3.072 3.430 909 H ARG 117 H ARG 117 12.370 1.305 1.736 910 HA ARG 117 HA ARG 117 12.680 0.283 -0.938 911 HB2 ARG 117 HB3 ARG 117 13.858 2.385 0.685 912 HB3 ARG 117 HB2 ARG 117 15.079 1.500 -0.219 913 HG2 ARG 117 HG3 ARG 117 12.761 2.163 -1.838 914 HG3 ARG 117 HG2 ARG 117 13.545 3.587 -1.152 915 HD2 ARG 117 HD3 ARG 117 15.429 3.304 -2.374 916 HD3 ARG 117 HD2 ARG 117 15.335 1.544 -2.308 917 HE ARG 117 HE ARG 117 14.188 1.565 -4.289 918 HH11 ARG 117 HH11 ARG 117 14.191 4.790 -2.954 919 HH12 ARG 117 HH12 ARG 117 13.501 5.511 -4.369 920 HH21 ARG 117 HH21 ARG 117 13.281 2.513 -6.151 921 HH22 ARG 117 HH22 ARG 117 12.984 4.219 -6.184 922 H LEU 118 H LEU 118 13.235 -1.779 -1.167 923 HA LEU 118 HA LEU 118 14.837 -3.215 0.703 924 HB2 LEU 118 HB3 LEU 118 13.388 -3.771 -1.772 925 HB3 LEU 118 HB2 LEU 118 14.886 -4.672 -1.651 926 HG LEU 118 HG LEU 118 14.072 -5.400 0.660 927 HD11 LEU 118 HD11 LEU 118 12.130 -3.560 0.290 928 HD12 LEU 118 HD12 LEU 118 11.993 -4.940 1.379 929 HD13 LEU 118 HD13 LEU 118 11.302 -5.023 -0.242 930 HD21 LEU 118 HD21 LEU 118 13.914 -7.232 -0.593 931 HD22 LEU 118 HD22 LEU 118 13.339 -6.327 -1.993 932 HD23 LEU 118 HD23 LEU 118 12.201 -6.844 -0.749 933 H ALA 119 H ALA 119 16.880 -4.305 0.129 934 HA ALA 119 HA ALA 119 18.693 -2.411 -1.133 935 HB1 ALA 119 HB1 ALA 119 18.912 -4.076 1.062 936 HB2 ALA 119 HB2 ALA 119 20.225 -3.189 0.289 937 HB3 ALA 119 HB3 ALA 119 19.906 -4.864 -0.163 938 H GLY 120 H GLY 120 17.478 -5.678 -1.592 939 HA2 GLY 120 HA3 GLY 120 19.253 -6.384 -3.695 940 HA3 GLY 120 HA2 GLY 120 17.740 -7.186 -3.306 941 H SER 121 H SER 121 18.985 -6.411 -5.891 942 HA SER 121 HA SER 121 17.020 -4.501 -6.924 943 HB2 SER 121 HB3 SER 121 19.470 -5.702 -8.239 944 HB3 SER 121 HB2 SER 121 18.414 -4.491 -8.966 945 HG SER 121 HG SER 121 20.178 -4.232 -6.787 946 H PHE 122 H PHE 122 15.168 -5.340 -7.611 947 HA PHE 122 HA PHE 122 15.219 -7.982 -8.915 948 HB2 PHE 122 HB3 PHE 122 12.955 -6.631 -7.431 949 HB3 PHE 122 HB2 PHE 122 12.844 -8.187 -8.247 950 HD1 PHE 122 HD2 PHE 122 14.453 -6.384 -5.457 951 HD2 PHE 122 HD1 PHE 122 13.597 -10.165 -7.211 952 HE1 PHE 122 HE2 PHE 122 15.219 -7.504 -3.405 953 HE2 PHE 122 HE1 PHE 122 14.361 -11.293 -5.162 954 HZ PHE 122 HZ PHE 122 15.174 -9.962 -3.256 955 H GLU 123 H GLU 123 13.513 -8.309 -10.574 956 HA GLU 123 HA GLU 123 12.818 -5.838 -12.001 957 HB2 GLU 123 HB3 GLU 123 13.467 -6.834 -14.131 958 HB3 GLU 123 HB2 GLU 123 14.843 -6.760 -13.039 959 HG2 GLU 123 HG3 GLU 123 13.706 -9.252 -12.572 960 HG3 GLU 123 HG2 GLU 123 13.624 -9.036 -14.320 961 H GLY 124 H GLY 124 10.825 -5.812 -12.901 962 HA2 GLY 124 HA3 GLY 124 9.378 -8.277 -13.387 963 HA3 GLY 124 HA2 GLY 124 8.747 -7.301 -12.068 964 H ASP 125 H ASP 125 6.911 -6.441 -12.817 965 HA ASP 125 HA ASP 125 7.085 -4.660 -15.115 966 HB2 ASP 125 HB3 ASP 125 6.168 -7.140 -15.611 967 HB3 ASP 125 HB2 ASP 125 4.668 -6.382 -15.085 968 H THR 126 H THR 126 6.758 -4.392 -12.193 969 HA THR 126 HA THR 126 4.444 -2.630 -12.269 970 HB THR 126 HB THR 126 4.684 -4.460 -9.908 971 HG1 THR 126 HG1 THR 126 3.167 -5.834 -10.953 972 HG21 THR 126 HG21 THR 126 2.661 -3.725 -9.311 973 HG22 THR 126 HG22 THR 126 2.064 -3.699 -10.970 974 HG23 THR 126 HG23 THR 126 3.044 -2.363 -10.364 975 H LYS 127 H LYS 127 5.474 -0.777 -11.854 976 HA LYS 127 HA LYS 127 7.180 -0.659 -9.453 977 HB2 LYS 127 HB3 LYS 127 8.372 1.233 -10.614 978 HB3 LYS 127 HB2 LYS 127 8.625 -0.357 -11.322 979 HG2 LYS 127 HG3 LYS 127 6.402 1.226 -12.440 980 HG3 LYS 127 HG2 LYS 127 8.033 1.825 -12.753 981 HD2 LYS 127 HD3 LYS 127 7.477 -1.070 -13.168 982 HD3 LYS 127 HD2 LYS 127 6.874 0.082 -14.362 983 HE2 LYS 127 HE3 LYS 127 9.401 0.974 -14.065 984 HE3 LYS 127 HE2 LYS 127 9.637 -0.743 -13.741 985 HZ1 LYS 127 HZ1 LYS 127 8.921 0.595 -16.218 986 HZ2 LYS 127 HZ2 LYS 127 8.125 -0.867 -15.918 987 HZ3 LYS 127 HZ3 LYS 127 9.815 -0.821 -15.969 988 H MET 128 H MET 128 7.310 1.575 -8.514 989 HA MET 128 HA MET 128 4.720 2.515 -7.913 990 HB2 MET 128 HB3 MET 128 6.718 2.687 -6.415 991 HB3 MET 128 HB2 MET 128 7.333 3.962 -7.459 992 HG2 MET 128 HG3 MET 128 6.237 4.841 -5.458 993 HG3 MET 128 HG2 MET 128 5.437 5.359 -6.939 994 HE1 MET 128 HE1 MET 128 2.488 5.629 -5.719 995 HE2 MET 128 HE2 MET 128 4.032 6.155 -5.049 996 HE3 MET 128 HE3 MET 128 2.931 5.185 -4.071 997 H ILE 129 H ILE 129 3.996 4.784 -8.158 998 HA ILE 129 HA ILE 129 4.478 5.692 -10.904 999 HB ILE 129 HB ILE 129 2.377 7.009 -10.589 1000 HG12 ILE 129 HG13 ILE 129 1.131 5.661 -8.492 1001 HG13 ILE 129 HG12 ILE 129 2.728 6.046 -7.863 1002 HG21 ILE 129 HG21 ILE 129 2.657 4.126 -10.762 1003 HG22 ILE 129 HG22 ILE 129 1.644 5.223 -11.700 1004 HG23 ILE 129 HG23 ILE 129 1.076 4.611 -10.146 1005 HD11 ILE 129 HD11 ILE 129 1.184 7.791 -7.301 1006 HD12 ILE 129 HD12 ILE 129 0.735 7.986 -8.995 1007 HD13 ILE 129 HD13 ILE 129 2.364 8.398 -8.461 1008 HA PRO 130 HA PRO 130 6.580 9.401 -9.788 1009 HB2 PRO 130 HB3 PRO 130 5.224 11.269 -11.314 1010 HB3 PRO 130 HB2 PRO 130 6.516 10.223 -11.910 1011 HG2 PRO 130 HG3 PRO 130 3.553 9.899 -12.143 1012 HG3 PRO 130 HG2 PRO 130 4.816 9.572 -13.345 1013 HD2 PRO 130 HD3 PRO 130 3.655 7.589 -11.971 1014 HD3 PRO 130 HD2 PRO 130 5.383 7.539 -12.378 1015 H LEU 131 H LEU 131 6.451 11.111 -8.366 1016 HA LEU 131 HA LEU 131 3.832 12.082 -7.531 1017 HB2 LEU 131 HB3 LEU 131 5.631 11.364 -5.294 1018 HB3 LEU 131 HB2 LEU 131 3.880 11.346 -5.377 1019 HG LEU 131 HG LEU 131 5.421 9.275 -6.886 1020 HD11 LEU 131 HD11 LEU 131 4.637 8.713 -4.076 1021 HD12 LEU 131 HD12 LEU 131 6.148 9.575 -4.372 1022 HD13 LEU 131 HD13 LEU 131 5.892 7.976 -5.071 1023 HD21 LEU 131 HD21 LEU 131 3.463 8.050 -6.769 1024 HD22 LEU 131 HD22 LEU 131 2.859 9.701 -6.909 1025 HD23 LEU 131 HD23 LEU 131 2.892 8.905 -5.336 1026 H ASN 132 H ASN 132 3.925 14.018 -6.245 1027 HA ASN 132 HA ASN 132 6.172 15.694 -6.953 1028 HB2 ASN 132 HB3 ASN 132 3.539 16.230 -6.711 1029 HB3 ASN 132 HB2 ASN 132 4.081 16.712 -5.106 1030 HD21 ASN 132 HD21 ASN 132 6.495 17.796 -5.537 1031 HD22 ASN 132 HD22 ASN 132 6.371 19.181 -6.562 1032 H TRP 133 H TRP 133 7.744 14.494 -5.712 1033 HA TRP 133 HA TRP 133 7.662 14.076 -2.972 1034 HB2 TRP 133 HB3 TRP 133 10.048 14.552 -4.761 1035 HB3 TRP 133 HB2 TRP 133 10.141 13.931 -3.114 1036 HD1 TRP 133 HD1 TRP 133 9.025 12.917 -6.636 1037 HE1 TRP 133 HE1 TRP 133 8.747 10.359 -6.708 1038 HE3 TRP 133 HE3 TRP 133 9.673 11.889 -1.670 1039 HZ2 TRP 133 HZ2 TRP 133 8.800 8.192 -4.900 1040 HZ3 TRP 133 HZ3 TRP 133 9.542 9.548 -0.923 1041 HH2 TRP 133 HH2 TRP 133 9.114 7.739 -2.506 1042 H ASP 134 H ASP 134 8.734 16.987 -4.738 1043 HA ASP 134 HA ASP 134 9.919 18.330 -2.618 1044 HB2 ASP 134 HB3 ASP 134 9.024 18.955 -5.263 1045 HB3 ASP 134 HB2 ASP 134 8.497 20.238 -4.177 1046 H ASP 135 H ASP 135 6.518 18.173 -3.574 1047 HA ASP 135 HA ASP 135 5.619 19.982 -1.561 1048 HB2 ASP 135 HB3 ASP 135 4.364 18.235 -3.597 1049 HB3 ASP 135 HB2 ASP 135 3.373 18.629 -2.195 1050 H PHE 136 H PHE 136 6.915 16.995 -1.184 1051 HA PHE 136 HA PHE 136 5.276 16.466 1.203 1052 HB2 PHE 136 HB3 PHE 136 6.442 14.553 -0.800 1053 HB3 PHE 136 HB2 PHE 136 6.082 14.033 0.844 1054 HD1 PHE 136 HD1 PHE 136 3.667 14.615 1.682 1055 HD2 PHE 136 HD2 PHE 136 4.813 14.359 -2.406 1056 HE1 PHE 136 HE1 PHE 136 1.319 14.238 1.054 1057 HE2 PHE 136 HE2 PHE 136 2.466 13.981 -3.045 1058 HZ PHE 136 HZ PHE 136 0.715 13.920 -1.313 1059 H THR 137 H THR 137 6.304 16.253 3.077 1060 HA THR 137 HA THR 137 9.250 16.366 3.040 1061 HB THR 137 HB THR 137 7.313 17.397 5.122 1062 HG1 THR 137 HG1 THR 137 7.756 19.360 4.329 1063 HG21 THR 137 HG21 THR 137 10.143 18.224 5.151 1064 HG22 THR 137 HG22 THR 137 9.779 16.605 5.747 1065 HG23 THR 137 HG23 THR 137 9.002 18.009 6.479 1066 H LYS 138 H LYS 138 10.425 14.939 4.181 1067 HA LYS 138 HA LYS 138 9.274 12.487 4.933 1068 HB2 LYS 138 HB3 LYS 138 11.633 12.830 4.166 1069 HB3 LYS 138 HB2 LYS 138 11.987 13.523 5.744 1070 HG2 LYS 138 HG3 LYS 138 12.156 11.524 6.698 1071 HG3 LYS 138 HG2 LYS 138 10.680 10.939 5.936 1072 HD2 LYS 138 HD3 LYS 138 12.304 9.550 5.037 1073 HD3 LYS 138 HD2 LYS 138 12.126 10.792 3.797 1074 HE2 LYS 138 HE3 LYS 138 14.174 11.701 4.216 1075 HE3 LYS 138 HE2 LYS 138 14.141 11.258 5.922 1076 HZ1 LYS 138 HZ1 LYS 138 15.099 9.287 5.514 1077 HZ2 LYS 138 HZ2 LYS 138 15.624 10.016 4.081 1078 HZ3 LYS 138 HZ3 LYS 138 14.249 9.031 4.073 1079 H VAL 139 H VAL 139 8.171 12.000 6.678 1080 HA VAL 139 HA VAL 139 8.223 13.726 9.001 1081 HB VAL 139 HB VAL 139 6.729 11.131 8.926 1082 HG11 VAL 139 HG11 VAL 139 5.295 12.138 10.445 1083 HG12 VAL 139 HG12 VAL 139 5.751 13.768 9.948 1084 HG13 VAL 139 HG13 VAL 139 6.869 12.791 10.900 1085 HG21 VAL 139 HG21 VAL 139 6.175 13.555 7.277 1086 HG22 VAL 139 HG22 VAL 139 4.827 12.625 7.932 1087 HG23 VAL 139 HG23 VAL 139 5.998 11.850 6.865 1088 H SER 140 H SER 140 9.373 10.569 8.028 1089 HA SER 140 HA SER 140 11.200 10.483 10.236 1090 HB2 SER 140 HB3 SER 140 8.960 8.448 10.154 1091 HB3 SER 140 HB2 SER 140 10.378 8.351 11.197 1092 HG SER 140 HG SER 140 9.707 10.292 12.177 1093 H SER 141 H SER 141 12.535 8.459 10.187 1094 HA SER 141 HA SER 141 12.469 6.864 7.800 1095 HB2 SER 141 HB3 SER 141 15.020 8.383 8.058 1096 HB3 SER 141 HB2 SER 141 14.245 7.719 6.619 1097 HG SER 141 HG SER 141 14.048 10.202 7.699 1098 H ARG 142 H ARG 142 13.174 4.910 8.331 1099 HA ARG 142 HA ARG 142 15.268 4.652 10.375 1100 HB2 ARG 142 HB3 ARG 142 12.909 4.224 11.261 1101 HB3 ARG 142 HB2 ARG 142 12.900 2.792 10.241 1102 HG2 ARG 142 HG3 ARG 142 13.680 1.792 12.091 1103 HG3 ARG 142 HG2 ARG 142 15.230 2.433 11.543 1104 HD2 ARG 142 HD3 ARG 142 15.396 3.734 13.339 1105 HD3 ARG 142 HD2 ARG 142 13.797 4.419 13.053 1106 HE ARG 142 HE ARG 142 14.489 2.342 14.917 1107 HH11 ARG 142 HH11 ARG 142 11.916 3.748 13.024 1108 HH12 ARG 142 HH12 ARG 142 10.661 3.148 14.055 1109 HH21 ARG 142 HH21 ARG 142 12.839 1.552 16.273 1110 HH22 ARG 142 HH22 ARG 142 11.184 1.901 15.900 1111 H THR 143 H THR 143 16.800 3.143 9.956 1112 HA THR 143 HA THR 143 16.499 1.631 7.451 1113 HB THR 143 HB THR 143 19.065 2.304 8.897 1114 HG1 THR 143 HG1 THR 143 18.090 4.209 8.196 1115 HG21 THR 143 HG21 THR 143 20.132 1.153 7.345 1116 HG22 THR 143 HG22 THR 143 19.288 2.017 6.060 1117 HG23 THR 143 HG23 THR 143 18.575 0.565 6.763 1118 H VAL 144 H VAL 144 15.951 -0.418 7.757 1119 HA VAL 144 HA VAL 144 17.057 -1.844 10.087 1120 HB VAL 144 HB VAL 144 14.610 -2.649 8.516 1121 HG11 VAL 144 HG11 VAL 144 15.797 -3.532 11.137 1122 HG12 VAL 144 HG12 VAL 144 15.525 -4.497 9.686 1123 HG13 VAL 144 HG13 VAL 144 14.153 -3.930 10.638 1124 HG21 VAL 144 HG21 VAL 144 13.656 -1.797 10.917 1125 HG22 VAL 144 HG22 VAL 144 13.642 -0.841 9.435 1126 HG23 VAL 144 HG23 VAL 144 14.936 -0.623 10.613 1127 H GLU 145 H GLU 145 18.352 -3.548 9.746 1128 HA GLU 145 HA GLU 145 18.498 -4.642 7.014 1129 HB2 GLU 145 HB3 GLU 145 20.942 -5.137 7.636 1130 HB3 GLU 145 HB2 GLU 145 20.514 -3.478 7.242 1131 HG2 GLU 145 HG3 GLU 145 20.958 -2.732 9.304 1132 HG3 GLU 145 HG2 GLU 145 20.299 -4.172 10.081 1133 H ASP 146 H ASP 146 18.785 -6.839 6.779 1134 HA ASP 146 HA ASP 146 18.305 -8.424 9.212 1135 HB2 ASP 146 HB3 ASP 146 17.227 -8.533 6.479 1136 HB3 ASP 146 HB2 ASP 146 17.704 -10.100 7.124 1137 H THR 147 H THR 147 18.940 -10.913 8.443 1138 HA THR 147 HA THR 147 21.724 -11.011 8.687 1139 HB THR 147 HB THR 147 21.230 -13.469 7.747 1140 HG1 THR 147 HG1 THR 147 18.709 -12.808 8.806 1141 HG21 THR 147 HG21 THR 147 20.135 -12.673 10.425 1142 HG22 THR 147 HG22 THR 147 21.860 -12.825 10.089 1143 HG23 THR 147 HG23 THR 147 20.804 -14.230 9.938 1144 H ASN 148 H ASN 148 19.638 -11.342 5.851 1145 HA ASN 148 HA ASN 148 21.891 -11.751 4.085 1146 HB2 ASN 148 HB3 ASN 148 19.001 -12.018 3.928 1147 HB3 ASN 148 HB2 ASN 148 19.652 -11.198 2.512 1148 HD21 ASN 148 HD21 ASN 148 18.691 -13.287 1.645 1149 HD22 ASN 148 HD22 ASN 148 19.781 -14.620 1.495 1150 HA PRO 149 HA PRO 149 22.727 -7.465 3.334 1151 HB2 PRO 149 HB3 PRO 149 23.752 -7.692 0.796 1152 HB3 PRO 149 HB2 PRO 149 24.665 -8.038 2.268 1153 HG2 PRO 149 HG3 PRO 149 23.275 -9.927 0.410 1154 HG3 PRO 149 HG2 PRO 149 24.855 -10.090 1.200 1155 HD2 PRO 149 HD3 PRO 149 22.679 -11.368 2.120 1156 HD3 PRO 149 HD2 PRO 149 23.920 -10.731 3.220 1157 H ALA 150 H ALA 150 20.838 -9.396 1.110 1158 HA ALA 150 HA ALA 150 19.833 -7.094 -0.328 1159 HB1 ALA 150 HB1 ALA 150 18.744 -8.602 -1.743 1160 HB2 ALA 150 HB2 ALA 150 18.729 -9.876 -0.524 1161 HB3 ALA 150 HB3 ALA 150 20.243 -9.422 -1.306 1162 H LEU 151 H LEU 151 19.038 -8.745 2.542 1163 HA LEU 151 HA LEU 151 16.213 -8.134 2.433 1164 HB2 LEU 151 HB3 LEU 151 17.964 -9.319 4.577 1165 HB3 LEU 151 HB2 LEU 151 16.257 -8.992 4.810 1166 HG LEU 151 HG LEU 151 17.539 -11.022 3.002 1167 HD11 LEU 151 HD11 LEU 151 16.529 -12.585 4.315 1168 HD12 LEU 151 HD12 LEU 151 15.188 -11.522 4.743 1169 HD13 LEU 151 HD13 LEU 151 16.761 -11.309 5.511 1170 HD21 LEU 151 HD21 LEU 151 14.934 -9.647 2.687 1171 HD22 LEU 151 HD22 LEU 151 14.957 -11.397 2.462 1172 HD23 LEU 151 HD23 LEU 151 15.993 -10.367 1.474 1173 H THR 152 H THR 152 18.721 -6.162 2.756 1174 HA THR 152 HA THR 152 18.011 -4.712 5.126 1175 HB THR 152 HB THR 152 19.589 -3.502 2.883 1176 HG1 THR 152 HG1 THR 152 20.570 -5.458 4.687 1177 HG21 THR 152 HG21 THR 152 19.240 -2.996 5.694 1178 HG22 THR 152 HG22 THR 152 20.011 -2.006 4.455 1179 HG23 THR 152 HG23 THR 152 20.939 -3.248 5.295 1180 H HIS 153 H HIS 153 16.336 -3.382 5.324 1181 HA HIS 153 HA HIS 153 15.306 -2.060 2.899 1182 HB2 HIS 153 HB3 HIS 153 13.481 -2.653 5.189 1183 HB3 HIS 153 HB2 HIS 153 13.112 -2.492 3.476 1184 HD1 HIS 153 HD1 HIS 153 12.735 -4.942 5.773 1185 HD2 HIS 153 HD2 HIS 153 14.902 -4.866 2.230 1186 HE1 HIS 153 HE1 HIS 153 12.998 -7.349 5.095 1187 HE2 HIS 153 HE2 HIS 153 14.230 -7.272 2.899 1188 H THR 154 H THR 154 14.034 -0.080 3.358 1189 HA THR 154 HA THR 154 14.919 1.312 5.788 1190 HB THR 154 HB THR 154 14.958 2.537 3.024 1191 HG1 THR 154 HG1 THR 154 17.044 1.504 4.632 1192 HG21 THR 154 HG21 THR 154 16.311 3.638 5.449 1193 HG22 THR 154 HG22 THR 154 14.628 4.024 5.089 1194 HG23 THR 154 HG23 THR 154 15.895 4.445 3.937 1195 H TYR 155 H TYR 155 13.185 1.969 6.858 1196 HA TYR 155 HA TYR 155 10.665 2.373 5.446 1197 HB2 TYR 155 HB3 TYR 155 11.460 1.937 8.291 1198 HB3 TYR 155 HB2 TYR 155 9.953 2.790 7.972 1199 HD1 TYR 155 HD1 TYR 155 8.275 1.620 6.384 1200 HD2 TYR 155 HD2 TYR 155 11.499 -0.389 8.301 1201 HE1 TYR 155 HE1 TYR 155 7.124 -0.529 6.055 1202 HE2 TYR 155 HE2 TYR 155 10.359 -2.543 7.976 1203 HH TYR 155 HH TYR 155 8.120 -3.144 5.897 1204 H GLU 156 H GLU 156 9.953 4.334 4.886 1205 HA GLU 156 HA GLU 156 10.960 6.658 6.385 1206 HB2 GLU 156 HB3 GLU 156 10.633 6.527 3.384 1207 HB3 GLU 156 HB2 GLU 156 11.183 7.917 4.310 1208 HG2 GLU 156 HG3 GLU 156 13.264 7.095 4.574 1209 HG3 GLU 156 HG2 GLU 156 12.710 5.425 4.683 1210 H VAL 157 H VAL 157 9.556 8.308 6.735 1211 HA VAL 157 HA VAL 157 6.776 7.874 5.868 1212 HB VAL 157 HB VAL 157 7.629 9.494 8.266 1213 HG11 VAL 157 HG11 VAL 157 5.027 8.548 7.140 1214 HG12 VAL 157 HG12 VAL 157 5.474 10.142 7.747 1215 HG13 VAL 157 HG13 VAL 157 5.185 8.819 8.875 1216 HG21 VAL 157 HG21 VAL 157 8.318 7.081 8.428 1217 HG22 VAL 157 HG22 VAL 157 6.608 6.661 8.326 1218 HG23 VAL 157 HG23 VAL 157 7.200 7.627 9.677 1219 H TRP 158 H TRP 158 5.574 9.652 5.193 1220 HA TRP 158 HA TRP 158 6.955 12.202 4.836 1221 HB2 TRP 158 HB3 TRP 158 5.834 10.632 2.514 1222 HB3 TRP 158 HB2 TRP 158 6.375 12.302 2.425 1223 HD1 TRP 158 HD1 TRP 158 7.854 8.815 3.266 1224 HE1 TRP 158 HE1 TRP 158 10.317 8.802 2.518 1225 HE3 TRP 158 HE3 TRP 158 8.257 13.669 1.713 1226 HZ2 TRP 158 HZ2 TRP 158 12.183 10.610 1.414 1227 HZ3 TRP 158 HZ3 TRP 158 10.415 14.448 0.823 1228 HH2 TRP 158 HH2 TRP 158 12.337 12.949 0.678 1229 H GLN 159 H GLN 159 5.665 13.941 4.884 1230 HA GLN 159 HA GLN 159 2.768 13.583 4.596 1231 HB2 GLN 159 HB3 GLN 159 4.226 14.354 7.038 1232 HB3 GLN 159 HB2 GLN 159 2.888 15.416 6.622 1233 HG2 GLN 159 HG3 GLN 159 1.310 13.758 6.890 1234 HG3 GLN 159 HG2 GLN 159 2.482 12.462 6.656 1235 HE21 GLN 159 HE21 GLN 159 1.712 15.122 8.866 1236 HE22 GLN 159 HE22 GLN 159 2.168 14.287 10.308 1237 H LYS 160 H LYS 160 1.873 15.141 3.362 1238 HA LYS 160 HA LYS 160 3.409 17.025 2.015 1239 HB2 LYS 160 HB3 LYS 160 0.935 16.065 1.668 1240 HB3 LYS 160 HB2 LYS 160 0.522 17.609 2.400 1241 HG2 LYS 160 HG3 LYS 160 2.182 18.551 0.604 1242 HG3 LYS 160 HG2 LYS 160 1.810 17.035 -0.218 1243 HD2 LYS 160 HD3 LYS 160 0.013 18.080 -1.037 1244 HD3 LYS 160 HD2 LYS 160 -0.667 17.955 0.587 1245 HE2 LYS 160 HE3 LYS 160 -0.737 20.175 0.661 1246 HE3 LYS 160 HE2 LYS 160 1.026 20.186 0.645 1247 HZ1 LYS 160 HZ1 LYS 160 0.147 21.560 -1.119 1248 HZ2 LYS 160 HZ2 LYS 160 -0.740 20.263 -1.743 1249 HZ3 LYS 160 HZ3 LYS 160 0.950 20.227 -1.782 1250 H LYS 161 H LYS 161 3.855 19.143 2.278 1251 HA LYS 161 HA LYS 161 4.076 20.239 4.813 1252 HB2 LYS 161 HB3 LYS 161 4.461 21.147 2.068 1253 HB3 LYS 161 HB2 LYS 161 3.951 22.447 3.137 1254 HG2 LYS 161 HG3 LYS 161 5.856 22.328 4.418 1255 HG3 LYS 161 HG2 LYS 161 6.169 20.645 3.985 1256 HD2 LYS 161 HD3 LYS 161 6.314 21.935 1.561 1257 HD3 LYS 161 HD2 LYS 161 7.018 23.112 2.671 1258 HE2 LYS 161 HE3 LYS 161 8.494 21.293 3.537 1259 HE3 LYS 161 HE2 LYS 161 7.873 20.252 2.257 1260 HZ1 LYS 161 HZ1 LYS 161 8.891 22.835 1.406 1261 HZ2 LYS 161 HZ2 LYS 161 9.072 21.311 0.695 1262 HZ3 LYS 161 HZ3 LYS 161 10.049 21.754 2.002 1263 H ALA 162 H ALA 162 2.926 21.772 5.977 1264 HA ALA 162 HA ALA 162 1.082 22.811 6.812 1265 HB1 ALA 162 HB1 ALA 162 -0.533 23.710 4.979 1266 HB2 ALA 162 HB2 ALA 162 0.740 23.200 3.870 1267 HB3 ALA 162 HB3 ALA 162 1.089 24.387 5.127 1268 H51A NDP 170 H51A NDP 170 -5.877 -0.659 -9.010 1269 H52A NDP 170 H52A NDP 170 -6.303 -2.221 -8.297 1270 H4B NDP 170 H4B NDP 170 -7.781 -2.652 -10.303 1271 H3B NDP 170 H3B NDP 170 -6.974 0.163 -11.053 1272 HO3A NDP 170 HO3A NDP 170 -7.514 -2.280 -12.439 1273 H2B NDP 170 H2B NDP 170 -9.215 0.491 -11.842 1274 H1B NDP 170 H1B NDP 170 -10.456 -0.628 -9.651 1275 H8A NDP 170 H8A NDP 170 -7.262 1.136 -8.644 1276 H61A NDP 170 H61A NDP 170 -10.798 6.197 -8.021 1277 H62A NDP 170 H62A NDP 170 -9.188 5.542 -7.834 1278 H2A NDP 170 H2A NDP 170 -13.298 2.979 -9.894 1279 H51N NDP 170 H51N NDP 170 -1.307 -4.546 -7.779 1280 H52N NDP 170 H52N NDP 170 -0.636 -3.584 -9.108 1281 H4D NDP 170 H4D NDP 170 0.940 -5.468 -9.622 1282 H3D NDP 170 H3D NDP 170 -0.339 -6.775 -7.210 1283 HO3N NDP 170 HO3N NDP 170 -0.797 -7.476 -9.426 1284 H2D NDP 170 H2D NDP 170 1.833 -7.682 -6.705 1285 HO2N NDP 170 HO2N NDP 170 3.231 -8.097 -8.206 1286 H1D NDP 170 H1D NDP 170 3.205 -5.324 -7.119 1287 H2N NDP 170 H2N NDP 170 3.721 -5.195 -4.764 1288 H71N NDP 170 H71N NDP 170 5.492 -4.522 -2.153 1289 H72N NDP 170 H72N NDP 170 5.084 -5.160 -3.723 1290 H41N NDP 170 H41N NDP 170 0.646 -3.877 -2.598 1291 H42N NDP 170 H42N NDP 170 0.645 -5.646 -2.278 1292 H5N NDP 170 H5N NDP 170 -1.161 -5.004 -3.874 1293 H6N NDP 170 H6N NDP 170 -0.392 -5.447 -6.211 Start of MODEL 3 1 H1 THR 1 HT1 THR 1 -5.834 9.417 5.263 2 H2 THR 1 HT2 THR 1 -4.204 9.860 5.568 3 H3 THR 1 HT3 THR 1 -4.770 8.301 6.011 4 HA THR 1 HA THR 1 -4.949 7.611 3.838 5 HB THR 1 HB THR 1 -4.178 10.314 2.799 6 HG1 THR 1 HG1 THR 1 -6.076 11.124 3.161 7 HG21 THR 1 HG21 THR 1 -6.146 9.204 1.209 8 HG22 THR 1 HG22 THR 1 -5.142 7.833 1.682 9 HG23 THR 1 HG23 THR 1 -4.412 9.227 0.885 10 H ALA 2 H ALA 2 -3.156 6.402 4.203 11 HA ALA 2 HA ALA 2 -0.567 7.671 3.608 12 HB1 ALA 2 HB1 ALA 2 -0.935 5.523 5.687 13 HB2 ALA 2 HB2 ALA 2 -0.876 7.246 6.060 14 HB3 ALA 2 HB3 ALA 2 0.524 6.451 5.339 15 H PHE 3 H PHE 3 0.934 6.401 2.503 16 HA PHE 3 HA PHE 3 -0.223 4.025 1.210 17 HB2 PHE 3 HB3 PHE 3 2.034 5.852 0.376 18 HB3 PHE 3 HB2 PHE 3 1.615 4.371 -0.473 19 HD1 PHE 3 HD1 PHE 3 -1.450 5.455 0.544 20 HD2 PHE 3 HD2 PHE 3 1.677 6.590 -2.113 21 HE1 PHE 3 HE1 PHE 3 -3.068 6.701 -0.827 22 HE2 PHE 3 HE2 PHE 3 0.064 7.837 -3.485 23 HZ PHE 3 HZ PHE 3 -2.309 7.895 -2.843 24 H LEU 4 H LEU 4 0.519 2.071 1.739 25 HA LEU 4 HA LEU 4 3.236 1.864 2.856 26 HB2 LEU 4 HB3 LEU 4 1.634 1.612 4.656 27 HB3 LEU 4 HB2 LEU 4 0.752 0.402 3.744 28 HG LEU 4 HG LEU 4 2.605 -1.154 3.929 29 HD11 LEU 4 HD11 LEU 4 4.470 -0.422 5.576 30 HD12 LEU 4 HD12 LEU 4 3.996 1.212 5.114 31 HD13 LEU 4 HD13 LEU 4 4.561 0.078 3.887 32 HD21 LEU 4 HD21 LEU 4 2.427 -0.219 6.722 33 HD22 LEU 4 HD22 LEU 4 2.087 -1.805 6.029 34 HD23 LEU 4 HD23 LEU 4 0.896 -0.511 5.896 35 H TRP 5 H TRP 5 4.466 0.781 1.460 36 HA TRP 5 HA TRP 5 3.651 -1.808 0.518 37 HB2 TRP 5 HB3 TRP 5 3.502 -1.421 -1.777 38 HB3 TRP 5 HB2 TRP 5 2.662 -0.033 -1.097 39 HD1 TRP 5 HD1 TRP 5 5.801 -0.985 -3.031 40 HE1 TRP 5 HE1 TRP 5 6.909 1.154 -3.934 41 HE3 TRP 5 HE3 TRP 5 2.951 2.496 -0.599 42 HZ2 TRP 5 HZ2 TRP 5 6.618 3.946 -3.651 43 HZ3 TRP 5 HZ3 TRP 5 3.433 4.881 -0.974 44 HH2 TRP 5 HH2 TRP 5 5.227 5.588 -2.468 45 H ALA 6 H ALA 6 5.376 -2.914 -0.681 46 HA ALA 6 HA ALA 6 8.012 -1.963 0.201 47 HB1 ALA 6 HB1 ALA 6 7.747 -4.708 -0.842 48 HB2 ALA 6 HB2 ALA 6 6.872 -4.364 0.650 49 HB3 ALA 6 HB3 ALA 6 8.615 -4.108 0.571 50 H GLN 7 H GLN 7 9.733 -1.792 -1.230 51 HA GLN 7 HA GLN 7 9.235 -2.400 -4.046 52 HB2 GLN 7 HB3 GLN 7 10.209 -0.111 -4.626 53 HB3 GLN 7 HB2 GLN 7 8.550 -0.153 -4.045 54 HG2 GLN 7 HG3 GLN 7 10.323 0.143 -1.825 55 HG3 GLN 7 HG2 GLN 7 10.705 1.351 -3.051 56 HE21 GLN 7 HE21 GLN 7 8.179 0.069 -0.987 57 HE22 GLN 7 HE22 GLN 7 7.183 1.480 -1.009 58 H ASP 8 H ASP 8 11.171 -2.291 -5.380 59 HA ASP 8 HA ASP 8 13.537 -3.080 -3.843 60 HB2 ASP 8 HB3 ASP 8 14.289 -4.204 -5.846 61 HB3 ASP 8 HB2 ASP 8 12.615 -4.653 -5.551 62 H ARG 9 H ARG 9 15.515 -2.670 -5.737 63 HA ARG 9 HA ARG 9 16.076 0.091 -5.359 64 HB2 ARG 9 HB3 ARG 9 17.433 -2.198 -6.707 65 HB3 ARG 9 HB2 ARG 9 17.973 -0.569 -7.088 66 HG2 ARG 9 HG3 ARG 9 17.696 -1.355 -4.232 67 HG3 ARG 9 HG2 ARG 9 19.080 -1.945 -5.156 68 HD2 ARG 9 HD3 ARG 9 18.293 0.958 -4.979 69 HD3 ARG 9 HD2 ARG 9 19.470 0.196 -3.910 70 HE ARG 9 HE ARG 9 19.894 1.043 -6.599 71 HH11 ARG 9 HH11 ARG 9 20.851 -1.335 -4.231 72 HH12 ARG 9 HH12 ARG 9 22.402 -1.609 -4.950 73 HH21 ARG 9 HH21 ARG 9 21.933 0.683 -7.547 74 HH22 ARG 9 HH22 ARG 9 23.017 -0.464 -6.832 75 H ASP 10 H ASP 10 14.666 -1.746 -7.952 76 HA ASP 10 HA ASP 10 14.954 0.389 -9.892 77 HB2 ASP 10 HB3 ASP 10 14.939 -2.203 -10.305 78 HB3 ASP 10 HB2 ASP 10 13.191 -1.995 -10.315 79 H GLY 11 H GLY 11 13.039 0.069 -7.303 80 HA2 GLY 11 HA3 GLY 11 11.225 1.428 -6.723 81 HA3 GLY 11 HA2 GLY 11 11.019 1.832 -8.421 82 H LEU 12 H LEU 12 11.248 -1.344 -8.622 83 HA LEU 12 HA LEU 12 8.609 -1.883 -9.222 84 HB2 LEU 12 HB3 LEU 12 10.570 -3.272 -9.834 85 HB3 LEU 12 HB2 LEU 12 10.685 -3.811 -8.173 86 HG LEU 12 HG LEU 12 8.042 -4.330 -9.205 87 HD11 LEU 12 HD11 LEU 12 8.419 -5.720 -10.998 88 HD12 LEU 12 HD12 LEU 12 10.145 -5.862 -10.662 89 HD13 LEU 12 HD13 LEU 12 9.496 -4.364 -11.327 90 HD21 LEU 12 HD21 LEU 12 9.048 -6.733 -8.697 91 HD22 LEU 12 HD22 LEU 12 8.569 -5.626 -7.410 92 HD23 LEU 12 HD23 LEU 12 10.267 -5.762 -7.868 93 H ILE 13 H ILE 13 7.425 -3.840 -7.946 94 HA ILE 13 HA ILE 13 7.513 -3.455 -5.084 95 HB ILE 13 HB ILE 13 5.148 -3.013 -4.852 96 HG12 ILE 13 HG13 ILE 13 4.962 -2.760 -7.860 97 HG13 ILE 13 HG12 ILE 13 4.494 -4.217 -6.990 98 HG21 ILE 13 HG21 ILE 13 6.086 -1.011 -6.873 99 HG22 ILE 13 HG22 ILE 13 6.862 -1.154 -5.296 100 HG23 ILE 13 HG23 ILE 13 5.148 -0.751 -5.403 101 HD11 ILE 13 HD11 ILE 13 3.311 -1.575 -6.257 102 HD12 ILE 13 HD12 ILE 13 2.668 -3.198 -6.008 103 HD13 ILE 13 HD13 ILE 13 2.690 -2.497 -7.625 104 H GLY 14 H GLY 14 6.314 -5.116 -7.932 105 HA2 GLY 14 HA3 GLY 14 6.776 -7.674 -7.100 106 HA3 GLY 14 HA2 GLY 14 5.166 -7.317 -6.497 107 H LYS 15 H LYS 15 5.843 -9.312 -8.415 108 HA LYS 15 HA LYS 15 4.491 -8.229 -10.802 109 HB2 LYS 15 HB3 LYS 15 5.613 -9.976 -12.108 110 HB3 LYS 15 HB2 LYS 15 6.773 -8.928 -11.304 111 HG2 LYS 15 HG3 LYS 15 7.745 -10.709 -10.431 112 HG3 LYS 15 HG2 LYS 15 6.261 -11.069 -9.546 113 HD2 LYS 15 HD3 LYS 15 6.983 -12.980 -10.893 114 HD3 LYS 15 HD2 LYS 15 5.429 -12.355 -11.448 115 HE2 LYS 15 HE3 LYS 15 6.344 -12.352 -13.487 116 HE3 LYS 15 HE2 LYS 15 7.224 -10.922 -12.949 117 HZ1 LYS 15 HZ1 LYS 15 8.988 -12.159 -13.550 118 HZ2 LYS 15 HZ2 LYS 15 8.175 -13.633 -13.376 119 HZ3 LYS 15 HZ3 LYS 15 8.800 -12.846 -12.015 120 H ASP 16 H ASP 16 2.414 -8.661 -10.116 121 HA ASP 16 HA ASP 16 0.500 -9.905 -10.109 122 HB2 ASP 16 HB3 ASP 16 2.311 -11.592 -11.473 123 HB3 ASP 16 HB2 ASP 16 1.503 -12.601 -10.277 124 H GLY 17 H GLY 17 0.346 -9.296 -7.913 125 HA2 GLY 17 HA3 GLY 17 -0.481 -10.820 -6.015 126 HA3 GLY 17 HA2 GLY 17 1.198 -11.337 -5.971 127 H HIS 18 H HIS 18 2.633 -10.179 -4.827 128 HA HIS 18 HA HIS 18 1.986 -7.463 -4.018 129 HB2 HIS 18 HB3 HIS 18 2.781 -8.185 -1.638 130 HB3 HIS 18 HB2 HIS 18 1.119 -8.469 -2.134 131 HD1 HIS 18 HD1 HIS 18 3.612 -10.115 -0.351 132 HD2 HIS 18 HD2 HIS 18 1.079 -11.301 -3.424 133 HE1 HIS 18 HE1 HIS 18 3.535 -12.625 -0.227 134 HE2 HIS 18 HE2 HIS 18 2.069 -13.324 -2.153 135 H LEU 19 H LEU 19 4.387 -9.808 -2.909 136 HA LEU 19 HA LEU 19 6.478 -8.134 -4.113 137 HB2 LEU 19 HB3 LEU 19 7.522 -9.439 -1.796 138 HB3 LEU 19 HB2 LEU 19 7.436 -7.726 -2.148 139 HG LEU 19 HG LEU 19 4.903 -8.861 -1.185 140 HD11 LEU 19 HD11 LEU 19 5.487 -9.576 0.873 141 HD12 LEU 19 HD12 LEU 19 6.875 -8.492 0.978 142 HD13 LEU 19 HD13 LEU 19 6.992 -9.988 0.050 143 HD21 LEU 19 HD21 LEU 19 5.168 -6.493 -1.442 144 HD22 LEU 19 HD22 LEU 19 6.623 -6.500 -0.444 145 HD23 LEU 19 HD23 LEU 19 5.054 -6.855 0.280 146 HA PRO 20 HA PRO 20 7.865 -12.070 -5.647 147 HB2 PRO 20 HB3 PRO 20 10.059 -11.275 -6.932 148 HB3 PRO 20 HB2 PRO 20 8.458 -10.747 -7.464 149 HG2 PRO 20 HG3 PRO 20 10.528 -9.257 -5.915 150 HG3 PRO 20 HG2 PRO 20 9.427 -8.669 -7.173 151 HD2 PRO 20 HD3 PRO 20 9.053 -8.403 -4.413 152 HD3 PRO 20 HD2 PRO 20 7.805 -8.194 -5.655 153 H TRP 21 H TRP 21 9.001 -10.728 -2.958 154 HA TRP 21 HA TRP 21 11.228 -12.636 -2.701 155 HB2 TRP 21 HB3 TRP 21 12.141 -10.920 -1.007 156 HB3 TRP 21 HB2 TRP 21 12.310 -10.547 -2.720 157 HD1 TRP 21 HD1 TRP 21 9.901 -9.693 0.202 158 HE1 TRP 21 HE1 TRP 21 9.030 -7.299 -0.164 159 HE3 TRP 21 HE3 TRP 21 12.125 -8.697 -4.294 160 HZ2 TRP 21 HZ2 TRP 21 9.256 -5.258 -2.100 161 HZ3 TRP 21 HZ3 TRP 21 11.746 -6.499 -5.335 162 HH2 TRP 21 HH2 TRP 21 10.341 -4.817 -4.259 163 H HIS 22 H HIS 22 11.760 -12.655 -0.132 164 HA HIS 22 HA HIS 22 9.195 -13.238 1.197 165 HB2 HIS 22 HB3 HIS 22 11.068 -15.088 0.586 166 HB3 HIS 22 HB2 HIS 22 11.645 -14.588 2.173 167 HD1 HIS 22 HD1 HIS 22 7.994 -14.835 1.269 168 HD2 HIS 22 HD2 HIS 22 10.839 -16.848 3.533 169 HE1 HIS 22 HE1 HIS 22 6.710 -16.534 2.607 170 HE2 HIS 22 HE2 HIS 22 8.461 -17.795 3.906 171 H LEU 23 H LEU 23 8.945 -11.312 2.272 172 HA LEU 23 HA LEU 23 11.079 -10.574 4.163 173 HB2 LEU 23 HB3 LEU 23 9.395 -9.010 2.373 174 HB3 LEU 23 HB2 LEU 23 9.349 -8.415 4.021 175 HG LEU 23 HG LEU 23 11.908 -8.437 3.924 176 HD11 LEU 23 HD11 LEU 23 11.735 -8.097 1.006 177 HD12 LEU 23 HD12 LEU 23 11.574 -9.752 1.596 178 HD13 LEU 23 HD13 LEU 23 13.008 -8.808 1.997 179 HD21 LEU 23 HD21 LEU 23 10.668 -6.381 3.943 180 HD22 LEU 23 HD22 LEU 23 10.285 -6.545 2.230 181 HD23 LEU 23 HD23 LEU 23 11.948 -6.257 2.738 182 HA PRO 24 HA PRO 24 7.699 -12.277 6.827 183 HB2 PRO 24 HB3 PRO 24 10.015 -12.365 8.680 184 HB3 PRO 24 HB2 PRO 24 8.823 -13.614 8.310 185 HG2 PRO 24 HG3 PRO 24 11.317 -13.774 7.373 186 HG3 PRO 24 HG2 PRO 24 9.932 -14.293 6.394 187 HD2 PRO 24 HD3 PRO 24 11.554 -11.788 6.211 188 HD3 PRO 24 HD2 PRO 24 10.857 -12.780 4.914 189 H ASP 25 H ASP 25 10.245 -9.930 7.572 190 HA ASP 25 HA ASP 25 8.975 -8.779 9.813 191 HB2 ASP 25 HB3 ASP 25 10.575 -6.871 9.320 192 HB3 ASP 25 HB2 ASP 25 11.309 -8.442 9.596 193 H ASP 26 H ASP 26 8.957 -8.008 6.363 194 HA ASP 26 HA ASP 26 7.597 -5.558 6.527 195 HB2 ASP 26 HB3 ASP 26 8.782 -6.581 4.504 196 HB3 ASP 26 HB2 ASP 26 7.306 -7.505 4.243 197 H LEU 27 H LEU 27 6.382 -8.867 6.126 198 HA LEU 27 HA LEU 27 3.649 -8.141 5.948 199 HB2 LEU 27 HB3 LEU 27 4.627 -10.780 6.996 200 HB3 LEU 27 HB2 LEU 27 3.166 -10.442 6.088 201 HG LEU 27 HG LEU 27 5.689 -9.855 4.672 202 HD11 LEU 27 HD11 LEU 27 6.491 -11.966 4.436 203 HD12 LEU 27 HD12 LEU 27 4.921 -12.716 4.723 204 HD13 LEU 27 HD13 LEU 27 5.863 -12.095 6.079 205 HD21 LEU 27 HD21 LEU 27 4.466 -10.374 2.815 206 HD22 LEU 27 HD22 LEU 27 3.174 -9.861 3.900 207 HD23 LEU 27 HD23 LEU 27 3.491 -11.579 3.656 208 H HIS 28 H HIS 28 5.561 -9.491 8.632 209 HA HIS 28 HA HIS 28 3.595 -9.499 10.582 210 HB2 HIS 28 HB3 HIS 28 6.277 -10.090 10.505 211 HB3 HIS 28 HB2 HIS 28 6.237 -8.694 11.577 212 HD1 HIS 28 HD1 HIS 28 5.004 -12.232 11.299 213 HD2 HIS 28 HD2 HIS 28 5.153 -9.156 14.089 214 HE1 HIS 28 HE1 HIS 28 4.332 -13.275 13.487 215 HE2 HIS 28 HE2 HIS 28 4.517 -11.415 15.176 216 H TYR 29 H TYR 29 5.664 -6.853 9.508 217 HA TYR 29 HA TYR 29 4.735 -5.039 11.535 218 HB2 TYR 29 HB3 TYR 29 7.000 -4.972 10.338 219 HB3 TYR 29 HB2 TYR 29 6.133 -4.261 8.981 220 HD1 TYR 29 HD1 TYR 29 6.282 -3.764 12.690 221 HD2 TYR 29 HD2 TYR 29 6.278 -1.971 8.832 222 HE1 TYR 29 HE1 TYR 29 6.491 -1.545 13.728 223 HE2 TYR 29 HE2 TYR 29 6.489 0.253 9.859 224 HH TYR 29 HH TYR 29 7.213 0.681 13.187 225 H PHE 30 H PHE 30 3.819 -5.883 8.283 226 HA PHE 30 HA PHE 30 2.350 -3.617 7.571 227 HB2 PHE 30 HB3 PHE 30 2.946 -5.926 6.318 228 HB3 PHE 30 HB2 PHE 30 1.270 -6.254 6.746 229 HD1 PHE 30 HD2 PHE 30 -0.422 -4.343 6.153 230 HD2 PHE 30 HD1 PHE 30 3.402 -4.830 4.350 231 HE1 PHE 30 HE2 PHE 30 -1.175 -3.032 4.212 232 HE2 PHE 30 HE1 PHE 30 2.656 -3.520 2.406 233 HZ PHE 30 HZ PHE 30 0.365 -2.619 2.335 234 H ARG 31 H ARG 31 1.031 -6.694 8.813 235 HA ARG 31 HA ARG 31 -1.527 -5.603 9.352 236 HB2 ARG 31 HB3 ARG 31 -0.319 -8.159 9.384 237 HB3 ARG 31 HB2 ARG 31 -1.001 -7.907 10.985 238 HG2 ARG 31 HG3 ARG 31 -3.098 -8.113 10.250 239 HG3 ARG 31 HG2 ARG 31 -2.794 -7.126 8.820 240 HD2 ARG 31 HD3 ARG 31 -3.246 -9.183 7.885 241 HD3 ARG 31 HD2 ARG 31 -1.488 -9.214 7.985 242 HE ARG 31 HE ARG 31 -3.360 -10.706 9.673 243 HH11 ARG 31 HH11 ARG 31 -0.059 -9.997 8.759 244 HH12 ARG 31 HH12 ARG 31 0.587 -11.381 9.570 245 HH21 ARG 31 HH21 ARG 31 -2.501 -12.520 10.735 246 HH22 ARG 31 HH22 ARG 31 -0.794 -12.812 10.690 247 H ALA 32 H ALA 32 1.407 -5.886 11.220 248 HA ALA 32 HA ALA 32 0.377 -5.539 13.796 249 HB1 ALA 32 HB1 ALA 32 3.007 -5.166 12.503 250 HB2 ALA 32 HB2 ALA 32 2.567 -6.086 13.942 251 HB3 ALA 32 HB3 ALA 32 2.756 -4.335 14.038 252 H GLN 33 H GLN 33 1.100 -3.214 11.265 253 HA GLN 33 HA GLN 33 0.526 -0.965 13.018 254 HB2 GLN 33 HB3 GLN 33 1.919 -1.353 10.516 255 HB3 GLN 33 HB2 GLN 33 0.752 -0.046 10.373 256 HG2 GLN 33 HG3 GLN 33 1.942 0.501 12.770 257 HG3 GLN 33 HG2 GLN 33 3.276 -0.165 11.829 258 HE21 GLN 33 HE21 GLN 33 3.628 0.789 9.685 259 HE22 GLN 33 HE22 GLN 33 3.335 2.479 9.477 260 H THR 34 H THR 34 -0.969 -2.803 10.449 261 HA THR 34 HA THR 34 -3.234 -0.960 10.339 262 HB THR 34 HB THR 34 -4.019 -2.542 8.517 263 HG1 THR 34 HG1 THR 34 -1.374 -3.528 8.653 264 HG21 THR 34 HG21 THR 34 -2.679 -1.635 6.834 265 HG22 THR 34 HG22 THR 34 -1.289 -1.473 7.907 266 HG23 THR 34 HG23 THR 34 -2.688 -0.420 8.112 267 H VAL 35 H VAL 35 -2.950 -2.239 12.781 268 HA VAL 35 HA VAL 35 -4.752 -4.513 12.827 269 HB VAL 35 HB VAL 35 -2.795 -4.463 14.330 270 HG11 VAL 35 HG11 VAL 35 -4.200 -2.355 15.941 271 HG12 VAL 35 HG12 VAL 35 -2.998 -1.945 14.718 272 HG13 VAL 35 HG13 VAL 35 -2.546 -2.946 16.097 273 HG21 VAL 35 HG21 VAL 35 -3.865 -5.625 15.951 274 HG22 VAL 35 HG22 VAL 35 -5.234 -5.442 14.854 275 HG23 VAL 35 HG23 VAL 35 -5.056 -4.354 16.230 276 H GLY 36 H GLY 36 -6.872 -4.201 12.749 277 HA2 GLY 36 HA3 GLY 36 -8.963 -3.415 13.294 278 HA3 GLY 36 HA2 GLY 36 -8.222 -2.552 14.632 279 H LYS 37 H LYS 37 -6.941 -1.929 11.503 280 HA LYS 37 HA LYS 37 -8.246 0.705 11.524 281 HB2 LYS 37 HB3 LYS 37 -5.579 -0.273 10.590 282 HB3 LYS 37 HB2 LYS 37 -6.281 1.138 9.815 283 HG2 LYS 37 HG3 LYS 37 -6.596 1.758 12.443 284 HG3 LYS 37 HG2 LYS 37 -5.088 0.842 12.470 285 HD2 LYS 37 HD3 LYS 37 -5.605 3.112 10.560 286 HD3 LYS 37 HD2 LYS 37 -4.851 3.332 12.140 287 HE2 LYS 37 HE3 LYS 37 -3.281 1.398 11.273 288 HE3 LYS 37 HE2 LYS 37 -3.802 1.993 9.697 289 HZ1 LYS 37 HZ1 LYS 37 -3.121 4.262 10.554 290 HZ2 LYS 37 HZ2 LYS 37 -1.870 3.181 10.198 291 HZ3 LYS 37 HZ3 LYS 37 -2.324 3.448 11.805 292 H ILE 38 H ILE 38 -7.901 1.537 8.961 293 HA ILE 38 HA ILE 38 -9.392 -0.454 7.381 294 HB ILE 38 HB ILE 38 -9.982 2.060 6.278 295 HG12 ILE 38 HG13 ILE 38 -10.812 2.184 9.149 296 HG13 ILE 38 HG12 ILE 38 -9.224 2.797 8.696 297 HG21 ILE 38 HG21 ILE 38 -11.812 0.554 8.107 298 HG22 ILE 38 HG22 ILE 38 -11.338 -0.092 6.536 299 HG23 ILE 38 HG23 ILE 38 -12.203 1.441 6.636 300 HD11 ILE 38 HD11 ILE 38 -11.833 3.707 7.511 301 HD12 ILE 38 HD12 ILE 38 -10.233 4.353 7.148 302 HD13 ILE 38 HD13 ILE 38 -10.921 4.555 8.760 303 H MET 39 H MET 39 -8.273 -1.182 5.734 304 HA MET 39 HA MET 39 -6.322 0.611 4.444 305 HB2 MET 39 HB3 MET 39 -5.239 -1.285 5.503 306 HB3 MET 39 HB2 MET 39 -6.313 -2.403 4.676 307 HG2 MET 39 HG3 MET 39 -5.285 -1.215 2.540 308 HG3 MET 39 HG2 MET 39 -3.959 -0.920 3.662 309 HE1 MET 39 HE1 MET 39 -6.407 -3.552 2.323 310 HE2 MET 39 HE2 MET 39 -6.227 -4.254 3.931 311 HE3 MET 39 HE3 MET 39 -5.559 -5.086 2.527 312 H VAL 40 H VAL 40 -6.519 1.040 2.338 313 HA VAL 40 HA VAL 40 -8.790 -0.110 0.907 314 HB VAL 40 HB VAL 40 -6.982 2.114 -0.037 315 HG11 VAL 40 HG11 VAL 40 -8.181 1.619 -1.892 316 HG12 VAL 40 HG12 VAL 40 -9.385 2.633 -1.098 317 HG13 VAL 40 HG13 VAL 40 -9.495 0.877 -0.979 318 HG21 VAL 40 HG21 VAL 40 -7.764 3.247 1.747 319 HG22 VAL 40 HG22 VAL 40 -9.097 2.123 2.009 320 HG23 VAL 40 HG23 VAL 40 -9.234 3.382 0.781 321 H VAL 41 H VAL 41 -8.584 -1.533 -0.724 322 HA VAL 41 HA VAL 41 -5.877 -2.010 -1.781 323 HB VAL 41 HB VAL 41 -6.789 -3.779 -0.200 324 HG11 VAL 41 HG11 VAL 41 -8.785 -3.981 -2.386 325 HG12 VAL 41 HG12 VAL 41 -8.962 -4.251 -0.654 326 HG13 VAL 41 HG13 VAL 41 -8.206 -5.480 -1.663 327 HG21 VAL 41 HG21 VAL 41 -6.270 -5.154 -2.747 328 HG22 VAL 41 HG22 VAL 41 -5.449 -5.286 -1.193 329 HG23 VAL 41 HG23 VAL 41 -5.088 -3.938 -2.271 330 H GLY 42 H GLY 42 -5.678 -2.642 -3.960 331 HA2 GLY 42 HA3 GLY 42 -7.774 -1.583 -5.665 332 HA3 GLY 42 HA2 GLY 42 -6.180 -2.119 -6.178 333 H ARG 43 H ARG 43 -8.301 -2.789 -7.732 334 HA ARG 43 HA ARG 43 -9.717 -5.087 -7.196 335 HB2 ARG 43 HB3 ARG 43 -10.193 -3.827 -9.168 336 HB3 ARG 43 HB2 ARG 43 -8.572 -4.085 -9.797 337 HG2 ARG 43 HG3 ARG 43 -9.136 -6.553 -9.866 338 HG3 ARG 43 HG2 ARG 43 -10.807 -6.079 -9.558 339 HD2 ARG 43 HD3 ARG 43 -9.123 -5.099 -11.859 340 HD3 ARG 43 HD2 ARG 43 -10.311 -6.400 -11.955 341 HE ARG 43 HE ARG 43 -11.251 -3.821 -10.990 342 HH11 ARG 43 HH11 ARG 43 -10.972 -6.047 -13.674 343 HH12 ARG 43 HH12 ARG 43 -12.284 -5.341 -14.554 344 HH21 ARG 43 HH21 ARG 43 -12.978 -2.907 -12.151 345 HH22 ARG 43 HH22 ARG 43 -13.421 -3.558 -13.692 346 H ARG 44 H ARG 44 -6.688 -5.003 -9.079 347 HA ARG 44 HA ARG 44 -6.325 -7.800 -9.038 348 HB2 ARG 44 HB3 ARG 44 -4.493 -5.493 -9.642 349 HB3 ARG 44 HB2 ARG 44 -3.923 -7.155 -9.684 350 HG2 ARG 44 HG3 ARG 44 -6.259 -6.157 -11.296 351 HG3 ARG 44 HG2 ARG 44 -4.600 -6.206 -11.896 352 HD2 ARG 44 HD3 ARG 44 -5.405 -8.214 -12.674 353 HD3 ARG 44 HD2 ARG 44 -4.716 -8.705 -11.127 354 HE ARG 44 HE ARG 44 -7.392 -8.021 -10.711 355 HH11 ARG 44 HH11 ARG 44 -5.519 -10.459 -12.364 356 HH12 ARG 44 HH12 ARG 44 -6.742 -11.676 -12.218 357 HH21 ARG 44 HH21 ARG 44 -9.002 -9.621 -10.518 358 HH22 ARG 44 HH22 ARG 44 -8.719 -11.201 -11.170 359 H THR 45 H THR 45 -5.608 -5.344 -6.731 360 HA THR 45 HA THR 45 -3.552 -6.806 -5.373 361 HB THR 45 HB THR 45 -5.154 -4.521 -4.246 362 HG1 THR 45 HG1 THR 45 -4.430 -3.547 -5.986 363 HG21 THR 45 HG21 THR 45 -3.031 -3.961 -3.138 364 HG22 THR 45 HG22 THR 45 -2.329 -5.443 -3.787 365 HG23 THR 45 HG23 THR 45 -3.669 -5.529 -2.645 366 H TYR 46 H TYR 46 -7.023 -6.203 -4.751 367 HA TYR 46 HA TYR 46 -7.129 -7.498 -2.278 368 HB2 TYR 46 HB3 TYR 46 -9.485 -7.505 -2.476 369 HB3 TYR 46 HB2 TYR 46 -8.955 -6.081 -3.357 370 HD1 TYR 46 HD2 TYR 46 -9.669 -9.696 -4.047 371 HD2 TYR 46 HD1 TYR 46 -9.995 -5.664 -5.370 372 HE1 TYR 46 HE2 TYR 46 -10.902 -10.451 -6.019 373 HE2 TYR 46 HE1 TYR 46 -11.245 -6.416 -7.347 374 HH TYR 46 HH TYR 46 -11.249 -9.315 -8.533 375 H GLU 47 H GLU 47 -7.498 -8.789 -5.550 376 HA GLU 47 HA GLU 47 -7.962 -11.477 -4.629 377 HB2 GLU 47 HB3 GLU 47 -8.134 -10.057 -7.100 378 HB3 GLU 47 HB2 GLU 47 -7.097 -11.455 -7.343 379 HG2 GLU 47 HG3 GLU 47 -9.596 -11.956 -5.872 380 HG3 GLU 47 HG2 GLU 47 -9.771 -11.510 -7.568 381 H SER 48 H SER 48 -5.262 -9.503 -5.164 382 HA SER 48 HA SER 48 -3.398 -11.680 -5.631 383 HB2 SER 48 HB3 SER 48 -3.219 -8.705 -5.542 384 HB3 SER 48 HB2 SER 48 -1.753 -9.632 -5.244 385 HG SER 48 HG SER 48 -2.088 -10.665 -7.254 386 H PHE 49 H PHE 49 -4.589 -9.787 -2.973 387 HA PHE 49 HA PHE 49 -2.468 -10.215 -1.165 388 HB2 PHE 49 HB3 PHE 49 -5.048 -8.985 -1.124 389 HB3 PHE 49 HB2 PHE 49 -4.907 -10.033 0.284 390 HD1 PHE 49 HD1 PHE 49 -2.781 -7.582 -1.570 391 HD2 PHE 49 HD2 PHE 49 -4.121 -9.052 2.192 392 HE1 PHE 49 HE1 PHE 49 -1.450 -5.859 -0.427 393 HE2 PHE 49 HE2 PHE 49 -2.793 -7.331 3.342 394 HZ PHE 49 HZ PHE 49 -1.455 -5.731 2.033 395 HA PRO 50 HA PRO 50 -3.233 -14.517 -0.271 396 HB2 PRO 50 HB3 PRO 50 -1.361 -14.862 1.619 397 HB3 PRO 50 HB2 PRO 50 -0.930 -14.626 -0.079 398 HG2 PRO 50 HG3 PRO 50 -0.910 -12.654 2.172 399 HG3 PRO 50 HG2 PRO 50 0.288 -12.900 0.889 400 HD2 PRO 50 HD3 PRO 50 -1.617 -10.929 0.845 401 HD3 PRO 50 HD2 PRO 50 -0.882 -11.627 -0.612 402 H LYS 51 H LYS 51 -3.499 -11.930 2.015 403 HA LYS 51 HA LYS 51 -4.975 -13.690 3.860 404 HB2 LYS 51 HB3 LYS 51 -3.223 -11.316 4.311 405 HB3 LYS 51 HB2 LYS 51 -4.564 -11.584 5.417 406 HG2 LYS 51 HG3 LYS 51 -2.626 -13.778 4.798 407 HG3 LYS 51 HG2 LYS 51 -2.256 -12.547 6.008 408 HD2 LYS 51 HD3 LYS 51 -4.720 -13.205 6.812 409 HD3 LYS 51 HD2 LYS 51 -4.255 -14.734 6.062 410 HE2 LYS 51 HE3 LYS 51 -2.178 -14.697 7.437 411 HE3 LYS 51 HE2 LYS 51 -2.801 -13.268 8.259 412 HZ1 LYS 51 HZ1 LYS 51 -3.574 -14.835 9.667 413 HZ2 LYS 51 HZ2 LYS 51 -3.622 -16.052 8.494 414 HZ3 LYS 51 HZ3 LYS 51 -4.856 -14.897 8.566 415 H ARG 52 H ARG 52 -6.735 -13.341 2.231 416 HA ARG 52 HA ARG 52 -8.129 -10.800 2.746 417 HB2 ARG 52 HB3 ARG 52 -9.318 -11.280 0.562 418 HB3 ARG 52 HB2 ARG 52 -7.616 -10.858 0.435 419 HG2 ARG 52 HG3 ARG 52 -6.993 -13.093 0.000 420 HG3 ARG 52 HG2 ARG 52 -8.580 -13.702 0.471 421 HD2 ARG 52 HD3 ARG 52 -8.015 -11.938 -1.909 422 HD3 ARG 52 HD2 ARG 52 -8.273 -13.681 -1.968 423 HE ARG 52 HE ARG 52 -10.436 -12.287 -0.719 424 HH11 ARG 52 HH11 ARG 52 -9.078 -13.220 -3.794 425 HH12 ARG 52 HH12 ARG 52 -10.595 -13.158 -4.625 426 HH21 ARG 52 HH21 ARG 52 -12.434 -12.203 -1.810 427 HH22 ARG 52 HH22 ARG 52 -12.501 -12.579 -3.500 428 HA PRO 53 HA PRO 53 -9.583 -9.938 3.531 429 HB2 PRO 53 HB3 PRO 53 -11.184 -9.948 5.893 430 HB3 PRO 53 HB2 PRO 53 -11.626 -9.349 4.295 431 HG2 PRO 53 HG3 PRO 53 -12.766 -11.543 5.544 432 HG3 PRO 53 HG2 PRO 53 -12.816 -11.220 3.803 433 HD2 PRO 53 HD3 PRO 53 -11.026 -13.054 5.344 434 HD3 PRO 53 HD2 PRO 53 -11.766 -13.277 3.743 435 H LEU 54 H LEU 54 -8.483 -8.669 5.126 436 HA LEU 54 HA LEU 54 -6.547 -10.124 6.612 437 HB2 LEU 54 HB3 LEU 54 -7.254 -7.202 6.509 438 HB3 LEU 54 HB2 LEU 54 -5.943 -7.826 7.490 439 HG LEU 54 HG LEU 54 -5.728 -8.741 4.747 440 HD11 LEU 54 HD11 LEU 54 -6.879 -6.330 4.737 441 HD12 LEU 54 HD12 LEU 54 -5.688 -6.832 3.537 442 HD13 LEU 54 HD13 LEU 54 -5.193 -5.840 4.909 443 HD21 LEU 54 HD21 LEU 54 -3.525 -7.283 5.207 444 HD22 LEU 54 HD22 LEU 54 -3.745 -8.924 5.815 445 HD23 LEU 54 HD23 LEU 54 -4.059 -7.544 6.868 446 HA PRO 55 HA PRO 55 -9.040 -10.693 10.275 447 HB2 PRO 55 HB3 PRO 55 -6.551 -11.467 11.613 448 HB3 PRO 55 HB2 PRO 55 -7.985 -12.435 11.267 449 HG2 PRO 55 HG3 PRO 55 -5.645 -12.819 9.983 450 HG3 PRO 55 HG2 PRO 55 -7.214 -13.081 9.198 451 HD2 PRO 55 HD3 PRO 55 -5.347 -10.748 8.975 452 HD3 PRO 55 HD2 PRO 55 -6.287 -11.568 7.709 453 H GLU 56 H GLU 56 -9.382 -9.767 12.270 454 HA GLU 56 HA GLU 56 -9.456 -8.051 13.755 455 HB2 GLU 56 HB3 GLU 56 -6.512 -8.659 13.634 456 HB3 GLU 56 HB2 GLU 56 -7.180 -7.492 14.766 457 HG2 GLU 56 HG3 GLU 56 -8.350 -10.225 14.662 458 HG3 GLU 56 HG2 GLU 56 -6.795 -9.986 15.458 459 H ARG 57 H ARG 57 -9.268 -7.249 10.910 460 HA ARG 57 HA ARG 57 -8.673 -4.467 11.427 461 HB2 ARG 57 HB3 ARG 57 -7.033 -4.120 9.806 462 HB3 ARG 57 HB2 ARG 57 -6.536 -5.611 10.586 463 HG2 ARG 57 HG3 ARG 57 -6.225 -6.131 8.382 464 HG3 ARG 57 HG2 ARG 57 -7.856 -6.745 8.650 465 HD2 ARG 57 HD3 ARG 57 -7.321 -5.286 6.549 466 HD3 ARG 57 HD2 ARG 57 -8.833 -5.069 7.421 467 HE ARG 57 HE ARG 57 -8.139 -2.972 8.041 468 HH11 ARG 57 HH11 ARG 57 -5.416 -4.754 6.780 469 HH12 ARG 57 HH12 ARG 57 -4.369 -3.376 6.750 470 HH21 ARG 57 HH21 ARG 57 -6.762 -1.158 8.002 471 HH22 ARG 57 HH22 ARG 57 -5.132 -1.334 7.448 472 H THR 58 H THR 58 -9.419 -3.033 9.683 473 HA THR 58 HA THR 58 -11.892 -4.058 8.567 474 HB THR 58 HB THR 58 -10.832 -1.257 8.269 475 HG1 THR 58 HG1 THR 58 -10.747 -1.569 10.432 476 HG21 THR 58 HG21 THR 58 -13.604 -2.406 8.366 477 HG22 THR 58 HG22 THR 58 -12.819 -1.586 7.015 478 HG23 THR 58 HG23 THR 58 -13.244 -0.681 8.469 479 H ASN 59 H ASN 59 -12.024 -4.865 6.599 480 HA ASN 59 HA ASN 59 -9.870 -4.379 4.696 481 HB2 ASN 59 HB3 ASN 59 -12.156 -6.211 4.110 482 HB3 ASN 59 HB2 ASN 59 -10.460 -6.359 3.661 483 HD21 ASN 59 HD21 ASN 59 -9.073 -6.300 5.864 484 HD22 ASN 59 HD22 ASN 59 -9.552 -7.526 6.982 485 H VAL 60 H VAL 60 -10.050 -3.260 2.863 486 HA VAL 60 HA VAL 60 -12.708 -2.487 1.902 487 HB VAL 60 HB VAL 60 -10.439 -0.553 2.400 488 HG11 VAL 60 HG11 VAL 60 -11.255 0.475 0.572 489 HG12 VAL 60 HG12 VAL 60 -12.545 0.985 1.660 490 HG13 VAL 60 HG13 VAL 60 -12.773 -0.420 0.619 491 HG21 VAL 60 HG21 VAL 60 -12.860 0.332 3.525 492 HG22 VAL 60 HG22 VAL 60 -11.417 -0.231 4.369 493 HG23 VAL 60 HG23 VAL 60 -12.700 -1.370 3.960 494 H VAL 61 H VAL 61 -12.891 -2.618 -0.267 495 HA VAL 61 HA VAL 61 -10.403 -2.950 -1.816 496 HB VAL 61 HB VAL 61 -13.056 -4.308 -2.306 497 HG11 VAL 61 HG11 VAL 61 -11.838 -5.597 -4.002 498 HG12 VAL 61 HG12 VAL 61 -10.408 -4.604 -3.718 499 HG13 VAL 61 HG13 VAL 61 -11.870 -3.875 -4.381 500 HG21 VAL 61 HG21 VAL 61 -11.470 -4.995 -0.326 501 HG22 VAL 61 HG22 VAL 61 -10.556 -5.772 -1.619 502 HG23 VAL 61 HG23 VAL 61 -12.240 -6.217 -1.337 503 H LEU 62 H LEU 62 -10.379 -2.233 -3.966 504 HA LEU 62 HA LEU 62 -12.539 -0.402 -4.757 505 HB2 LEU 62 HB3 LEU 62 -10.497 0.789 -3.812 506 HB3 LEU 62 HB2 LEU 62 -9.615 0.191 -5.204 507 HG LEU 62 HG LEU 62 -11.567 1.361 -6.544 508 HD11 LEU 62 HD11 LEU 62 -11.513 3.476 -4.555 509 HD12 LEU 62 HD12 LEU 62 -12.324 2.020 -3.977 510 HD13 LEU 62 HD13 LEU 62 -12.871 2.805 -5.460 511 HD21 LEU 62 HD21 LEU 62 -9.153 1.902 -6.641 512 HD22 LEU 62 HD22 LEU 62 -9.366 2.964 -5.247 513 HD23 LEU 62 HD23 LEU 62 -10.189 3.326 -6.766 514 H THR 63 H THR 63 -13.411 -1.414 -6.453 515 HA THR 63 HA THR 63 -11.628 -2.259 -8.625 516 HB THR 63 HB THR 63 -12.479 -4.226 -7.333 517 HG1 THR 63 HG1 THR 63 -13.627 -4.206 -9.907 518 HG21 THR 63 HG21 THR 63 -14.857 -4.897 -7.833 519 HG22 THR 63 HG22 THR 63 -15.145 -3.209 -8.259 520 HG23 THR 63 HG23 THR 63 -14.638 -3.632 -6.623 521 H HIS 64 H HIS 64 -12.310 -1.733 -10.675 522 HA HIS 64 HA HIS 64 -14.142 0.373 -10.965 523 HB2 HIS 64 HB3 HIS 64 -12.437 -1.219 -12.721 524 HB3 HIS 64 HB2 HIS 64 -13.936 -0.726 -13.500 525 HD1 HIS 64 HD1 HIS 64 -14.018 2.077 -11.902 526 HD2 HIS 64 HD2 HIS 64 -10.893 0.570 -14.188 527 HE1 HIS 64 HE1 HIS 64 -12.665 4.079 -12.597 528 HE2 HIS 64 HE2 HIS 64 -10.735 3.136 -13.910 529 H GLN 65 H GLN 65 -14.550 -3.085 -11.150 530 HA GLN 65 HA GLN 65 -16.931 -3.270 -12.570 531 HB2 GLN 65 HB3 GLN 65 -15.749 -4.931 -10.361 532 HB3 GLN 65 HB2 GLN 65 -17.313 -5.331 -11.057 533 HG2 GLN 65 HG3 GLN 65 -16.414 -5.904 -13.096 534 HG3 GLN 65 HG2 GLN 65 -14.967 -4.928 -12.850 535 HE21 GLN 65 HE21 GLN 65 -13.438 -5.688 -11.224 536 HE22 GLN 65 HE22 GLN 65 -13.248 -7.390 -10.990 537 H GLU 66 H GLU 66 -18.961 -2.680 -12.172 538 HA GLU 66 HA GLU 66 -19.582 -1.356 -9.677 539 HB2 GLU 66 HB3 GLU 66 -21.783 -0.904 -10.808 540 HB3 GLU 66 HB2 GLU 66 -20.371 -0.264 -11.637 541 HG2 GLU 66 HG3 GLU 66 -21.045 -2.936 -12.532 542 HG3 GLU 66 HG2 GLU 66 -22.379 -1.803 -12.740 543 H ASP 67 H ASP 67 -20.361 -4.370 -11.279 544 HA ASP 67 HA ASP 67 -22.277 -5.019 -9.158 545 HB2 ASP 67 HB3 ASP 67 -21.781 -6.143 -11.899 546 HB3 ASP 67 HB2 ASP 67 -22.696 -7.053 -10.701 547 H TYR 68 H TYR 68 -19.202 -5.110 -9.020 548 HA TYR 68 HA TYR 68 -18.571 -7.888 -8.759 549 HB2 TYR 68 HB3 TYR 68 -16.841 -6.184 -9.244 550 HB3 TYR 68 HB2 TYR 68 -17.086 -5.500 -7.640 551 HD1 TYR 68 HD1 TYR 68 -16.528 -8.906 -9.085 552 HD2 TYR 68 HD2 TYR 68 -15.456 -6.060 -6.110 553 HE1 TYR 68 HE1 TYR 68 -14.891 -10.493 -8.167 554 HE2 TYR 68 HE2 TYR 68 -13.813 -7.639 -5.184 555 HH TYR 68 HH TYR 68 -13.772 -10.886 -5.918 556 H GLN 69 H GLN 69 -18.130 -9.041 -6.822 557 HA GLN 69 HA GLN 69 -19.366 -7.904 -4.407 558 HB2 GLN 69 HB3 GLN 69 -19.663 -10.801 -5.171 559 HB3 GLN 69 HB2 GLN 69 -20.543 -9.905 -3.941 560 HG2 GLN 69 HG3 GLN 69 -20.786 -9.058 -6.784 561 HG3 GLN 69 HG2 GLN 69 -21.644 -10.497 -6.240 562 HE21 GLN 69 HE21 GLN 69 -21.361 -7.050 -5.967 563 HE22 GLN 69 HE22 GLN 69 -22.854 -6.787 -5.138 564 H ALA 70 H ALA 70 -17.628 -7.593 -3.137 565 HA ALA 70 HA ALA 70 -15.600 -9.698 -2.946 566 HB1 ALA 70 HB1 ALA 70 -15.447 -7.058 -1.534 567 HB2 ALA 70 HB2 ALA 70 -15.050 -7.199 -3.247 568 HB3 ALA 70 HB3 ALA 70 -14.138 -8.121 -2.051 569 H GLN 71 H GLN 71 -16.439 -11.252 -1.664 570 HA GLN 71 HA GLN 71 -18.018 -10.777 0.632 571 HB2 GLN 71 HB3 GLN 71 -16.402 -13.270 0.144 572 HB3 GLN 71 HB2 GLN 71 -17.928 -13.113 1.003 573 HG2 GLN 71 HG3 GLN 71 -19.060 -13.527 -0.847 574 HG3 GLN 71 HG2 GLN 71 -18.265 -12.191 -1.677 575 HE21 GLN 71 HE21 GLN 71 -17.586 -12.905 -3.567 576 HE22 GLN 71 HE22 GLN 71 -16.731 -14.379 -3.851 577 H GLY 72 H GLY 72 -17.419 -10.099 2.570 578 HA2 GLY 72 HA3 GLY 72 -16.102 -10.380 4.549 579 HA3 GLY 72 HA2 GLY 72 -14.734 -10.803 3.534 580 H ALA 73 H ALA 73 -15.241 -8.477 1.695 581 HA ALA 73 HA ALA 73 -14.436 -6.325 3.543 582 HB1 ALA 73 HB1 ALA 73 -12.789 -5.580 1.903 583 HB2 ALA 73 HB2 ALA 73 -13.212 -6.934 0.855 584 HB3 ALA 73 HB3 ALA 73 -12.467 -7.234 2.425 585 H VAL 74 H VAL 74 -14.520 -4.133 2.445 586 HA VAL 74 HA VAL 74 -17.144 -3.819 1.267 587 HB VAL 74 HB VAL 74 -15.134 -1.622 1.744 588 HG11 VAL 74 HG11 VAL 74 -17.202 -1.201 0.374 589 HG12 VAL 74 HG12 VAL 74 -17.009 -0.171 1.793 590 HG13 VAL 74 HG13 VAL 74 -18.140 -1.523 1.832 591 HG21 VAL 74 HG21 VAL 74 -17.135 -2.723 3.717 592 HG22 VAL 74 HG22 VAL 74 -16.115 -1.303 3.954 593 HG23 VAL 74 HG23 VAL 74 -15.383 -2.903 3.817 594 H VAL 75 H VAL 75 -17.608 -2.980 -0.768 595 HA VAL 75 HA VAL 75 -15.327 -2.820 -2.629 596 HB VAL 75 HB VAL 75 -18.090 -3.823 -3.322 597 HG11 VAL 75 HG11 VAL 75 -16.539 -2.715 -5.071 598 HG12 VAL 75 HG12 VAL 75 -17.290 -4.263 -5.457 599 HG13 VAL 75 HG13 VAL 75 -15.603 -4.205 -4.946 600 HG21 VAL 75 HG21 VAL 75 -15.665 -5.224 -2.348 601 HG22 VAL 75 HG22 VAL 75 -16.584 -5.989 -3.644 602 HG23 VAL 75 HG23 VAL 75 -17.370 -5.609 -2.111 603 H VAL 76 H VAL 76 -15.148 -0.976 -3.717 604 HA VAL 76 HA VAL 76 -17.538 0.685 -4.108 605 HB VAL 76 HB VAL 76 -16.002 2.703 -3.768 606 HG11 VAL 76 HG11 VAL 76 -17.501 2.726 -2.105 607 HG12 VAL 76 HG12 VAL 76 -16.157 2.155 -1.115 608 HG13 VAL 76 HG13 VAL 76 -17.317 1.003 -1.776 609 HG21 VAL 76 HG21 VAL 76 -14.069 0.769 -3.466 610 HG22 VAL 76 HG22 VAL 76 -14.401 1.269 -1.807 611 HG23 VAL 76 HG23 VAL 76 -13.921 2.465 -3.011 612 H HIS 77 H HIS 77 -17.492 2.032 -5.931 613 HA HIS 77 HA HIS 77 -15.277 1.559 -7.804 614 HB2 HIS 77 HB3 HIS 77 -17.821 1.899 -9.173 615 HB3 HIS 77 HB2 HIS 77 -16.604 0.644 -9.369 616 HD1 HIS 77 HD1 HIS 77 -16.781 -1.353 -7.517 617 HD2 HIS 77 HD2 HIS 77 -20.134 1.044 -8.042 618 HE1 HIS 77 HE1 HIS 77 -18.697 -2.657 -6.545 619 HE2 HIS 77 HE2 HIS 77 -20.696 -1.141 -6.775 620 H ASP 78 H ASP 78 -15.071 3.756 -6.397 621 HA ASP 78 HA ASP 78 -15.322 5.809 -8.319 622 HB2 ASP 78 HB3 ASP 78 -17.529 5.509 -6.507 623 HB3 ASP 78 HB2 ASP 78 -16.696 7.019 -6.154 624 H VAL 79 H VAL 79 -14.004 7.573 -7.827 625 HA VAL 79 HA VAL 79 -11.984 7.084 -5.903 626 HB VAL 79 HB VAL 79 -11.559 9.682 -6.429 627 HG11 VAL 79 HG11 VAL 79 -10.786 8.007 -8.698 628 HG12 VAL 79 HG12 VAL 79 -10.417 7.308 -7.121 629 HG13 VAL 79 HG13 VAL 79 -9.788 8.899 -7.550 630 HG21 VAL 79 HG21 VAL 79 -12.669 8.840 -9.061 631 HG22 VAL 79 HG22 VAL 79 -12.383 10.459 -8.423 632 HG23 VAL 79 HG23 VAL 79 -13.762 9.519 -7.856 633 H ALA 80 H ALA 80 -14.454 9.600 -6.110 634 HA ALA 80 HA ALA 80 -14.018 10.619 -3.509 635 HB1 ALA 80 HB1 ALA 80 -16.540 11.395 -3.996 636 HB2 ALA 80 HB2 ALA 80 -16.033 10.993 -5.636 637 HB3 ALA 80 HB3 ALA 80 -15.131 12.187 -4.702 638 H ALA 81 H ALA 81 -15.774 7.896 -4.720 639 HA ALA 81 HA ALA 81 -17.712 7.541 -2.750 640 HB1 ALA 81 HB1 ALA 81 -17.950 6.087 -4.520 641 HB2 ALA 81 HB2 ALA 81 -17.270 5.020 -3.292 642 HB3 ALA 81 HB3 ALA 81 -16.235 5.680 -4.558 643 H VAL 82 H VAL 82 -14.673 5.687 -2.893 644 HA VAL 82 HA VAL 82 -14.724 4.756 -0.288 645 HB VAL 82 HB VAL 82 -13.185 4.051 -2.194 646 HG11 VAL 82 HG11 VAL 82 -11.354 5.224 -2.777 647 HG12 VAL 82 HG12 VAL 82 -11.102 5.853 -1.148 648 HG13 VAL 82 HG13 VAL 82 -12.316 6.582 -2.197 649 HG21 VAL 82 HG21 VAL 82 -11.540 3.159 -0.718 650 HG22 VAL 82 HG22 VAL 82 -13.068 3.218 0.160 651 HG23 VAL 82 HG23 VAL 82 -11.829 4.435 0.466 652 H PHE 83 H PHE 83 -13.624 7.853 -1.533 653 HA PHE 83 HA PHE 83 -12.181 8.700 0.718 654 HB2 PHE 83 HB3 PHE 83 -13.521 10.070 -1.573 655 HB3 PHE 83 HB2 PHE 83 -13.013 11.045 -0.200 656 HD1 PHE 83 HD2 PHE 83 -10.516 9.803 0.605 657 HD2 PHE 83 HD1 PHE 83 -12.057 10.533 -3.294 658 HE1 PHE 83 HE2 PHE 83 -8.223 9.858 -0.287 659 HE2 PHE 83 HE1 PHE 83 -9.768 10.588 -4.193 660 HZ PHE 83 HZ PHE 83 -7.847 10.249 -2.689 661 H ALA 84 H ALA 84 -15.611 9.082 -0.130 662 HA ALA 84 HA ALA 84 -16.323 10.561 2.165 663 HB1 ALA 84 HB1 ALA 84 -18.365 8.731 1.083 664 HB2 ALA 84 HB2 ALA 84 -17.644 9.836 -0.087 665 HB3 ALA 84 HB3 ALA 84 -18.434 10.472 1.356 666 H TYR 85 H TYR 85 -15.962 7.158 1.508 667 HA TYR 85 HA TYR 85 -17.154 6.190 3.888 668 HB2 TYR 85 HB3 TYR 85 -16.806 4.261 2.793 669 HB3 TYR 85 HB2 TYR 85 -15.760 5.074 1.639 670 HD1 TYR 85 HD1 TYR 85 -15.737 3.442 4.989 671 HD2 TYR 85 HD2 TYR 85 -13.491 4.574 1.565 672 HE1 TYR 85 HE1 TYR 85 -13.809 2.178 5.841 673 HE2 TYR 85 HE2 TYR 85 -11.556 3.316 2.402 674 HH TYR 85 HH TYR 85 -10.671 2.353 4.309 675 H ALA 86 H ALA 86 -13.696 6.517 3.034 676 HA ALA 86 HA ALA 86 -12.521 6.058 5.426 677 HB1 ALA 86 HB1 ALA 86 -11.427 6.715 3.227 678 HB2 ALA 86 HB2 ALA 86 -10.653 7.291 4.704 679 HB3 ALA 86 HB3 ALA 86 -11.645 8.387 3.744 680 H LYS 87 H LYS 87 -14.123 9.084 4.486 681 HA LYS 87 HA LYS 87 -13.406 10.494 6.857 682 HB2 LYS 87 HB3 LYS 87 -14.532 11.240 4.508 683 HB3 LYS 87 HB2 LYS 87 -15.967 11.169 5.522 684 HG2 LYS 87 HG3 LYS 87 -15.101 13.407 5.517 685 HG3 LYS 87 HG2 LYS 87 -14.879 12.701 7.119 686 HD2 LYS 87 HD3 LYS 87 -12.712 13.183 7.000 687 HD3 LYS 87 HD2 LYS 87 -12.563 12.085 5.627 688 HE2 LYS 87 HE3 LYS 87 -13.572 14.211 4.362 689 HE3 LYS 87 HE2 LYS 87 -12.766 15.039 5.694 690 HZ1 LYS 87 HZ1 LYS 87 -10.731 14.481 4.931 691 HZ2 LYS 87 HZ2 LYS 87 -11.536 14.408 3.445 692 HZ3 LYS 87 HZ3 LYS 87 -11.230 12.988 4.310 693 H GLN 88 H GLN 88 -16.200 8.643 5.825 694 HA GLN 88 HA GLN 88 -17.821 8.972 8.074 695 HB2 GLN 88 HB3 GLN 88 -18.397 7.904 5.819 696 HB3 GLN 88 HB2 GLN 88 -17.705 6.425 6.471 697 HG2 GLN 88 HG3 GLN 88 -19.832 6.040 7.079 698 HG3 GLN 88 HG2 GLN 88 -19.384 7.037 8.462 699 HE21 GLN 88 HE21 GLN 88 -20.255 7.741 5.094 700 HE22 GLN 88 HE22 GLN 88 -21.515 8.861 5.474 701 H HIS 89 H HIS 89 -14.894 7.212 7.736 702 HA HIS 89 HA HIS 89 -15.453 5.716 10.207 703 HB2 HIS 89 HB3 HIS 89 -14.134 5.005 7.750 704 HB3 HIS 89 HB2 HIS 89 -13.008 4.839 9.093 705 HD1 HIS 89 HD1 HIS 89 -14.177 3.432 11.220 706 HD2 HIS 89 HD2 HIS 89 -15.611 2.782 7.374 707 HE1 HIS 89 HE1 HIS 89 -15.365 1.217 11.311 708 HE2 HIS 89 HE2 HIS 89 -16.152 0.806 8.953 709 HA PRO 90 HA PRO 90 -12.426 9.022 11.433 710 HB2 PRO 90 HB3 PRO 90 -13.759 9.972 13.555 711 HB3 PRO 90 HB2 PRO 90 -14.166 10.476 11.909 712 HG2 PRO 90 HG3 PRO 90 -15.502 8.432 13.647 713 HG3 PRO 90 HG2 PRO 90 -16.238 9.692 12.640 714 HD2 PRO 90 HD3 PRO 90 -16.013 7.087 11.856 715 HD3 PRO 90 HD2 PRO 90 -16.034 8.452 10.723 716 H ASP 91 H ASP 91 -13.599 6.144 12.679 717 HA ASP 91 HA ASP 91 -12.301 6.252 15.250 718 HB2 ASP 91 HB3 ASP 91 -14.385 4.854 14.533 719 HB3 ASP 91 HB2 ASP 91 -13.190 3.703 13.942 720 H GLN 92 H GLN 92 -11.386 5.435 12.035 721 HA GLN 92 HA GLN 92 -8.757 4.614 13.021 722 HB2 GLN 92 HB3 GLN 92 -10.384 3.083 10.988 723 HB3 GLN 92 HB2 GLN 92 -8.676 2.806 11.298 724 HG2 GLN 92 HG3 GLN 92 -9.092 1.591 13.113 725 HG3 GLN 92 HG2 GLN 92 -10.280 2.742 13.719 726 HE21 GLN 92 HE21 GLN 92 -10.276 0.954 10.679 727 HE22 GLN 92 HE22 GLN 92 -11.735 0.080 10.982 728 H GLU 93 H GLU 93 -7.199 4.411 11.076 729 HA GLU 93 HA GLU 93 -7.586 6.802 9.421 730 HB2 GLU 93 HB3 GLU 93 -5.246 5.473 10.642 731 HB3 GLU 93 HB2 GLU 93 -4.987 6.130 9.032 732 HG2 GLU 93 HG3 GLU 93 -6.132 7.723 11.309 733 HG3 GLU 93 HG2 GLU 93 -4.412 7.658 10.926 734 H LEU 94 H LEU 94 -6.728 6.737 7.198 735 HA LEU 94 HA LEU 94 -7.415 4.182 5.934 736 HB2 LEU 94 HB3 LEU 94 -8.240 6.742 5.386 737 HB3 LEU 94 HB2 LEU 94 -6.976 6.502 4.195 738 HG LEU 94 HG LEU 94 -8.192 4.339 3.573 739 HD11 LEU 94 HD11 LEU 94 -10.092 5.554 5.505 740 HD12 LEU 94 HD12 LEU 94 -9.725 3.858 5.190 741 HD13 LEU 94 HD13 LEU 94 -10.750 4.761 4.074 742 HD21 LEU 94 HD21 LEU 94 -9.238 7.102 3.063 743 HD22 LEU 94 HD22 LEU 94 -9.972 5.689 2.305 744 HD23 LEU 94 HD23 LEU 94 -8.275 6.067 2.009 745 H VAL 95 H VAL 95 -5.870 2.934 5.130 746 HA VAL 95 HA VAL 95 -3.329 4.174 4.308 747 HB VAL 95 HB VAL 95 -3.557 1.502 5.695 748 HG11 VAL 95 HG11 VAL 95 -1.603 2.343 4.026 749 HG12 VAL 95 HG12 VAL 95 -1.349 1.220 5.361 750 HG13 VAL 95 HG13 VAL 95 -0.992 2.934 5.571 751 HG21 VAL 95 HG21 VAL 95 -3.212 2.454 7.705 752 HG22 VAL 95 HG22 VAL 95 -3.905 3.883 6.940 753 HG23 VAL 95 HG23 VAL 95 -2.154 3.703 7.048 754 H ILE 96 H ILE 96 -2.976 3.839 2.220 755 HA ILE 96 HA ILE 96 -4.374 1.731 0.806 756 HB ILE 96 HB ILE 96 -2.540 3.936 -0.141 757 HG12 ILE 96 HG13 ILE 96 -4.577 4.802 -1.200 758 HG13 ILE 96 HG12 ILE 96 -5.491 3.430 -0.585 759 HG21 ILE 96 HG21 ILE 96 -3.906 1.795 -1.767 760 HG22 ILE 96 HG22 ILE 96 -2.169 2.052 -1.596 761 HG23 ILE 96 HG23 ILE 96 -3.158 3.244 -2.440 762 HD11 ILE 96 HD11 ILE 96 -5.719 5.617 0.660 763 HD12 ILE 96 HD12 ILE 96 -4.071 5.346 1.230 764 HD13 ILE 96 HD13 ILE 96 -5.344 4.190 1.626 765 H ALA 97 H ALA 97 -3.541 -0.170 0.226 766 HA ALA 97 HA ALA 97 -0.687 -0.636 0.755 767 HB1 ALA 97 HB1 ALA 97 -1.337 -3.048 0.831 768 HB2 ALA 97 HB2 ALA 97 -3.019 -2.540 0.681 769 HB3 ALA 97 HB3 ALA 97 -2.071 -2.050 2.086 770 H GLY 98 H GLY 98 -3.181 -0.868 -1.692 771 HA2 GLY 98 HA3 GLY 98 -1.372 -0.796 -3.833 772 HA3 GLY 98 HA2 GLY 98 -1.799 -2.476 -3.548 773 H GLY 99 H GLY 99 -4.141 -1.297 -6.101 774 HA2 GLY 99 HA3 GLY 99 -1.348 -1.994 -5.553 775 HA3 GLY 99 HA2 GLY 99 -2.212 -2.259 -7.056 776 H ALA 100 H ALA 100 -0.266 -1.370 -8.027 777 HA ALA 100 HA ALA 100 0.706 1.201 -7.627 778 HB1 ALA 100 HB1 ALA 100 0.630 -0.369 -10.201 779 HB2 ALA 100 HB2 ALA 100 1.874 -0.473 -8.956 780 HB3 ALA 100 HB3 ALA 100 1.664 1.021 -9.869 781 H GLN 101 H GLN 101 -2.062 0.111 -9.505 782 HA GLN 101 HA GLN 101 -2.471 2.584 -10.863 783 HB2 GLN 101 HB3 GLN 101 -3.968 0.044 -10.521 784 HB3 GLN 101 HB2 GLN 101 -4.903 1.462 -10.978 785 HG2 GLN 101 HG3 GLN 101 -4.383 0.716 -13.045 786 HG3 GLN 101 HG2 GLN 101 -2.948 1.698 -12.754 787 HE21 GLN 101 HE21 GLN 101 -4.175 -1.428 -13.327 788 HE22 GLN 101 HE22 GLN 101 -2.676 -2.283 -13.258 789 H ILE 102 H ILE 102 -3.782 1.112 -7.935 790 HA ILE 102 HA ILE 102 -5.656 3.164 -7.376 791 HB ILE 102 HB ILE 102 -4.386 1.049 -5.639 792 HG12 ILE 102 HG13 ILE 102 -6.652 0.093 -5.668 793 HG13 ILE 102 HG12 ILE 102 -7.207 1.432 -6.666 794 HG21 ILE 102 HG21 ILE 102 -6.315 1.722 -4.045 795 HG22 ILE 102 HG22 ILE 102 -6.225 3.276 -4.875 796 HG23 ILE 102 HG23 ILE 102 -4.814 2.647 -4.024 797 HD11 ILE 102 HD11 ILE 102 -6.013 0.687 -8.524 798 HD12 ILE 102 HD12 ILE 102 -6.700 -0.774 -7.816 799 HD13 ILE 102 HD13 ILE 102 -5.001 -0.384 -7.556 800 H PHE 103 H PHE 103 -2.244 2.836 -6.904 801 HA PHE 103 HA PHE 103 -1.987 4.833 -4.874 802 HB2 PHE 103 HB3 PHE 103 -0.096 3.330 -6.640 803 HB3 PHE 103 HB2 PHE 103 0.479 4.773 -5.812 804 HD1 PHE 103 HD1 PHE 103 -0.417 4.788 -3.216 805 HD2 PHE 103 HD2 PHE 103 0.438 1.369 -5.601 806 HE1 PHE 103 HE1 PHE 103 -0.032 3.467 -1.177 807 HE2 PHE 103 HE2 PHE 103 0.824 0.041 -3.566 808 HZ PHE 103 HZ PHE 103 0.588 1.090 -1.350 809 H THR 104 H THR 104 -1.773 4.770 -8.393 810 HA THR 104 HA THR 104 -0.755 7.325 -8.835 811 HB THR 104 HB THR 104 -2.757 5.816 -10.523 812 HG1 THR 104 HG1 THR 104 -0.954 4.562 -10.262 813 HG21 THR 104 HG21 THR 104 -1.861 8.386 -10.912 814 HG22 THR 104 HG22 THR 104 -2.529 7.312 -12.142 815 HG23 THR 104 HG23 THR 104 -0.783 7.412 -11.914 816 H ALA 105 H ALA 105 -4.165 6.286 -8.639 817 HA ALA 105 HA ALA 105 -5.316 8.792 -9.066 818 HB1 ALA 105 HB1 ALA 105 -6.241 6.317 -7.668 819 HB2 ALA 105 HB2 ALA 105 -6.827 7.046 -9.163 820 HB3 ALA 105 HB3 ALA 105 -7.220 7.784 -7.610 821 H PHE 106 H PHE 106 -4.774 7.210 -5.889 822 HA PHE 106 HA PHE 106 -5.398 9.552 -4.442 823 HB2 PHE 106 HB3 PHE 106 -3.970 7.007 -3.663 824 HB3 PHE 106 HB2 PHE 106 -4.368 8.284 -2.520 825 HD1 PHE 106 HD2 PHE 106 -5.989 6.093 -5.068 826 HD2 PHE 106 HD1 PHE 106 -6.358 8.173 -1.374 827 HE1 PHE 106 HE2 PHE 106 -8.208 5.091 -4.734 828 HE2 PHE 106 HE1 PHE 106 -8.579 7.171 -1.032 829 HZ PHE 106 HZ PHE 106 -9.502 5.627 -2.716 830 H LYS 107 H LYS 107 -2.610 8.657 -6.179 831 HA LYS 107 HA LYS 107 -0.461 9.515 -4.754 832 HB2 LYS 107 HB3 LYS 107 0.675 9.678 -6.740 833 HB3 LYS 107 HB2 LYS 107 -0.727 8.764 -7.271 834 HG2 LYS 107 HG3 LYS 107 -1.754 10.959 -7.964 835 HG3 LYS 107 HG2 LYS 107 -0.178 11.694 -7.661 836 HD2 LYS 107 HD3 LYS 107 0.855 10.282 -9.316 837 HD3 LYS 107 HD2 LYS 107 -0.645 9.379 -9.538 838 HE2 LYS 107 HE3 LYS 107 -1.156 10.793 -11.176 839 HE3 LYS 107 HE2 LYS 107 -1.342 12.047 -9.951 840 HZ1 LYS 107 HZ1 LYS 107 0.850 11.577 -11.814 841 HZ2 LYS 107 HZ2 LYS 107 1.273 12.127 -10.272 842 HZ3 LYS 107 HZ3 LYS 107 0.217 13.035 -11.232 843 H ASP 108 H ASP 108 -2.826 11.568 -6.381 844 HA ASP 108 HA ASP 108 -1.480 13.988 -5.502 845 HB2 ASP 108 HB3 ASP 108 -3.595 13.310 -7.426 846 HB3 ASP 108 HB2 ASP 108 -3.888 14.804 -6.541 847 H ASP 109 H ASP 109 -4.301 12.061 -4.729 848 HA ASP 109 HA ASP 109 -5.281 13.991 -2.794 849 HB2 ASP 109 HB3 ASP 109 -6.258 11.403 -3.905 850 HB3 ASP 109 HB2 ASP 109 -6.875 11.925 -2.341 851 H VAL 110 H VAL 110 -2.706 12.115 -2.615 852 HA VAL 110 HA VAL 110 -3.224 10.759 -0.113 853 HB VAL 110 HB VAL 110 -1.755 9.751 -1.819 854 HG11 VAL 110 HG11 VAL 110 0.447 11.616 -1.102 855 HG12 VAL 110 HG12 VAL 110 -0.738 12.135 -2.300 856 HG13 VAL 110 HG13 VAL 110 0.201 10.666 -2.567 857 HG21 VAL 110 HG21 VAL 110 -1.557 9.403 0.733 858 HG22 VAL 110 HG22 VAL 110 -0.061 10.324 0.583 859 HG23 VAL 110 HG23 VAL 110 -0.260 8.815 -0.307 860 H ASP 111 H ASP 111 -1.904 11.074 1.791 861 HA ASP 111 HA ASP 111 -0.925 13.833 2.101 862 HB2 ASP 111 HB3 ASP 111 -3.234 13.133 3.182 863 HB3 ASP 111 HB2 ASP 111 -2.191 12.433 4.416 864 H THR 112 H THR 112 -0.732 10.477 3.207 865 HA THR 112 HA THR 112 1.911 11.090 4.354 866 HB THR 112 HB THR 112 0.018 8.859 5.106 867 HG1 THR 112 HG1 THR 112 0.815 11.118 6.615 868 HG21 THR 112 HG21 THR 112 1.554 8.603 7.065 869 HG22 THR 112 HG22 THR 112 2.715 9.608 6.197 870 HG23 THR 112 HG23 THR 112 2.207 8.061 5.519 871 H LEU 113 H LEU 113 3.555 9.430 4.147 872 HA LEU 113 HA LEU 113 3.126 7.513 1.980 873 HB2 LEU 113 HB3 LEU 113 4.401 9.929 1.582 874 HB3 LEU 113 HB2 LEU 113 5.731 8.821 1.847 875 HG LEU 113 HG LEU 113 5.086 7.473 -0.023 876 HD11 LEU 113 HD11 LEU 113 2.509 8.605 0.438 877 HD12 LEU 113 HD12 LEU 113 2.961 7.275 -0.627 878 HD13 LEU 113 HD13 LEU 113 2.987 8.932 -1.227 879 HD21 LEU 113 HD21 LEU 113 4.818 9.550 -1.737 880 HD22 LEU 113 HD22 LEU 113 6.346 9.046 -1.014 881 HD23 LEU 113 HD23 LEU 113 5.428 10.374 -0.301 882 H LEU 114 H LEU 114 3.773 5.587 2.617 883 HA LEU 114 HA LEU 114 6.108 5.360 4.396 884 HB2 LEU 114 HB3 LEU 114 3.431 4.016 4.598 885 HB3 LEU 114 HB2 LEU 114 4.863 3.239 5.244 886 HG LEU 114 HG LEU 114 4.341 6.040 6.086 887 HD11 LEU 114 HD11 LEU 114 2.752 5.407 7.759 888 HD12 LEU 114 HD12 LEU 114 2.843 3.714 7.275 889 HD13 LEU 114 HD13 LEU 114 2.129 4.904 6.188 890 HD21 LEU 114 HD21 LEU 114 5.437 5.381 8.049 891 HD22 LEU 114 HD22 LEU 114 6.311 4.561 6.755 892 HD23 LEU 114 HD23 LEU 114 5.150 3.669 7.739 893 H VAL 115 H VAL 115 7.656 4.520 3.121 894 HA VAL 115 HA VAL 115 6.901 2.242 1.407 895 HB VAL 115 HB VAL 115 8.547 2.944 -0.232 896 HG11 VAL 115 HG11 VAL 115 6.150 3.868 -0.143 897 HG12 VAL 115 HG12 VAL 115 7.313 4.666 -1.201 898 HG13 VAL 115 HG13 VAL 115 6.906 5.380 0.360 899 HG21 VAL 115 HG21 VAL 115 10.148 4.019 1.256 900 HG22 VAL 115 HG22 VAL 115 9.002 5.325 1.562 901 HG23 VAL 115 HG23 VAL 115 9.681 5.107 -0.052 902 H THR 116 H THR 116 8.425 0.625 1.057 903 HA THR 116 HA THR 116 10.621 0.517 3.020 904 HB THR 116 HB THR 116 8.815 -1.683 1.998 905 HG1 THR 116 HG1 THR 116 8.325 -1.893 4.187 906 HG21 THR 116 HG21 THR 116 11.257 -1.974 3.730 907 HG22 THR 116 HG22 THR 116 11.052 -2.598 2.093 908 HG23 THR 116 HG23 THR 116 10.065 -3.234 3.409 909 H ARG 117 H ARG 117 12.318 1.135 1.757 910 HA ARG 117 HA ARG 117 12.603 0.191 -0.948 911 HB2 ARG 117 HB3 ARG 117 13.455 2.419 0.340 912 HB3 ARG 117 HB2 ARG 117 14.922 1.449 0.374 913 HG2 ARG 117 HG3 ARG 117 14.268 1.131 -2.194 914 HG3 ARG 117 HG2 ARG 117 13.527 2.706 -1.905 915 HD2 ARG 117 HD3 ARG 117 16.272 2.332 -0.876 916 HD3 ARG 117 HD2 ARG 117 16.094 2.380 -2.629 917 HE ARG 117 HE ARG 117 15.508 4.608 -2.495 918 HH11 ARG 117 HH11 ARG 117 15.669 3.237 0.714 919 HH12 ARG 117 HH12 ARG 117 15.592 4.773 1.507 920 HH21 ARG 117 HH21 ARG 117 15.406 6.626 -1.449 921 HH22 ARG 117 HH22 ARG 117 15.442 6.695 0.282 922 H LEU 118 H LEU 118 13.105 -1.892 -1.228 923 HA LEU 118 HA LEU 118 14.782 -3.347 0.588 924 HB2 LEU 118 HB3 LEU 118 12.989 -3.951 -1.550 925 HB3 LEU 118 HB2 LEU 118 14.528 -4.715 -1.897 926 HG LEU 118 HG LEU 118 14.308 -5.532 0.607 927 HD11 LEU 118 HD11 LEU 118 11.624 -4.540 -0.098 928 HD12 LEU 118 HD12 LEU 118 12.386 -4.741 1.480 929 HD13 LEU 118 HD13 LEU 118 11.690 -6.134 0.652 930 HD21 LEU 118 HD21 LEU 118 13.492 -6.602 -1.974 931 HD22 LEU 118 HD22 LEU 118 12.644 -7.349 -0.620 932 HD23 LEU 118 HD23 LEU 118 14.407 -7.359 -0.670 933 H ALA 119 H ALA 119 16.837 -4.244 0.135 934 HA ALA 119 HA ALA 119 18.539 -2.502 -1.397 935 HB1 ALA 119 HB1 ALA 119 18.875 -4.211 0.793 936 HB2 ALA 119 HB2 ALA 119 20.102 -3.214 0.012 937 HB3 ALA 119 HB3 ALA 119 19.870 -4.888 -0.496 938 H GLY 120 H GLY 120 17.231 -5.743 -1.721 939 HA2 GLY 120 HA3 GLY 120 18.869 -6.616 -3.843 940 HA3 GLY 120 HA2 GLY 120 17.283 -7.255 -3.444 941 H SER 121 H SER 121 18.554 -6.712 -6.044 942 HA SER 121 HA SER 121 16.798 -4.626 -7.124 943 HB2 SER 121 HB3 SER 121 18.292 -4.365 -8.875 944 HB3 SER 121 HB2 SER 121 19.385 -4.858 -7.582 945 HG SER 121 HG SER 121 18.342 -6.439 -9.685 946 H PHE 122 H PHE 122 14.923 -5.250 -7.963 947 HA PHE 122 HA PHE 122 14.770 -7.901 -9.242 948 HB2 PHE 122 HB3 PHE 122 12.573 -6.523 -7.686 949 HB3 PHE 122 HB2 PHE 122 12.470 -8.105 -8.451 950 HD1 PHE 122 HD2 PHE 122 14.311 -6.214 -5.840 951 HD2 PHE 122 HD1 PHE 122 13.063 -10.020 -7.278 952 HE1 PHE 122 HE2 PHE 122 15.134 -7.261 -3.772 953 HE2 PHE 122 HE1 PHE 122 13.884 -11.074 -5.211 954 HZ PHE 122 HZ PHE 122 14.921 -9.694 -3.455 955 H GLU 123 H GLU 123 12.986 -8.093 -10.835 956 HA GLU 123 HA GLU 123 12.210 -5.568 -12.088 957 HB2 GLU 123 HB3 GLU 123 12.930 -6.304 -14.293 958 HB3 GLU 123 HB2 GLU 123 14.300 -6.261 -13.192 959 HG2 GLU 123 HG3 GLU 123 13.130 -8.859 -13.112 960 HG3 GLU 123 HG2 GLU 123 13.403 -8.399 -14.791 961 H GLY 124 H GLY 124 10.260 -5.632 -13.142 962 HA2 GLY 124 HA3 GLY 124 8.987 -8.132 -13.804 963 HA3 GLY 124 HA2 GLY 124 8.287 -7.347 -12.396 964 H ASP 125 H ASP 125 6.458 -6.369 -12.937 965 HA ASP 125 HA ASP 125 6.462 -4.511 -15.181 966 HB2 ASP 125 HB3 ASP 125 5.544 -6.949 -15.741 967 HB3 ASP 125 HB2 ASP 125 4.084 -6.296 -15.005 968 H THR 126 H THR 126 6.377 -4.284 -12.264 969 HA THR 126 HA THR 126 4.030 -2.572 -12.100 970 HB THR 126 HB THR 126 4.453 -4.251 -9.696 971 HG1 THR 126 HG1 THR 126 4.516 -5.864 -11.219 972 HG21 THR 126 HG21 THR 126 1.778 -4.061 -10.808 973 HG22 THR 126 HG22 THR 126 2.516 -2.489 -10.503 974 HG23 THR 126 HG23 THR 126 2.372 -3.664 -9.196 975 H LYS 127 H LYS 127 5.051 -0.700 -11.758 976 HA LYS 127 HA LYS 127 6.954 -0.563 -9.514 977 HB2 LYS 127 HB3 LYS 127 7.060 0.978 -12.114 978 HB3 LYS 127 HB2 LYS 127 8.124 1.247 -10.740 979 HG2 LYS 127 HG3 LYS 127 9.010 -1.012 -10.970 980 HG3 LYS 127 HG2 LYS 127 7.928 -1.302 -12.334 981 HD2 LYS 127 HD3 LYS 127 9.678 1.083 -12.487 982 HD3 LYS 127 HD2 LYS 127 10.460 -0.492 -12.633 983 HE2 LYS 127 HE3 LYS 127 9.891 -0.441 -14.786 984 HE3 LYS 127 HE2 LYS 127 8.230 -0.706 -14.258 985 HZ1 LYS 127 HZ1 LYS 127 8.597 1.238 -15.774 986 HZ2 LYS 127 HZ2 LYS 127 9.423 1.995 -14.506 987 HZ3 LYS 127 HZ3 LYS 127 7.789 1.595 -14.330 988 H MET 128 H MET 128 7.156 1.682 -8.614 989 HA MET 128 HA MET 128 4.593 2.637 -7.870 990 HB2 MET 128 HB3 MET 128 6.667 2.724 -6.454 991 HB3 MET 128 HB2 MET 128 7.246 4.029 -7.480 992 HG2 MET 128 HG3 MET 128 6.242 4.820 -5.382 993 HG3 MET 128 HG2 MET 128 5.420 5.437 -6.813 994 HE1 MET 128 HE1 MET 128 4.083 6.186 -4.889 995 HE2 MET 128 HE2 MET 128 3.137 5.174 -3.797 996 HE3 MET 128 HE3 MET 128 2.461 5.666 -5.349 997 H ILE 129 H ILE 129 3.973 4.978 -8.022 998 HA ILE 129 HA ILE 129 4.443 5.933 -10.762 999 HB ILE 129 HB ILE 129 2.317 7.323 -10.250 1000 HG12 ILE 129 HG13 ILE 129 0.772 6.210 -8.667 1001 HG13 ILE 129 HG12 ILE 129 2.070 5.129 -8.178 1002 HG21 ILE 129 HG21 ILE 129 1.405 5.893 -11.680 1003 HG22 ILE 129 HG22 ILE 129 1.287 4.650 -10.434 1004 HG23 ILE 129 HG23 ILE 129 2.761 4.802 -11.393 1005 HD11 ILE 129 HD11 ILE 129 1.446 7.325 -6.835 1006 HD12 ILE 129 HD12 ILE 129 2.584 8.031 -7.982 1007 HD13 ILE 129 HD13 ILE 129 3.096 6.710 -6.932 1008 HA PRO 130 HA PRO 130 6.543 9.598 -9.528 1009 HB2 PRO 130 HB3 PRO 130 4.604 11.121 -11.192 1010 HB3 PRO 130 HB2 PRO 130 6.369 11.096 -11.258 1011 HG2 PRO 130 HG3 PRO 130 4.926 9.830 -13.101 1012 HG3 PRO 130 HG2 PRO 130 6.427 9.122 -12.477 1013 HD2 PRO 130 HD3 PRO 130 3.592 8.421 -11.845 1014 HD3 PRO 130 HD2 PRO 130 5.004 7.360 -12.026 1015 H LEU 131 H LEU 131 6.429 11.283 -8.081 1016 HA LEU 131 HA LEU 131 3.815 12.207 -7.158 1017 HB2 LEU 131 HB3 LEU 131 5.750 11.527 -5.016 1018 HB3 LEU 131 HB2 LEU 131 3.999 11.513 -4.988 1019 HG LEU 131 HG LEU 131 5.353 9.426 -6.618 1020 HD11 LEU 131 HD11 LEU 131 6.579 9.652 -4.393 1021 HD12 LEU 131 HD12 LEU 131 5.931 8.065 -4.807 1022 HD13 LEU 131 HD13 LEU 131 5.081 9.090 -3.651 1023 HD21 LEU 131 HD21 LEU 131 3.477 8.096 -5.568 1024 HD22 LEU 131 HD22 LEU 131 2.988 9.406 -6.643 1025 HD23 LEU 131 HD23 LEU 131 2.896 9.618 -4.895 1026 H ASN 132 H ASN 132 3.900 14.177 -5.942 1027 HA ASN 132 HA ASN 132 6.054 15.906 -6.743 1028 HB2 ASN 132 HB3 ASN 132 3.408 16.315 -6.145 1029 HB3 ASN 132 HB2 ASN 132 4.196 16.913 -4.689 1030 HD21 ASN 132 HD21 ASN 132 6.444 18.055 -5.568 1031 HD22 ASN 132 HD22 ASN 132 6.096 19.362 -6.643 1032 H TRP 133 H TRP 133 7.726 14.645 -5.670 1033 HA TRP 133 HA TRP 133 7.915 14.161 -2.961 1034 HB2 TRP 133 HB3 TRP 133 10.108 14.736 -4.954 1035 HB3 TRP 133 HB2 TRP 133 10.382 14.095 -3.335 1036 HD1 TRP 133 HD1 TRP 133 8.896 13.109 -6.727 1037 HE1 TRP 133 HE1 TRP 133 8.672 10.544 -6.814 1038 HE3 TRP 133 HE3 TRP 133 10.169 12.019 -1.897 1039 HZ2 TRP 133 HZ2 TRP 133 9.004 8.351 -5.069 1040 HZ3 TRP 133 HZ3 TRP 133 10.192 9.663 -1.186 1041 HH2 TRP 133 HH2 TRP 133 9.621 7.869 -2.740 1042 H ASP 134 H ASP 134 8.938 17.131 -4.699 1043 HA ASP 134 HA ASP 134 10.193 18.392 -2.577 1044 HB2 ASP 134 HB3 ASP 134 8.482 19.779 -4.645 1045 HB3 ASP 134 HB2 ASP 134 9.856 20.449 -3.769 1046 H ASP 135 H ASP 135 6.760 18.331 -3.435 1047 HA ASP 135 HA ASP 135 5.961 20.107 -1.357 1048 HB2 ASP 135 HB3 ASP 135 4.754 19.275 -3.596 1049 HB3 ASP 135 HB2 ASP 135 4.006 18.159 -2.458 1050 H PHE 136 H PHE 136 7.158 17.039 -1.115 1051 HA PHE 136 HA PHE 136 5.641 16.552 1.361 1052 HB2 PHE 136 HB3 PHE 136 6.672 14.547 -0.651 1053 HB3 PHE 136 HB2 PHE 136 6.131 14.103 0.965 1054 HD1 PHE 136 HD1 PHE 136 3.729 15.148 1.568 1055 HD2 PHE 136 HD2 PHE 136 5.163 14.299 -2.347 1056 HE1 PHE 136 HE1 PHE 136 1.411 15.008 0.754 1057 HE2 PHE 136 HE2 PHE 136 2.848 14.159 -3.169 1058 HZ PHE 136 HZ PHE 136 0.968 14.513 -1.618 1059 H THR 137 H THR 137 6.787 16.282 3.160 1060 HA THR 137 HA THR 137 9.726 16.191 2.910 1061 HB THR 137 HB THR 137 7.964 17.435 5.023 1062 HG1 THR 137 HG1 THR 137 9.765 18.440 3.095 1063 HG21 THR 137 HG21 THR 137 10.968 17.274 5.022 1064 HG22 THR 137 HG22 THR 137 9.887 16.441 6.140 1065 HG23 THR 137 HG23 THR 137 9.972 18.203 6.143 1066 H LYS 138 H LYS 138 10.913 14.762 4.095 1067 HA LYS 138 HA LYS 138 9.590 12.397 4.969 1068 HB2 LYS 138 HB3 LYS 138 12.132 13.008 4.091 1069 HB3 LYS 138 HB2 LYS 138 12.382 12.683 5.801 1070 HG2 LYS 138 HG3 LYS 138 10.694 10.649 4.825 1071 HG3 LYS 138 HG2 LYS 138 11.997 10.844 3.655 1072 HD2 LYS 138 HD3 LYS 138 12.327 10.401 6.620 1073 HD3 LYS 138 HD2 LYS 138 12.582 9.197 5.356 1074 HE2 LYS 138 HE3 LYS 138 14.142 11.744 5.775 1075 HE3 LYS 138 HE2 LYS 138 14.711 10.099 6.058 1076 HZ1 LYS 138 HZ1 LYS 138 14.446 11.565 3.570 1077 HZ2 LYS 138 HZ2 LYS 138 13.964 9.945 3.505 1078 HZ3 LYS 138 HZ3 LYS 138 15.533 10.341 3.996 1079 H VAL 139 H VAL 139 8.441 12.443 6.791 1080 HA VAL 139 HA VAL 139 9.255 14.059 9.040 1081 HB VAL 139 HB VAL 139 7.239 13.198 10.151 1082 HG11 VAL 139 HG11 VAL 139 6.460 13.962 7.360 1083 HG12 VAL 139 HG12 VAL 139 7.268 15.106 8.432 1084 HG13 VAL 139 HG13 VAL 139 5.709 14.419 8.888 1085 HG21 VAL 139 HG21 VAL 139 7.263 11.332 7.842 1086 HG22 VAL 139 HG22 VAL 139 5.698 11.888 8.434 1087 HG23 VAL 139 HG23 VAL 139 6.807 11.051 9.521 1088 H SER 140 H SER 140 9.474 10.712 8.060 1089 HA SER 140 HA SER 140 11.098 10.198 10.430 1090 HB2 SER 140 HB3 SER 140 8.415 9.185 10.112 1091 HB3 SER 140 HB2 SER 140 9.569 7.852 10.168 1092 HG SER 140 HG SER 140 9.531 9.975 12.046 1093 H SER 141 H SER 141 12.508 8.412 10.245 1094 HA SER 141 HA SER 141 12.595 6.894 7.790 1095 HB2 SER 141 HB3 SER 141 15.182 7.773 7.747 1096 HB3 SER 141 HB2 SER 141 13.895 8.416 6.728 1097 HG SER 141 HG SER 141 15.292 9.651 8.653 1098 H ARG 142 H ARG 142 13.409 4.926 8.169 1099 HA ARG 142 HA ARG 142 15.360 4.523 10.292 1100 HB2 ARG 142 HB3 ARG 142 13.206 4.281 11.434 1101 HB3 ARG 142 HB2 ARG 142 12.696 3.093 10.242 1102 HG2 ARG 142 HG3 ARG 142 14.269 1.505 11.012 1103 HG3 ARG 142 HG2 ARG 142 15.109 2.709 11.991 1104 HD2 ARG 142 HD3 ARG 142 13.862 2.012 13.700 1105 HD3 ARG 142 HD2 ARG 142 12.501 2.808 12.913 1106 HE ARG 142 HE ARG 142 13.024 -0.033 13.055 1107 HH11 ARG 142 HH11 ARG 142 11.247 2.516 11.460 1108 HH12 ARG 142 HH12 ARG 142 10.007 1.456 10.881 1109 HH21 ARG 142 HH21 ARG 142 11.394 -1.424 12.292 1110 HH22 ARG 142 HH22 ARG 142 10.089 -0.779 11.353 1111 H THR 143 H THR 143 16.884 3.176 9.601 1112 HA THR 143 HA THR 143 16.331 1.521 7.250 1113 HB THR 143 HB THR 143 19.076 1.743 8.370 1114 HG1 THR 143 HG1 THR 143 17.605 3.893 7.314 1115 HG21 THR 143 HG21 THR 143 19.789 1.454 6.243 1116 HG22 THR 143 HG22 THR 143 18.414 2.310 5.545 1117 HG23 THR 143 HG23 THR 143 18.224 0.652 6.117 1118 H VAL 144 H VAL 144 15.832 -0.533 7.557 1119 HA VAL 144 HA VAL 144 16.868 -1.907 9.948 1120 HB VAL 144 HB VAL 144 14.502 -2.720 8.253 1121 HG11 VAL 144 HG11 VAL 144 14.964 -4.663 9.306 1122 HG12 VAL 144 HG12 VAL 144 14.122 -3.884 10.647 1123 HG13 VAL 144 HG13 VAL 144 15.885 -3.875 10.587 1124 HG21 VAL 144 HG21 VAL 144 14.024 -1.749 10.982 1125 HG22 VAL 144 HG22 VAL 144 13.114 -1.465 9.498 1126 HG23 VAL 144 HG23 VAL 144 14.560 -0.516 9.841 1127 H GLU 145 H GLU 145 18.188 -3.616 9.715 1128 HA GLU 145 HA GLU 145 18.498 -4.757 7.018 1129 HB2 GLU 145 HB3 GLU 145 20.935 -5.170 7.803 1130 HB3 GLU 145 HB2 GLU 145 20.478 -3.567 7.242 1131 HG2 GLU 145 HG3 GLU 145 20.510 -2.669 9.369 1132 HG3 GLU 145 HG2 GLU 145 20.341 -4.243 10.145 1133 H ASP 146 H ASP 146 18.863 -6.945 6.855 1134 HA ASP 146 HA ASP 146 18.368 -8.485 9.315 1135 HB2 ASP 146 HB3 ASP 146 17.410 -8.751 6.519 1136 HB3 ASP 146 HB2 ASP 146 17.776 -10.252 7.364 1137 H THR 147 H THR 147 19.077 -10.980 8.592 1138 HA THR 147 HA THR 147 21.860 -10.997 8.871 1139 HB THR 147 HB THR 147 21.432 -13.480 7.942 1140 HG1 THR 147 HG1 THR 147 19.409 -13.898 7.683 1141 HG21 THR 147 HG21 THR 147 22.128 -13.307 10.150 1142 HG22 THR 147 HG22 THR 147 20.538 -14.062 10.264 1143 HG23 THR 147 HG23 THR 147 20.727 -12.344 10.617 1144 H ASN 148 H ASN 148 19.823 -11.458 6.015 1145 HA ASN 148 HA ASN 148 22.115 -11.784 4.282 1146 HB2 ASN 148 HB3 ASN 148 19.237 -12.182 4.088 1147 HB3 ASN 148 HB2 ASN 148 19.886 -11.375 2.663 1148 HD21 ASN 148 HD21 ASN 148 18.929 -14.212 3.495 1149 HD22 ASN 148 HD22 ASN 148 20.112 -15.237 2.763 1150 HA PRO 149 HA PRO 149 22.751 -7.475 3.472 1151 HB2 PRO 149 HB3 PRO 149 23.820 -7.689 0.951 1152 HB3 PRO 149 HB2 PRO 149 24.728 -7.969 2.440 1153 HG2 PRO 149 HG3 PRO 149 23.456 -9.950 0.594 1154 HG3 PRO 149 HG2 PRO 149 25.032 -10.024 1.405 1155 HD2 PRO 149 HD3 PRO 149 22.909 -11.394 2.319 1156 HD3 PRO 149 HD2 PRO 149 24.103 -10.680 3.423 1157 H ALA 150 H ALA 150 21.035 -9.519 1.191 1158 HA ALA 150 HA ALA 150 19.930 -7.294 -0.276 1159 HB1 ALA 150 HB1 ALA 150 20.272 -10.021 -0.767 1160 HB2 ALA 150 HB2 ALA 150 19.512 -8.831 -1.823 1161 HB3 ALA 150 HB3 ALA 150 18.527 -9.772 -0.703 1162 H LEU 151 H LEU 151 19.165 -8.924 2.613 1163 HA LEU 151 HA LEU 151 16.319 -8.404 2.471 1164 HB2 LEU 151 HB3 LEU 151 18.078 -9.524 4.646 1165 HB3 LEU 151 HB2 LEU 151 16.351 -9.279 4.831 1166 HG LEU 151 HG LEU 151 17.745 -11.194 2.968 1167 HD11 LEU 151 HD11 LEU 151 15.554 -12.011 4.764 1168 HD12 LEU 151 HD12 LEU 151 17.069 -11.550 5.540 1169 HD13 LEU 151 HD13 LEU 151 17.051 -12.843 4.341 1170 HD21 LEU 151 HD21 LEU 151 15.947 -10.200 1.713 1171 HD22 LEU 151 HD22 LEU 151 14.833 -10.421 3.063 1172 HD23 LEU 151 HD23 LEU 151 15.473 -11.825 2.209 1173 H THR 152 H THR 152 18.738 -6.347 2.781 1174 HA THR 152 HA THR 152 17.981 -4.931 5.164 1175 HB THR 152 HB THR 152 19.618 -3.782 2.916 1176 HG1 THR 152 HG1 THR 152 20.426 -5.650 4.883 1177 HG21 THR 152 HG21 THR 152 20.889 -3.136 5.198 1178 HG22 THR 152 HG22 THR 152 19.217 -3.169 5.757 1179 HG23 THR 152 HG23 THR 152 19.679 -2.121 4.415 1180 H HIS 153 H HIS 153 16.295 -3.621 5.350 1181 HA HIS 153 HA HIS 153 15.243 -2.336 2.913 1182 HB2 HIS 153 HB3 HIS 153 13.462 -2.787 5.262 1183 HB3 HIS 153 HB2 HIS 153 13.068 -2.742 3.548 1184 HD1 HIS 153 HD1 HIS 153 12.680 -5.019 6.005 1185 HD2 HIS 153 HD2 HIS 153 14.834 -5.219 2.458 1186 HE1 HIS 153 HE1 HIS 153 12.917 -7.471 5.500 1187 HE2 HIS 153 HE2 HIS 153 14.287 -7.569 3.388 1188 H THR 154 H THR 154 14.024 -0.310 3.333 1189 HA THR 154 HA THR 154 14.992 1.138 5.697 1190 HB THR 154 HB THR 154 15.008 2.294 2.904 1191 HG1 THR 154 HG1 THR 154 16.818 1.274 2.715 1192 HG21 THR 154 HG21 THR 154 14.770 3.906 4.798 1193 HG22 THR 154 HG22 THR 154 16.206 4.129 3.798 1194 HG23 THR 154 HG23 THR 154 16.343 3.354 5.377 1195 H TYR 155 H TYR 155 13.307 1.894 6.772 1196 HA TYR 155 HA TYR 155 10.769 2.315 5.399 1197 HB2 TYR 155 HB3 TYR 155 11.620 1.898 8.219 1198 HB3 TYR 155 HB2 TYR 155 10.175 2.869 7.956 1199 HD1 TYR 155 HD1 TYR 155 8.457 1.777 6.228 1200 HD2 TYR 155 HD2 TYR 155 11.349 -0.373 8.489 1201 HE1 TYR 155 HE1 TYR 155 7.122 -0.273 5.975 1202 HE2 TYR 155 HE2 TYR 155 10.024 -2.429 8.241 1203 HH TYR 155 HH TYR 155 8.334 -3.373 6.824 1204 H GLU 156 H GLU 156 9.970 4.272 4.914 1205 HA GLU 156 HA GLU 156 11.125 6.624 6.242 1206 HB2 GLU 156 HB3 GLU 156 10.737 6.282 3.266 1207 HB3 GLU 156 HB2 GLU 156 11.140 7.803 4.048 1208 HG2 GLU 156 HG3 GLU 156 13.271 7.064 4.651 1209 HG3 GLU 156 HG2 GLU 156 12.857 5.372 4.378 1210 H VAL 157 H VAL 157 9.752 8.296 6.617 1211 HA VAL 157 HA VAL 157 6.940 7.895 5.838 1212 HB VAL 157 HB VAL 157 7.835 9.482 8.238 1213 HG11 VAL 157 HG11 VAL 157 5.521 9.146 8.958 1214 HG12 VAL 157 HG12 VAL 157 5.193 8.229 7.488 1215 HG13 VAL 157 HG13 VAL 157 5.592 9.943 7.387 1216 HG21 VAL 157 HG21 VAL 157 8.633 7.194 8.523 1217 HG22 VAL 157 HG22 VAL 157 7.021 6.577 8.160 1218 HG23 VAL 157 HG23 VAL 157 7.292 7.532 9.617 1219 H TRP 158 H TRP 158 5.755 9.680 5.203 1220 HA TRP 158 HA TRP 158 7.149 12.229 4.871 1221 HB2 TRP 158 HB3 TRP 158 5.955 10.706 2.552 1222 HB3 TRP 158 HB2 TRP 158 6.486 12.381 2.476 1223 HD1 TRP 158 HD1 TRP 158 8.038 8.914 3.305 1224 HE1 TRP 158 HE1 TRP 158 10.467 8.917 2.453 1225 HE3 TRP 158 HE3 TRP 158 8.297 13.727 1.602 1226 HZ2 TRP 158 HZ2 TRP 158 12.254 10.720 1.217 1227 HZ3 TRP 158 HZ3 TRP 158 10.401 14.512 0.597 1228 HH2 TRP 158 HH2 TRP 158 12.338 13.038 0.410 1229 H GLN 159 H GLN 159 5.875 13.976 5.020 1230 HA GLN 159 HA GLN 159 2.974 13.655 4.778 1231 HB2 GLN 159 HB3 GLN 159 4.449 14.150 7.247 1232 HB3 GLN 159 HB2 GLN 159 3.238 15.384 6.930 1233 HG2 GLN 159 HG3 GLN 159 1.568 14.025 7.467 1234 HG3 GLN 159 HG2 GLN 159 2.215 12.710 6.486 1235 HE21 GLN 159 HE21 GLN 159 3.388 11.114 7.439 1236 HE22 GLN 159 HE22 GLN 159 3.618 10.981 9.146 1237 H LYS 160 H LYS 160 2.029 15.316 3.742 1238 HA LYS 160 HA LYS 160 3.533 17.275 2.445 1239 HB2 LYS 160 HB3 LYS 160 1.017 16.356 2.172 1240 HB3 LYS 160 HB2 LYS 160 0.681 17.881 2.980 1241 HG2 LYS 160 HG3 LYS 160 2.201 18.918 1.177 1242 HG3 LYS 160 HG2 LYS 160 1.943 17.402 0.312 1243 HD2 LYS 160 HD3 LYS 160 -0.367 17.767 0.135 1244 HD3 LYS 160 HD2 LYS 160 -0.353 19.011 1.386 1245 HE2 LYS 160 HE3 LYS 160 0.299 20.632 -0.047 1246 HE3 LYS 160 HE2 LYS 160 1.332 19.544 -0.973 1247 HZ1 LYS 160 HZ1 LYS 160 -1.068 18.598 -1.608 1248 HZ2 LYS 160 HZ2 LYS 160 -0.282 19.802 -2.498 1249 HZ3 LYS 160 HZ3 LYS 160 -1.463 20.225 -1.364 1250 H LYS 161 H LYS 161 4.143 19.304 2.930 1251 HA LYS 161 HA LYS 161 4.050 20.167 5.644 1252 HB2 LYS 161 HB3 LYS 161 4.884 21.760 3.216 1253 HB3 LYS 161 HB2 LYS 161 5.307 22.093 4.890 1254 HG2 LYS 161 HG3 LYS 161 6.575 19.996 4.975 1255 HG3 LYS 161 HG2 LYS 161 6.172 19.697 3.283 1256 HD2 LYS 161 HD3 LYS 161 8.167 20.707 2.935 1257 HD3 LYS 161 HD2 LYS 161 7.192 22.172 3.072 1258 HE2 LYS 161 HE3 LYS 161 8.623 22.783 4.675 1259 HE3 LYS 161 HE2 LYS 161 7.800 21.599 5.689 1260 HZ1 LYS 161 HZ1 LYS 161 9.701 20.503 5.839 1261 HZ2 LYS 161 HZ2 LYS 161 10.466 21.590 4.793 1262 HZ3 LYS 161 HZ3 LYS 161 9.686 20.225 4.169 1263 H ALA 162 H ALA 162 2.968 21.903 6.560 1264 HA ALA 162 HA ALA 162 1.218 23.308 6.940 1265 HB1 ALA 162 HB1 ALA 162 1.864 24.944 5.517 1266 HB2 ALA 162 HB2 ALA 162 0.406 24.450 4.656 1267 HB3 ALA 162 HB3 ALA 162 1.982 23.851 4.138 1268 H51A NDP 170 H51A NDP 170 -5.818 -0.090 -10.180 1269 H52A NDP 170 H52A NDP 170 -5.998 -1.656 -9.382 1270 H4B NDP 170 H4B NDP 170 -7.709 -2.252 -11.180 1271 H3B NDP 170 H3B NDP 170 -7.285 0.631 -11.986 1272 HO3A NDP 170 HO3A NDP 170 -6.460 -1.065 -13.321 1273 H2B NDP 170 H2B NDP 170 -9.638 0.750 -12.430 1274 H1B NDP 170 H1B NDP 170 -10.434 -0.530 -10.119 1275 H8A NDP 170 H8A NDP 170 -7.368 1.570 -9.436 1276 H61A NDP 170 H61A NDP 170 -11.352 6.201 -8.342 1277 H62A NDP 170 H62A NDP 170 -9.686 5.684 -8.221 1278 H2A NDP 170 H2A NDP 170 -13.666 2.750 -10.040 1279 H51N NDP 170 H51N NDP 170 -0.671 -3.120 -8.676 1280 H52N NDP 170 H52N NDP 170 -1.396 -3.944 -7.285 1281 H4D NDP 170 H4D NDP 170 0.560 -5.240 -9.235 1282 H3D NDP 170 H3D NDP 170 -0.729 -6.272 -6.698 1283 HO3N NDP 170 HO3N NDP 170 -1.318 -7.808 -8.064 1284 H2D NDP 170 H2D NDP 170 1.310 -7.477 -6.294 1285 HO2N NDP 170 HO2N NDP 170 1.627 -8.104 -8.552 1286 H1D NDP 170 H1D NDP 170 2.995 -5.380 -6.921 1287 H2N NDP 170 H2N NDP 170 3.743 -5.096 -4.668 1288 H71N NDP 170 H71N NDP 170 5.817 -4.610 -2.245 1289 H72N NDP 170 H72N NDP 170 5.207 -4.878 -3.862 1290 H41N NDP 170 H41N NDP 170 0.999 -3.558 -2.226 1291 H42N NDP 170 H42N NDP 170 0.927 -5.318 -1.864 1292 H5N NDP 170 H5N NDP 170 -0.999 -4.605 -3.274 1293 H6N NDP 170 H6N NDP 170 -0.506 -5.125 -5.671 Start of MODEL 4 1 H1 THR 1 HT1 THR 1 -4.443 7.869 5.623 2 H2 THR 1 HT2 THR 1 -6.004 8.390 5.134 3 H3 THR 1 HT3 THR 1 -4.774 9.542 5.460 4 HA THR 1 HA THR 1 -5.032 7.686 3.210 5 HB THR 1 HB THR 1 -4.297 10.598 3.184 6 HG1 THR 1 HG1 THR 1 -6.149 10.959 4.107 7 HG21 THR 1 HG21 THR 1 -4.241 9.245 1.087 8 HG22 THR 1 HG22 THR 1 -5.313 10.644 1.046 9 HG23 THR 1 HG23 THR 1 -5.982 9.027 1.259 10 H ALA 2 H ALA 2 -3.183 6.412 3.839 11 HA ALA 2 HA ALA 2 -0.648 7.757 3.187 12 HB1 ALA 2 HB1 ALA 2 -0.792 5.594 5.264 13 HB2 ALA 2 HB2 ALA 2 -0.988 7.297 5.680 14 HB3 ALA 2 HB3 ALA 2 0.514 6.736 4.945 15 H PHE 3 H PHE 3 0.933 6.439 2.185 16 HA PHE 3 HA PHE 3 -0.203 4.068 0.870 17 HB2 PHE 3 HB3 PHE 3 2.058 5.920 0.124 18 HB3 PHE 3 HB2 PHE 3 1.792 4.381 -0.685 19 HD1 PHE 3 HD1 PHE 3 -1.015 4.198 -1.092 20 HD2 PHE 3 HD2 PHE 3 1.478 7.632 -1.260 21 HE1 PHE 3 HE1 PHE 3 -2.606 5.272 -2.633 22 HE2 PHE 3 HE2 PHE 3 -0.100 8.715 -2.802 23 HZ PHE 3 HZ PHE 3 -2.144 7.534 -3.489 24 H LEU 4 H LEU 4 0.490 2.110 1.449 25 HA LEU 4 HA LEU 4 3.160 1.875 2.667 26 HB2 LEU 4 HB3 LEU 4 1.516 1.674 4.428 27 HB3 LEU 4 HB2 LEU 4 0.615 0.488 3.501 28 HG LEU 4 HG LEU 4 2.437 -1.117 3.729 29 HD11 LEU 4 HD11 LEU 4 4.407 0.103 3.787 30 HD12 LEU 4 HD12 LEU 4 4.244 -0.458 5.451 31 HD13 LEU 4 HD13 LEU 4 3.811 1.200 5.033 32 HD21 LEU 4 HD21 LEU 4 0.651 -0.456 5.625 33 HD22 LEU 4 HD22 LEU 4 2.150 -0.216 6.522 34 HD23 LEU 4 HD23 LEU 4 1.801 -1.782 5.790 35 H TRP 5 H TRP 5 4.413 0.756 1.312 36 HA TRP 5 HA TRP 5 3.581 -1.833 0.389 37 HB2 TRP 5 HB3 TRP 5 3.493 -1.478 -1.916 38 HB3 TRP 5 HB2 TRP 5 2.652 -0.072 -1.275 39 HD1 TRP 5 HD1 TRP 5 5.771 -1.085 -3.186 40 HE1 TRP 5 HE1 TRP 5 6.943 1.028 -4.070 41 HE3 TRP 5 HE3 TRP 5 3.028 2.465 -0.726 42 HZ2 TRP 5 HZ2 TRP 5 6.743 3.822 -3.759 43 HZ3 TRP 5 HZ3 TRP 5 3.587 4.837 -1.081 44 HH2 TRP 5 HH2 TRP 5 5.403 5.498 -2.568 45 H ALA 6 H ALA 6 5.319 -2.990 -0.735 46 HA ALA 6 HA ALA 6 7.940 -2.083 0.225 47 HB1 ALA 6 HB1 ALA 6 7.293 -4.270 1.015 48 HB2 ALA 6 HB2 ALA 6 8.634 -4.436 -0.119 49 HB3 ALA 6 HB3 ALA 6 6.991 -4.815 -0.635 50 H GLN 7 H GLN 7 9.671 -1.797 -1.146 51 HA GLN 7 HA GLN 7 9.408 -2.506 -3.953 52 HB2 GLN 7 HB3 GLN 7 9.826 -0.224 -4.741 53 HB3 GLN 7 HB2 GLN 7 8.318 -0.322 -3.841 54 HG2 GLN 7 HG3 GLN 7 10.400 0.319 -2.020 55 HG3 GLN 7 HG2 GLN 7 10.527 1.392 -3.412 56 HE21 GLN 7 HE21 GLN 7 8.134 0.083 -1.142 57 HE22 GLN 7 HE22 GLN 7 7.189 1.524 -1.043 58 H ASP 8 H ASP 8 11.397 -2.096 -5.181 59 HA ASP 8 HA ASP 8 13.743 -2.347 -3.423 60 HB2 ASP 8 HB3 ASP 8 14.579 -2.968 -6.017 61 HB3 ASP 8 HB2 ASP 8 14.231 -4.107 -4.724 62 H ARG 9 H ARG 9 15.774 -1.718 -5.173 63 HA ARG 9 HA ARG 9 15.803 1.105 -5.012 64 HB2 ARG 9 HB3 ARG 9 17.634 -0.776 -6.508 65 HB3 ARG 9 HB2 ARG 9 17.958 0.928 -6.222 66 HG2 ARG 9 HG3 ARG 9 17.596 0.225 -3.709 67 HG3 ARG 9 HG2 ARG 9 18.039 -1.364 -4.336 68 HD2 ARG 9 HD3 ARG 9 20.088 -0.486 -3.716 69 HD3 ARG 9 HD2 ARG 9 20.017 -0.104 -5.436 70 HE ARG 9 HE ARG 9 18.950 2.052 -4.011 71 HH11 ARG 9 HH11 ARG 9 22.014 0.450 -4.483 72 HH12 ARG 9 HH12 ARG 9 22.948 1.881 -4.199 73 HH21 ARG 9 HH21 ARG 9 20.176 3.935 -3.639 74 HH22 ARG 9 HH22 ARG 9 21.905 3.859 -3.719 75 H ASP 10 H ASP 10 14.437 -0.944 -7.343 76 HA ASP 10 HA ASP 10 14.685 1.055 -9.469 77 HB2 ASP 10 HB3 ASP 10 14.976 -1.603 -9.646 78 HB3 ASP 10 HB2 ASP 10 13.246 -1.495 -9.954 79 H GLY 11 H GLY 11 12.638 0.524 -6.962 80 HA2 GLY 11 HA3 GLY 11 10.630 1.683 -6.595 81 HA3 GLY 11 HA2 GLY 11 10.482 1.932 -8.328 82 H LEU 12 H LEU 12 11.183 -1.171 -8.271 83 HA LEU 12 HA LEU 12 8.770 -2.195 -9.035 84 HB2 LEU 12 HB3 LEU 12 11.190 -3.205 -8.905 85 HB3 LEU 12 HB2 LEU 12 10.616 -3.865 -7.390 86 HG LEU 12 HG LEU 12 8.799 -5.022 -8.608 87 HD11 LEU 12 HD11 LEU 12 8.577 -5.003 -10.902 88 HD12 LEU 12 HD12 LEU 12 10.221 -4.420 -11.162 89 HD13 LEU 12 HD13 LEU 12 8.980 -3.321 -10.563 90 HD21 LEU 12 HD21 LEU 12 11.446 -5.695 -8.349 91 HD22 LEU 12 HD22 LEU 12 11.128 -5.994 -10.060 92 HD23 LEU 12 HD23 LEU 12 10.144 -6.787 -8.830 93 H ILE 13 H ILE 13 7.594 -4.044 -7.801 94 HA ILE 13 HA ILE 13 7.283 -3.576 -4.961 95 HB ILE 13 HB ILE 13 4.960 -3.111 -4.971 96 HG12 ILE 13 HG13 ILE 13 4.943 -3.390 -7.990 97 HG13 ILE 13 HG12 ILE 13 4.367 -4.626 -6.877 98 HG21 ILE 13 HG21 ILE 13 4.859 -0.963 -5.927 99 HG22 ILE 13 HG22 ILE 13 5.991 -1.393 -7.209 100 HG23 ILE 13 HG23 ILE 13 6.559 -1.236 -5.546 101 HD11 ILE 13 HD11 ILE 13 2.798 -2.768 -8.022 102 HD12 ILE 13 HD12 ILE 13 3.189 -1.966 -6.501 103 HD13 ILE 13 HD13 ILE 13 2.438 -3.563 -6.489 104 H GLY 14 H GLY 14 6.283 -5.283 -7.877 105 HA2 GLY 14 HA3 GLY 14 6.808 -7.842 -6.981 106 HA3 GLY 14 HA2 GLY 14 5.133 -7.524 -6.549 107 H LYS 15 H LYS 15 6.128 -9.487 -8.442 108 HA LYS 15 HA LYS 15 4.955 -8.408 -10.921 109 HB2 LYS 15 HB3 LYS 15 6.258 -10.311 -12.025 110 HB3 LYS 15 HB2 LYS 15 7.184 -8.937 -11.438 111 HG2 LYS 15 HG3 LYS 15 8.314 -10.178 -9.967 112 HG3 LYS 15 HG2 LYS 15 6.872 -11.057 -9.459 113 HD2 LYS 15 HD3 LYS 15 7.370 -11.943 -12.055 114 HD3 LYS 15 HD2 LYS 15 8.962 -11.840 -11.301 115 HE2 LYS 15 HE3 LYS 15 7.055 -13.015 -9.490 116 HE3 LYS 15 HE2 LYS 15 7.068 -13.884 -11.024 117 HZ1 LYS 15 HZ1 LYS 15 8.758 -14.943 -9.977 118 HZ2 LYS 15 HZ2 LYS 15 9.179 -13.610 -9.025 119 HZ3 LYS 15 HZ3 LYS 15 9.656 -13.675 -10.647 120 H ASP 16 H ASP 16 2.851 -8.973 -10.645 121 HA ASP 16 HA ASP 16 1.022 -10.318 -10.863 122 HB2 ASP 16 HB3 ASP 16 3.150 -11.951 -11.872 123 HB3 ASP 16 HB2 ASP 16 2.061 -12.962 -10.926 124 H GLY 17 H GLY 17 0.344 -9.871 -8.780 125 HA2 GLY 17 HA3 GLY 17 -0.660 -11.196 -6.972 126 HA3 GLY 17 HA2 GLY 17 0.889 -12.010 -6.818 127 H HIS 18 H HIS 18 2.734 -10.682 -6.139 128 HA HIS 18 HA HIS 18 2.437 -8.107 -5.043 129 HB2 HIS 18 HB3 HIS 18 2.372 -8.575 -2.674 130 HB3 HIS 18 HB2 HIS 18 1.004 -9.378 -3.433 131 HD1 HIS 18 HD1 HIS 18 3.217 -10.014 -0.860 132 HD2 HIS 18 HD2 HIS 18 2.085 -12.235 -4.184 133 HE1 HIS 18 HE1 HIS 18 3.759 -12.402 -0.289 134 HE2 HIS 18 HE2 HIS 18 3.145 -13.717 -2.348 135 H LEU 19 H LEU 19 4.280 -8.519 -2.811 136 HA LEU 19 HA LEU 19 6.713 -8.422 -4.236 137 HB2 LEU 19 HB3 LEU 19 7.751 -8.509 -1.947 138 HB3 LEU 19 HB2 LEU 19 6.604 -7.211 -2.214 139 HG LEU 19 HG LEU 19 4.999 -9.159 -1.150 140 HD11 LEU 19 HD11 LEU 19 6.584 -9.575 0.994 141 HD12 LEU 19 HD12 LEU 19 7.770 -9.662 -0.308 142 HD13 LEU 19 HD13 LEU 19 6.369 -10.734 -0.317 143 HD21 LEU 19 HD21 LEU 19 4.892 -7.775 0.769 144 HD22 LEU 19 HD22 LEU 19 5.221 -6.706 -0.595 145 HD23 LEU 19 HD23 LEU 19 6.524 -7.161 0.504 146 HA PRO 20 HA PRO 20 7.167 -12.904 -4.393 147 HB2 PRO 20 HB3 PRO 20 9.137 -12.977 -6.213 148 HB3 PRO 20 HB2 PRO 20 7.468 -12.600 -6.660 149 HG2 PRO 20 HG3 PRO 20 9.775 -10.744 -6.217 150 HG3 PRO 20 HG2 PRO 20 8.551 -10.720 -7.500 151 HD2 PRO 20 HD3 PRO 20 8.454 -9.122 -5.281 152 HD3 PRO 20 HD2 PRO 20 7.017 -9.642 -6.182 153 H TRP 21 H TRP 21 9.140 -10.643 -2.955 154 HA TRP 21 HA TRP 21 11.345 -12.501 -2.476 155 HB2 TRP 21 HB3 TRP 21 12.324 -10.505 -1.233 156 HB3 TRP 21 HB2 TRP 21 12.136 -10.329 -2.974 157 HD1 TRP 21 HD1 TRP 21 10.077 -9.426 0.196 158 HE1 TRP 21 HE1 TRP 21 8.979 -7.133 -0.207 159 HE3 TRP 21 HE3 TRP 21 11.676 -8.595 -4.584 160 HZ2 TRP 21 HZ2 TRP 21 8.808 -5.227 -2.284 161 HZ3 TRP 21 HZ3 TRP 21 10.999 -6.516 -5.710 162 HH2 TRP 21 HH2 TRP 21 9.594 -4.868 -4.583 163 H HIS 22 H HIS 22 12.129 -12.808 -0.262 164 HA HIS 22 HA HIS 22 9.902 -13.340 1.522 165 HB2 HIS 22 HB3 HIS 22 12.562 -14.417 1.100 166 HB3 HIS 22 HB2 HIS 22 12.267 -14.100 2.806 167 HD1 HIS 22 HD1 HIS 22 11.743 -16.325 3.769 168 HD2 HIS 22 HD2 HIS 22 9.740 -15.667 0.189 169 HE1 HIS 22 HE1 HIS 22 10.222 -18.306 3.476 170 HE2 HIS 22 HE2 HIS 22 9.088 -17.930 1.258 171 H LEU 23 H LEU 23 9.294 -11.329 2.311 172 HA LEU 23 HA LEU 23 11.299 -9.951 3.974 173 HB2 LEU 23 HB3 LEU 23 9.468 -8.963 2.003 174 HB3 LEU 23 HB2 LEU 23 9.060 -8.269 3.560 175 HG LEU 23 HG LEU 23 11.612 -7.737 3.694 176 HD11 LEU 23 HD11 LEU 23 11.685 -9.059 1.334 177 HD12 LEU 23 HD12 LEU 23 12.867 -7.852 1.838 178 HD13 LEU 23 HD13 LEU 23 11.533 -7.392 0.782 179 HD21 LEU 23 HD21 LEU 23 9.335 -6.344 2.574 180 HD22 LEU 23 HD22 LEU 23 10.856 -5.779 1.883 181 HD23 LEU 23 HD23 LEU 23 10.616 -5.749 3.630 182 HA PRO 24 HA PRO 24 8.337 -11.839 6.971 183 HB2 PRO 24 HB3 PRO 24 10.675 -11.485 8.742 184 HB3 PRO 24 HB2 PRO 24 9.698 -12.926 8.443 185 HG2 PRO 24 HG3 PRO 24 12.186 -12.705 7.481 186 HG3 PRO 24 HG2 PRO 24 10.904 -13.516 6.563 187 HD2 PRO 24 HD3 PRO 24 12.038 -10.767 6.214 188 HD3 PRO 24 HD2 PRO 24 11.561 -11.956 4.984 189 H ASP 25 H ASP 25 10.702 -9.278 7.748 190 HA ASP 25 HA ASP 25 9.255 -8.120 9.832 191 HB2 ASP 25 HB3 ASP 25 10.666 -6.072 9.242 192 HB3 ASP 25 HB2 ASP 25 11.529 -7.540 9.671 193 H ASP 26 H ASP 26 8.866 -7.871 6.395 194 HA ASP 26 HA ASP 26 7.415 -5.410 6.411 195 HB2 ASP 26 HB3 ASP 26 8.646 -6.542 4.438 196 HB3 ASP 26 HB2 ASP 26 7.177 -7.496 4.259 197 H LEU 27 H LEU 27 6.345 -8.769 5.811 198 HA LEU 27 HA LEU 27 3.614 -8.232 5.862 199 HB2 LEU 27 HB3 LEU 27 3.491 -10.719 6.534 200 HB3 LEU 27 HB2 LEU 27 4.145 -10.291 4.970 201 HG LEU 27 HG LEU 27 6.351 -10.362 6.705 202 HD11 LEU 27 HD11 LEU 27 5.261 -11.546 8.400 203 HD12 LEU 27 HD12 LEU 27 6.132 -12.771 7.479 204 HD13 LEU 27 HD13 LEU 27 4.395 -12.566 7.252 205 HD21 LEU 27 HD21 LEU 27 7.135 -12.042 5.263 206 HD22 LEU 27 HD22 LEU 27 6.075 -11.044 4.268 207 HD23 LEU 27 HD23 LEU 27 5.503 -12.594 4.884 208 H HIS 28 H HIS 28 5.818 -9.170 8.472 209 HA HIS 28 HA HIS 28 3.870 -9.445 10.486 210 HB2 HIS 28 HB3 HIS 28 6.606 -9.799 10.317 211 HB3 HIS 28 HB2 HIS 28 6.453 -8.445 11.431 212 HD1 HIS 28 HD1 HIS 28 5.035 -11.952 11.023 213 HD2 HIS 28 HD2 HIS 28 5.992 -9.204 13.989 214 HE1 HIS 28 HE1 HIS 28 4.641 -13.148 13.199 215 HE2 HIS 28 HE2 HIS 28 5.325 -11.499 14.977 216 H TYR 29 H TYR 29 5.749 -6.672 9.375 217 HA TYR 29 HA TYR 29 4.784 -4.898 11.401 218 HB2 TYR 29 HB3 TYR 29 6.941 -4.536 10.272 219 HB3 TYR 29 HB2 TYR 29 6.102 -4.287 8.745 220 HD1 TYR 29 HD2 TYR 29 4.384 -2.341 8.680 221 HD2 TYR 29 HD1 TYR 29 7.417 -2.719 11.639 222 HE1 TYR 29 HE2 TYR 29 4.190 0.060 9.177 223 HE2 TYR 29 HE1 TYR 29 7.230 -0.320 12.146 224 HH TYR 29 HH TYR 29 5.435 1.478 11.912 225 H PHE 30 H PHE 30 3.651 -5.933 8.294 226 HA PHE 30 HA PHE 30 1.918 -3.727 7.793 227 HB2 PHE 30 HB3 PHE 30 2.708 -5.177 5.984 228 HB3 PHE 30 HB2 PHE 30 1.863 -6.547 6.697 229 HD1 PHE 30 HD1 PHE 30 -0.616 -6.581 6.728 230 HD2 PHE 30 HD2 PHE 30 1.581 -3.599 4.633 231 HE1 PHE 30 HE1 PHE 30 -2.628 -6.018 5.429 232 HE2 PHE 30 HE2 PHE 30 -0.427 -3.029 3.330 233 HZ PHE 30 HZ PHE 30 -2.535 -4.240 3.727 234 H ARG 31 H ARG 31 1.435 -6.972 9.149 235 HA ARG 31 HA ARG 31 -1.367 -6.539 9.605 236 HB2 ARG 31 HB3 ARG 31 0.191 -8.766 9.374 237 HB3 ARG 31 HB2 ARG 31 -0.044 -8.692 11.114 238 HG2 ARG 31 HG3 ARG 31 -2.198 -9.288 10.975 239 HG3 ARG 31 HG2 ARG 31 -2.485 -8.292 9.547 240 HD2 ARG 31 HD3 ARG 31 -2.758 -10.697 9.091 241 HD3 ARG 31 HD2 ARG 31 -1.473 -9.968 8.129 242 HE ARG 31 HE ARG 31 -0.454 -11.099 10.530 243 HH11 ARG 31 HH11 ARG 31 -1.594 -11.933 7.338 244 HH12 ARG 31 HH12 ARG 31 -0.658 -13.387 7.248 245 HH21 ARG 31 HH21 ARG 31 0.777 -13.012 10.412 246 HH22 ARG 31 HH22 ARG 31 0.687 -14.000 8.993 247 H ALA 32 H ALA 32 1.537 -5.915 11.354 248 HA ALA 32 HA ALA 32 0.381 -5.903 13.968 249 HB1 ALA 32 HB1 ALA 32 2.657 -6.238 14.045 250 HB2 ALA 32 HB2 ALA 32 2.542 -4.522 14.436 251 HB3 ALA 32 HB3 ALA 32 2.986 -5.027 12.806 252 H GLN 33 H GLN 33 0.906 -3.489 11.465 253 HA GLN 33 HA GLN 33 -0.012 -1.346 13.206 254 HB2 GLN 33 HB3 GLN 33 1.540 -1.533 10.778 255 HB3 GLN 33 HB2 GLN 33 0.235 -0.372 10.583 256 HG2 GLN 33 HG3 GLN 33 1.637 -0.092 13.117 257 HG3 GLN 33 HG2 GLN 33 2.685 0.117 11.715 258 HE21 GLN 33 HE21 GLN 33 2.077 1.712 10.137 259 HE22 GLN 33 HE22 GLN 33 1.165 3.097 10.621 260 H THR 34 H THR 34 -1.239 -3.421 10.713 261 HA THR 34 HA THR 34 -3.592 -1.758 10.287 262 HB THR 34 HB THR 34 -4.199 -3.376 8.578 263 HG1 THR 34 HG1 THR 34 -2.566 -5.103 8.220 264 HG21 THR 34 HG21 THR 34 -1.730 -3.469 7.455 265 HG22 THR 34 HG22 THR 34 -1.559 -2.123 8.582 266 HG23 THR 34 HG23 THR 34 -2.833 -2.096 7.363 267 H VAL 35 H VAL 35 -3.198 -2.886 12.922 268 HA VAL 35 HA VAL 35 -5.118 -5.057 13.124 269 HB VAL 35 HB VAL 35 -3.760 -3.589 15.384 270 HG11 VAL 35 HG11 VAL 35 -5.541 -5.923 15.166 271 HG12 VAL 35 HG12 VAL 35 -5.290 -4.806 16.507 272 HG13 VAL 35 HG13 VAL 35 -4.150 -6.123 16.231 273 HG21 VAL 35 HG21 VAL 35 -2.203 -4.629 13.657 274 HG22 VAL 35 HG22 VAL 35 -2.836 -6.187 14.188 275 HG23 VAL 35 HG23 VAL 35 -1.993 -5.141 15.331 276 H GLY 36 H GLY 36 -7.160 -4.369 12.764 277 HA2 GLY 36 HA3 GLY 36 -9.199 -3.502 13.444 278 HA3 GLY 36 HA2 GLY 36 -8.375 -2.688 14.765 279 H LYS 37 H LYS 37 -7.286 -2.290 11.482 280 HA LYS 37 HA LYS 37 -8.339 0.464 11.527 281 HB2 LYS 37 HB3 LYS 37 -5.714 -0.670 10.727 282 HB3 LYS 37 HB2 LYS 37 -6.334 0.654 9.752 283 HG2 LYS 37 HG3 LYS 37 -6.663 1.377 12.466 284 HG3 LYS 37 HG2 LYS 37 -5.024 0.751 12.272 285 HD2 LYS 37 HD3 LYS 37 -5.918 2.573 10.146 286 HD3 LYS 37 HD2 LYS 37 -5.769 3.309 11.743 287 HE2 LYS 37 HE3 LYS 37 -3.585 1.607 10.586 288 HE3 LYS 37 HE2 LYS 37 -3.713 3.324 10.206 289 HZ1 LYS 37 HZ1 LYS 37 -3.814 2.572 13.024 290 HZ2 LYS 37 HZ2 LYS 37 -3.113 3.925 12.290 291 HZ3 LYS 37 HZ3 LYS 37 -2.317 2.433 12.247 292 H ILE 38 H ILE 38 -8.056 1.298 9.024 293 HA ILE 38 HA ILE 38 -9.606 -0.632 7.422 294 HB ILE 38 HB ILE 38 -10.012 1.968 6.363 295 HG12 ILE 38 HG13 ILE 38 -10.897 1.917 9.239 296 HG13 ILE 38 HG12 ILE 38 -9.350 2.620 8.781 297 HG21 ILE 38 HG21 ILE 38 -11.993 0.397 7.979 298 HG22 ILE 38 HG22 ILE 38 -11.472 -0.109 6.372 299 HG23 ILE 38 HG23 ILE 38 -12.287 1.440 6.588 300 HD11 ILE 38 HD11 ILE 38 -10.898 3.899 7.043 301 HD12 ILE 38 HD12 ILE 38 -10.617 4.484 8.683 302 HD13 ILE 38 HD13 ILE 38 -12.093 3.596 8.304 303 H MET 39 H MET 39 -8.396 -1.456 5.873 304 HA MET 39 HA MET 39 -6.364 0.247 4.598 305 HB2 MET 39 HB3 MET 39 -5.291 -1.626 5.547 306 HB3 MET 39 HB2 MET 39 -6.552 -2.727 5.014 307 HG2 MET 39 HG3 MET 39 -4.966 -1.278 2.959 308 HG3 MET 39 HG2 MET 39 -4.217 -2.621 3.819 309 HE1 MET 39 HE1 MET 39 -6.191 -5.644 3.027 310 HE2 MET 39 HE2 MET 39 -7.350 -4.633 3.892 311 HE3 MET 39 HE3 MET 39 -5.655 -4.648 4.380 312 H VAL 40 H VAL 40 -6.576 0.795 2.529 313 HA VAL 40 HA VAL 40 -8.829 -0.289 1.016 314 HB VAL 40 HB VAL 40 -6.995 1.956 0.178 315 HG11 VAL 40 HG11 VAL 40 -9.847 1.804 -0.603 316 HG12 VAL 40 HG12 VAL 40 -8.746 0.640 -1.339 317 HG13 VAL 40 HG13 VAL 40 -8.448 2.369 -1.516 318 HG21 VAL 40 HG21 VAL 40 -9.621 2.230 1.634 319 HG22 VAL 40 HG22 VAL 40 -8.533 3.526 1.138 320 HG23 VAL 40 HG23 VAL 40 -8.041 2.397 2.400 321 H VAL 41 H VAL 41 -8.621 -1.452 -0.850 322 HA VAL 41 HA VAL 41 -5.907 -1.924 -1.863 323 HB VAL 41 HB VAL 41 -7.134 -3.752 -0.275 324 HG11 VAL 41 HG11 VAL 41 -7.706 -4.676 -3.085 325 HG12 VAL 41 HG12 VAL 41 -8.922 -4.123 -1.934 326 HG13 VAL 41 HG13 VAL 41 -7.984 -5.577 -1.595 327 HG21 VAL 41 HG21 VAL 41 -5.597 -5.339 -1.917 328 HG22 VAL 41 HG22 VAL 41 -5.021 -4.394 -0.545 329 HG23 VAL 41 HG23 VAL 41 -4.938 -3.723 -2.174 330 H GLY 42 H GLY 42 -5.766 -2.592 -4.052 331 HA2 GLY 42 HA3 GLY 42 -7.857 -1.503 -5.710 332 HA3 GLY 42 HA2 GLY 42 -6.332 -2.179 -6.263 333 H ARG 43 H ARG 43 -8.547 -2.742 -7.717 334 HA ARG 43 HA ARG 43 -10.072 -4.938 -6.999 335 HB2 ARG 43 HB3 ARG 43 -9.976 -5.340 -9.613 336 HB3 ARG 43 HB2 ARG 43 -10.873 -4.001 -8.918 337 HG2 ARG 43 HG3 ARG 43 -9.503 -2.456 -9.801 338 HG3 ARG 43 HG2 ARG 43 -8.057 -3.434 -9.553 339 HD2 ARG 43 HD3 ARG 43 -8.442 -3.165 -11.916 340 HD3 ARG 43 HD2 ARG 43 -8.735 -4.845 -11.468 341 HE ARG 43 HE ARG 43 -11.124 -3.308 -11.385 342 HH11 ARG 43 HH11 ARG 43 -8.930 -4.919 -13.570 343 HH12 ARG 43 HH12 ARG 43 -10.136 -5.189 -14.783 344 HH21 ARG 43 HH21 ARG 43 -12.714 -3.667 -12.979 345 HH22 ARG 43 HH22 ARG 43 -12.284 -4.478 -14.447 346 H ARG 44 H ARG 44 -7.193 -5.024 -9.117 347 HA ARG 44 HA ARG 44 -6.949 -7.815 -9.124 348 HB2 ARG 44 HB3 ARG 44 -4.826 -5.700 -9.521 349 HB3 ARG 44 HB2 ARG 44 -4.625 -7.405 -9.899 350 HG2 ARG 44 HG3 ARG 44 -6.697 -5.617 -11.152 351 HG3 ARG 44 HG2 ARG 44 -5.129 -5.996 -11.868 352 HD2 ARG 44 HD3 ARG 44 -6.214 -7.692 -12.853 353 HD3 ARG 44 HD2 ARG 44 -6.083 -8.480 -11.282 354 HE ARG 44 HE ARG 44 -8.391 -6.929 -11.246 355 HH11 ARG 44 HH11 ARG 44 -7.149 -9.709 -12.952 356 HH12 ARG 44 HH12 ARG 44 -8.714 -10.400 -13.219 357 HH21 ARG 44 HH21 ARG 44 -10.450 -7.838 -11.596 358 HH22 ARG 44 HH22 ARG 44 -10.588 -9.338 -12.450 359 H THR 45 H THR 45 -6.177 -5.489 -6.728 360 HA THR 45 HA THR 45 -4.154 -6.981 -5.380 361 HB THR 45 HB THR 45 -5.760 -5.036 -3.838 362 HG1 THR 45 HG1 THR 45 -4.428 -4.374 -6.232 363 HG21 THR 45 HG21 THR 45 -2.853 -5.555 -4.303 364 HG22 THR 45 HG22 THR 45 -3.767 -5.611 -2.796 365 HG23 THR 45 HG23 THR 45 -3.414 -4.059 -3.556 366 H TYR 46 H TYR 46 -7.587 -6.317 -4.551 367 HA TYR 46 HA TYR 46 -7.759 -7.879 -2.292 368 HB2 TYR 46 HB3 TYR 46 -10.127 -7.930 -2.581 369 HB3 TYR 46 HB2 TYR 46 -9.576 -6.395 -3.236 370 HD1 TYR 46 HD2 TYR 46 -10.226 -9.889 -4.429 371 HD2 TYR 46 HD1 TYR 46 -10.513 -5.718 -5.237 372 HE1 TYR 46 HE2 TYR 46 -11.357 -10.384 -6.541 373 HE2 TYR 46 HE1 TYR 46 -11.664 -6.210 -7.351 374 HH TYR 46 HH TYR 46 -13.020 -8.068 -8.326 375 H GLU 47 H GLU 47 -7.905 -8.886 -5.654 376 HA GLU 47 HA GLU 47 -8.441 -11.651 -4.985 377 HB2 GLU 47 HB3 GLU 47 -7.642 -11.760 -7.569 378 HB3 GLU 47 HB2 GLU 47 -9.292 -11.423 -7.069 379 HG2 GLU 47 HG3 GLU 47 -9.037 -9.117 -7.447 380 HG3 GLU 47 HG2 GLU 47 -7.282 -9.245 -7.537 381 H SER 48 H SER 48 -5.730 -9.631 -5.506 382 HA SER 48 HA SER 48 -3.905 -11.931 -5.615 383 HB2 SER 48 HB3 SER 48 -3.378 -9.007 -6.192 384 HB3 SER 48 HB2 SER 48 -2.185 -10.298 -6.312 385 HG SER 48 HG SER 48 -4.242 -9.624 -8.019 386 H PHE 49 H PHE 49 -5.301 -10.884 -3.179 387 HA PHE 49 HA PHE 49 -3.024 -9.920 -1.615 388 HB2 PHE 49 HB3 PHE 49 -5.644 -9.135 -1.603 389 HB3 PHE 49 HB2 PHE 49 -5.597 -10.239 -0.232 390 HD1 PHE 49 HD1 PHE 49 -3.581 -7.445 -1.674 391 HD2 PHE 49 HD2 PHE 49 -5.089 -9.354 1.818 392 HE1 PHE 49 HE1 PHE 49 -2.596 -5.671 -0.283 393 HE2 PHE 49 HE2 PHE 49 -4.106 -7.584 3.214 394 HZ PHE 49 HZ PHE 49 -2.858 -5.739 2.165 395 HA PRO 50 HA PRO 50 -2.338 -14.028 -0.036 396 HB2 PRO 50 HB3 PRO 50 -0.944 -12.719 2.199 397 HB3 PRO 50 HB2 PRO 50 -0.313 -13.824 0.976 398 HG2 PRO 50 HG3 PRO 50 0.315 -11.212 0.984 399 HG3 PRO 50 HG2 PRO 50 0.127 -12.129 -0.523 400 HD2 PRO 50 HD3 PRO 50 -1.783 -10.236 0.798 401 HD3 PRO 50 HD2 PRO 50 -1.384 -10.421 -0.924 402 H LYS 51 H LYS 51 -3.569 -11.428 1.993 403 HA LYS 51 HA LYS 51 -5.000 -13.449 3.585 404 HB2 LYS 51 HB3 LYS 51 -3.050 -11.629 4.520 405 HB3 LYS 51 HB2 LYS 51 -4.600 -11.044 5.108 406 HG2 LYS 51 HG3 LYS 51 -3.750 -13.902 5.439 407 HG3 LYS 51 HG2 LYS 51 -3.311 -12.646 6.598 408 HD2 LYS 51 HD3 LYS 51 -5.259 -13.106 7.596 409 HD3 LYS 51 HD2 LYS 51 -6.013 -12.250 6.250 410 HE2 LYS 51 HE3 LYS 51 -5.760 -14.640 5.110 411 HE3 LYS 51 HE2 LYS 51 -5.823 -15.161 6.793 412 HZ1 LYS 51 HZ1 LYS 51 -8.027 -15.158 6.012 413 HZ2 LYS 51 HZ2 LYS 51 -7.869 -13.639 5.286 414 HZ3 LYS 51 HZ3 LYS 51 -7.893 -13.771 6.972 415 H ARG 52 H ARG 52 -6.732 -13.098 2.066 416 HA ARG 52 HA ARG 52 -8.195 -10.598 2.591 417 HB2 ARG 52 HB3 ARG 52 -9.267 -11.024 0.321 418 HB3 ARG 52 HB2 ARG 52 -7.593 -10.486 0.319 419 HG2 ARG 52 HG3 ARG 52 -6.977 -12.273 -0.830 420 HG3 ARG 52 HG2 ARG 52 -7.657 -13.340 0.399 421 HD2 ARG 52 HD3 ARG 52 -9.892 -12.438 -0.907 422 HD3 ARG 52 HD2 ARG 52 -8.715 -12.572 -2.213 423 HE ARG 52 HE ARG 52 -8.408 -14.925 -1.017 424 HH11 ARG 52 HH11 ARG 52 -11.321 -13.221 -1.914 425 HH12 ARG 52 HH12 ARG 52 -12.243 -14.668 -2.143 426 HH21 ARG 52 HH21 ARG 52 -9.621 -16.824 -1.320 427 HH22 ARG 52 HH22 ARG 52 -11.279 -16.712 -1.807 428 HA PRO 53 HA PRO 53 -9.531 -9.896 3.569 429 HB2 PRO 53 HB3 PRO 53 -11.289 -9.990 5.752 430 HB3 PRO 53 HB2 PRO 53 -11.666 -9.408 4.131 431 HG2 PRO 53 HG3 PRO 53 -12.728 -11.695 5.394 432 HG3 PRO 53 HG2 PRO 53 -12.913 -11.239 3.694 433 HD2 PRO 53 HD3 PRO 53 -11.053 -13.196 4.942 434 HD3 PRO 53 HD2 PRO 53 -11.793 -13.206 3.326 435 H LEU 54 H LEU 54 -8.679 -8.834 5.492 436 HA LEU 54 HA LEU 54 -6.922 -10.572 6.976 437 HB2 LEU 54 HB3 LEU 54 -7.311 -7.591 6.912 438 HB3 LEU 54 HB2 LEU 54 -6.199 -8.364 8.024 439 HG LEU 54 HG LEU 54 -5.627 -9.348 5.420 440 HD11 LEU 54 HD11 LEU 54 -4.867 -6.760 4.846 441 HD12 LEU 54 HD12 LEU 54 -6.522 -6.586 5.427 442 HD13 LEU 54 HD13 LEU 54 -6.171 -7.661 4.074 443 HD21 LEU 54 HD21 LEU 54 -3.898 -7.301 6.675 444 HD22 LEU 54 HD22 LEU 54 -3.492 -8.887 6.018 445 HD23 LEU 54 HD23 LEU 54 -4.234 -8.757 7.613 446 HA PRO 55 HA PRO 55 -9.710 -10.952 10.420 447 HB2 PRO 55 HB3 PRO 55 -8.057 -12.199 12.143 448 HB3 PRO 55 HB2 PRO 55 -8.729 -13.012 10.724 449 HG2 PRO 55 HG3 PRO 55 -6.020 -11.796 11.104 450 HG3 PRO 55 HG2 PRO 55 -6.457 -13.339 10.347 451 HD2 PRO 55 HD3 PRO 55 -5.900 -11.082 8.926 452 HD3 PRO 55 HD2 PRO 55 -7.007 -12.344 8.351 453 H GLU 56 H GLU 56 -10.232 -9.854 12.219 454 HA GLU 56 HA GLU 56 -10.196 -8.316 13.880 455 HB2 GLU 56 HB3 GLU 56 -7.879 -9.783 14.200 456 HB3 GLU 56 HB2 GLU 56 -7.303 -8.121 14.217 457 HG2 GLU 56 HG3 GLU 56 -8.156 -7.727 16.235 458 HG3 GLU 56 HG2 GLU 56 -9.680 -8.524 15.848 459 H ARG 57 H ARG 57 -9.885 -7.463 11.060 460 HA ARG 57 HA ARG 57 -9.165 -4.721 11.659 461 HB2 ARG 57 HB3 ARG 57 -7.507 -4.433 10.020 462 HB3 ARG 57 HB2 ARG 57 -7.068 -5.918 10.847 463 HG2 ARG 57 HG3 ARG 57 -6.754 -6.535 8.674 464 HG3 ARG 57 HG2 ARG 57 -8.426 -7.043 8.914 465 HD2 ARG 57 HD3 ARG 57 -7.824 -5.718 6.783 466 HD3 ARG 57 HD2 ARG 57 -9.273 -5.273 7.676 467 HE ARG 57 HE ARG 57 -8.309 -3.256 8.184 468 HH11 ARG 57 HH11 ARG 57 -5.868 -5.408 6.922 469 HH12 ARG 57 HH12 ARG 57 -4.659 -4.174 6.812 470 HH21 ARG 57 HH21 ARG 57 -6.720 -1.632 8.043 471 HH22 ARG 57 HH22 ARG 57 -5.141 -2.030 7.453 472 H THR 58 H THR 58 -9.688 -3.247 9.798 473 HA THR 58 HA THR 58 -12.192 -4.149 8.586 474 HB THR 58 HB THR 58 -11.145 -1.336 8.461 475 HG1 THR 58 HG1 THR 58 -11.032 -1.984 10.644 476 HG21 THR 58 HG21 THR 58 -13.176 -1.787 7.220 477 HG22 THR 58 HG22 THR 58 -13.505 -0.743 8.603 478 HG23 THR 58 HG23 THR 58 -13.930 -2.453 8.668 479 H ASN 59 H ASN 59 -12.149 -4.887 6.575 480 HA ASN 59 HA ASN 59 -9.924 -4.185 4.828 481 HB2 ASN 59 HB3 ASN 59 -12.067 -6.298 4.703 482 HB3 ASN 59 HB2 ASN 59 -11.010 -5.962 3.335 483 HD21 ASN 59 HD21 ASN 59 -10.750 -6.487 6.835 484 HD22 ASN 59 HD22 ASN 59 -9.382 -7.535 6.749 485 H VAL 60 H VAL 60 -10.119 -3.217 2.857 486 HA VAL 60 HA VAL 60 -12.767 -2.292 2.009 487 HB VAL 60 HB VAL 60 -10.349 -0.505 2.331 488 HG11 VAL 60 HG11 VAL 60 -11.208 0.531 0.526 489 HG12 VAL 60 HG12 VAL 60 -12.383 1.160 1.681 490 HG13 VAL 60 HG13 VAL 60 -12.781 -0.249 0.697 491 HG21 VAL 60 HG21 VAL 60 -11.183 -0.005 4.326 492 HG22 VAL 60 HG22 VAL 60 -12.497 -1.155 4.078 493 HG23 VAL 60 HG23 VAL 60 -12.685 0.522 3.568 494 H VAL 61 H VAL 61 -13.065 -2.369 -0.156 495 HA VAL 61 HA VAL 61 -10.691 -2.940 -1.815 496 HB VAL 61 HB VAL 61 -13.467 -4.050 -2.237 497 HG11 VAL 61 HG11 VAL 61 -12.317 -5.526 -3.861 498 HG12 VAL 61 HG12 VAL 61 -10.842 -4.590 -3.618 499 HG13 VAL 61 HG13 VAL 61 -12.270 -3.822 -4.313 500 HG21 VAL 61 HG21 VAL 61 -12.940 -5.895 -1.061 501 HG22 VAL 61 HG22 VAL 61 -11.783 -4.830 -0.264 502 HG23 VAL 61 HG23 VAL 61 -11.256 -5.874 -1.584 503 H LEU 62 H LEU 62 -10.648 -2.179 -3.921 504 HA LEU 62 HA LEU 62 -12.725 -0.258 -4.715 505 HB2 LEU 62 HB3 LEU 62 -10.699 0.879 -3.703 506 HB3 LEU 62 HB2 LEU 62 -9.766 0.247 -5.045 507 HG LEU 62 HG LEU 62 -11.651 1.491 -6.460 508 HD11 LEU 62 HD11 LEU 62 -12.172 2.359 -3.799 509 HD12 LEU 62 HD12 LEU 62 -12.971 2.840 -5.297 510 HD13 LEU 62 HD13 LEU 62 -11.555 3.726 -4.728 511 HD21 LEU 62 HD21 LEU 62 -9.365 1.971 -6.800 512 HD22 LEU 62 HD22 LEU 62 -9.193 2.667 -5.188 513 HD23 LEU 62 HD23 LEU 62 -10.130 3.515 -6.419 514 H THR 63 H THR 63 -13.582 -1.250 -6.450 515 HA THR 63 HA THR 63 -11.750 -2.136 -8.569 516 HB THR 63 HB THR 63 -12.711 -4.072 -7.306 517 HG1 THR 63 HG1 THR 63 -13.372 -3.724 -10.030 518 HG21 THR 63 HG21 THR 63 -14.848 -4.128 -6.763 519 HG22 THR 63 HG22 THR 63 -15.246 -4.260 -8.476 520 HG23 THR 63 HG23 THR 63 -15.170 -2.674 -7.708 521 H HIS 64 H HIS 64 -12.587 -2.003 -10.719 522 HA HIS 64 HA HIS 64 -14.173 0.309 -11.175 523 HB2 HIS 64 HB3 HIS 64 -12.766 -1.692 -12.843 524 HB3 HIS 64 HB2 HIS 64 -14.103 -0.846 -13.614 525 HD1 HIS 64 HD1 HIS 64 -13.361 1.166 -14.824 526 HD2 HIS 64 HD2 HIS 64 -10.962 0.389 -11.525 527 HE1 HIS 64 HE1 HIS 64 -11.599 2.961 -14.836 528 HE2 HIS 64 HE2 HIS 64 -10.106 2.417 -12.882 529 H GLN 65 H GLN 65 -14.836 -3.133 -11.200 530 HA GLN 65 HA GLN 65 -17.259 -3.170 -12.556 531 HB2 GLN 65 HB3 GLN 65 -16.095 -4.885 -10.388 532 HB3 GLN 65 HB2 GLN 65 -17.736 -5.167 -10.951 533 HG2 GLN 65 HG3 GLN 65 -17.043 -6.146 -12.826 534 HG3 GLN 65 HG2 GLN 65 -15.822 -4.910 -13.125 535 HE21 GLN 65 HE21 GLN 65 -13.794 -5.099 -11.994 536 HE22 GLN 65 HE22 GLN 65 -13.204 -6.661 -11.552 537 H GLU 66 H GLU 66 -19.225 -2.431 -12.128 538 HA GLU 66 HA GLU 66 -19.708 -1.036 -9.644 539 HB2 GLU 66 HB3 GLU 66 -21.904 -0.472 -10.735 540 HB3 GLU 66 HB2 GLU 66 -20.477 0.063 -11.613 541 HG2 GLU 66 HG3 GLU 66 -21.467 -2.591 -12.370 542 HG3 GLU 66 HG2 GLU 66 -22.567 -1.257 -12.714 543 H ASP 67 H ASP 67 -20.679 -4.020 -11.179 544 HA ASP 67 HA ASP 67 -22.611 -4.543 -9.042 545 HB2 ASP 67 HB3 ASP 67 -22.903 -4.937 -11.672 546 HB3 ASP 67 HB2 ASP 67 -22.210 -6.498 -11.241 547 H TYR 68 H TYR 68 -19.557 -4.717 -8.840 548 HA TYR 68 HA TYR 68 -19.065 -7.528 -8.450 549 HB2 TYR 68 HB3 TYR 68 -17.288 -5.886 -9.123 550 HB3 TYR 68 HB2 TYR 68 -17.373 -5.210 -7.500 551 HD1 TYR 68 HD1 TYR 68 -17.061 -8.587 -9.082 552 HD2 TYR 68 HD2 TYR 68 -15.754 -5.929 -6.027 553 HE1 TYR 68 HE1 TYR 68 -15.461 -10.282 -8.301 554 HE2 TYR 68 HE2 TYR 68 -14.149 -7.617 -5.238 555 HH TYR 68 HH TYR 68 -13.336 -10.362 -7.032 556 H GLN 69 H GLN 69 -18.794 -8.613 -6.498 557 HA GLN 69 HA GLN 69 -19.726 -7.191 -4.095 558 HB2 GLN 69 HB3 GLN 69 -20.466 -10.025 -4.842 559 HB3 GLN 69 HB2 GLN 69 -21.009 -9.139 -3.424 560 HG2 GLN 69 HG3 GLN 69 -21.620 -8.340 -6.259 561 HG3 GLN 69 HG2 GLN 69 -22.693 -9.293 -5.235 562 HE21 GLN 69 HE21 GLN 69 -22.374 -6.362 -6.427 563 HE22 GLN 69 HE22 GLN 69 -23.010 -5.399 -5.141 564 H ALA 70 H ALA 70 -17.989 -7.071 -2.833 565 HA ALA 70 HA ALA 70 -16.142 -9.339 -2.690 566 HB1 ALA 70 HB1 ALA 70 -15.716 -6.701 -1.330 567 HB2 ALA 70 HB2 ALA 70 -15.388 -6.907 -3.051 568 HB3 ALA 70 HB3 ALA 70 -14.520 -7.882 -1.866 569 H GLN 71 H GLN 71 -16.990 -10.810 -1.332 570 HA GLN 71 HA GLN 71 -18.441 -10.174 1.020 571 HB2 GLN 71 HB3 GLN 71 -17.291 -12.677 -0.152 572 HB3 GLN 71 HB2 GLN 71 -17.856 -12.689 1.513 573 HG2 GLN 71 HG3 GLN 71 -19.671 -13.444 0.261 574 HG3 GLN 71 HG2 GLN 71 -20.042 -11.756 0.612 575 HE21 GLN 71 HE21 GLN 71 -20.739 -10.606 -1.031 576 HE22 GLN 71 HE22 GLN 71 -20.438 -10.923 -2.703 577 H GLY 72 H GLY 72 -17.722 -9.621 2.960 578 HA2 GLY 72 HA3 GLY 72 -16.296 -9.994 4.849 579 HA3 GLY 72 HA2 GLY 72 -15.009 -10.440 3.741 580 H ALA 73 H ALA 73 -15.507 -8.093 1.966 581 HA ALA 73 HA ALA 73 -14.598 -5.961 3.788 582 HB1 ALA 73 HB1 ALA 73 -12.968 -5.269 2.078 583 HB2 ALA 73 HB2 ALA 73 -13.404 -6.682 1.117 584 HB3 ALA 73 HB3 ALA 73 -12.650 -6.890 2.697 585 H VAL 74 H VAL 74 -14.628 -3.774 2.664 586 HA VAL 74 HA VAL 74 -17.258 -3.409 1.518 587 HB VAL 74 HB VAL 74 -15.167 -1.279 1.967 588 HG11 VAL 74 HG11 VAL 74 -18.168 -1.214 1.703 589 HG12 VAL 74 HG12 VAL 74 -16.978 -0.524 0.599 590 HG13 VAL 74 HG13 VAL 74 -17.188 0.162 2.210 591 HG21 VAL 74 HG21 VAL 74 -17.185 -2.397 3.907 592 HG22 VAL 74 HG22 VAL 74 -16.314 -0.881 4.143 593 HG23 VAL 74 HG23 VAL 74 -15.429 -2.405 4.066 594 H VAL 75 H VAL 75 -17.717 -2.497 -0.505 595 HA VAL 75 HA VAL 75 -15.472 -2.521 -2.413 596 HB VAL 75 HB VAL 75 -18.314 -3.311 -3.050 597 HG11 VAL 75 HG11 VAL 75 -17.468 -4.018 -5.161 598 HG12 VAL 75 HG12 VAL 75 -15.801 -3.754 -4.651 599 HG13 VAL 75 HG13 VAL 75 -16.880 -2.378 -4.887 600 HG21 VAL 75 HG21 VAL 75 -17.826 -5.206 -1.955 601 HG22 VAL 75 HG22 VAL 75 -16.101 -4.844 -1.903 602 HG23 VAL 75 HG23 VAL 75 -16.806 -5.570 -3.347 603 H VAL 76 H VAL 76 -15.327 -0.873 -3.844 604 HA VAL 76 HA VAL 76 -17.534 1.005 -4.129 605 HB VAL 76 HB VAL 76 -15.895 2.932 -3.793 606 HG11 VAL 76 HG11 VAL 76 -16.351 1.550 -1.197 607 HG12 VAL 76 HG12 VAL 76 -17.742 1.977 -2.193 608 HG13 VAL 76 HG13 VAL 76 -16.630 3.232 -1.648 609 HG21 VAL 76 HG21 VAL 76 -13.886 1.458 -3.777 610 HG22 VAL 76 HG22 VAL 76 -14.393 0.868 -2.193 611 HG23 VAL 76 HG23 VAL 76 -13.981 2.568 -2.411 612 H HIS 77 H HIS 77 -17.413 2.284 -5.975 613 HA HIS 77 HA HIS 77 -15.187 1.724 -7.807 614 HB2 HIS 77 HB3 HIS 77 -17.673 2.073 -9.255 615 HB3 HIS 77 HB2 HIS 77 -16.508 0.757 -9.346 616 HD1 HIS 77 HD1 HIS 77 -16.858 -1.187 -7.509 617 HD2 HIS 77 HD2 HIS 77 -20.040 1.426 -8.064 618 HE1 HIS 77 HE1 HIS 77 -18.855 -2.339 -6.508 619 HE2 HIS 77 HE2 HIS 77 -20.786 -0.777 -6.932 620 H ASP 78 H ASP 78 -14.966 3.922 -6.433 621 HA ASP 78 HA ASP 78 -15.153 5.972 -8.362 622 HB2 ASP 78 HB3 ASP 78 -17.342 5.756 -6.449 623 HB3 ASP 78 HB2 ASP 78 -16.525 7.313 -6.346 624 H VAL 79 H VAL 79 -13.810 7.716 -7.845 625 HA VAL 79 HA VAL 79 -11.851 7.193 -5.858 626 HB VAL 79 HB VAL 79 -11.386 9.802 -6.398 627 HG11 VAL 79 HG11 VAL 79 -9.560 9.015 -7.446 628 HG12 VAL 79 HG12 VAL 79 -10.496 8.001 -8.543 629 HG13 VAL 79 HG13 VAL 79 -10.165 7.450 -6.900 630 HG21 VAL 79 HG21 VAL 79 -12.407 8.831 -9.037 631 HG22 VAL 79 HG22 VAL 79 -12.027 10.474 -8.521 632 HG23 VAL 79 HG23 VAL 79 -13.480 9.675 -7.921 633 H ALA 80 H ALA 80 -14.294 9.722 -6.166 634 HA ALA 80 HA ALA 80 -13.909 10.813 -3.591 635 HB1 ALA 80 HB1 ALA 80 -16.598 11.053 -4.771 636 HB2 ALA 80 HB2 ALA 80 -15.265 11.615 -5.780 637 HB3 ALA 80 HB3 ALA 80 -15.503 12.299 -4.172 638 H ALA 81 H ALA 81 -15.667 8.056 -4.749 639 HA ALA 81 HA ALA 81 -17.590 7.752 -2.751 640 HB1 ALA 81 HB1 ALA 81 -16.117 5.776 -4.465 641 HB2 ALA 81 HB2 ALA 81 -17.791 6.320 -4.588 642 HB3 ALA 81 HB3 ALA 81 -17.304 5.254 -3.269 643 H VAL 82 H VAL 82 -14.589 5.841 -2.912 644 HA VAL 82 HA VAL 82 -14.617 4.928 -0.309 645 HB VAL 82 HB VAL 82 -13.100 4.241 -2.260 646 HG11 VAL 82 HG11 VAL 82 -12.153 6.753 -2.129 647 HG12 VAL 82 HG12 VAL 82 -11.252 5.395 -2.798 648 HG13 VAL 82 HG13 VAL 82 -10.962 5.914 -1.136 649 HG21 VAL 82 HG21 VAL 82 -11.799 4.487 0.445 650 HG22 VAL 82 HG22 VAL 82 -11.472 3.273 -0.791 651 HG23 VAL 82 HG23 VAL 82 -13.029 3.292 0.036 652 H PHE 83 H PHE 83 -13.516 8.027 -1.542 653 HA PHE 83 HA PHE 83 -12.041 8.817 0.721 654 HB2 PHE 83 HB3 PHE 83 -13.359 10.278 -1.547 655 HB3 PHE 83 HB2 PHE 83 -12.667 11.175 -0.204 656 HD1 PHE 83 HD2 PHE 83 -10.264 9.639 0.417 657 HD2 PHE 83 HD1 PHE 83 -11.964 10.657 -3.349 658 HE1 PHE 83 HE2 PHE 83 -8.042 9.475 -0.627 659 HE2 PHE 83 HE1 PHE 83 -9.746 10.494 -4.399 660 HZ PHE 83 HZ PHE 83 -7.782 9.902 -3.038 661 H ALA 84 H ALA 84 -15.443 9.256 -0.176 662 HA ALA 84 HA ALA 84 -16.143 10.798 2.091 663 HB1 ALA 84 HB1 ALA 84 -18.494 9.881 1.553 664 HB2 ALA 84 HB2 ALA 84 -17.723 9.136 0.152 665 HB3 ALA 84 HB3 ALA 84 -17.697 10.889 0.346 666 H TYR 85 H TYR 85 -15.819 7.390 1.474 667 HA TYR 85 HA TYR 85 -17.109 6.466 3.825 668 HB2 TYR 85 HB3 TYR 85 -16.764 4.510 2.776 669 HB3 TYR 85 HB2 TYR 85 -15.712 5.303 1.613 670 HD1 TYR 85 HD1 TYR 85 -15.640 3.870 5.062 671 HD2 TYR 85 HD2 TYR 85 -13.512 4.636 1.465 672 HE1 TYR 85 HE1 TYR 85 -13.722 2.606 5.937 673 HE2 TYR 85 HE2 TYR 85 -11.585 3.372 2.324 674 HH TYR 85 HH TYR 85 -10.896 1.929 3.944 675 H ALA 86 H ALA 86 -13.622 6.699 3.054 676 HA ALA 86 HA ALA 86 -12.531 6.235 5.485 677 HB1 ALA 86 HB1 ALA 86 -11.540 7.125 3.142 678 HB2 ALA 86 HB2 ALA 86 -10.605 7.045 4.635 679 HB3 ALA 86 HB3 ALA 86 -11.343 8.568 4.138 680 H LYS 87 H LYS 87 -14.048 9.264 4.469 681 HA LYS 87 HA LYS 87 -13.364 10.671 6.866 682 HB2 LYS 87 HB3 LYS 87 -14.370 11.412 4.426 683 HB3 LYS 87 HB2 LYS 87 -15.801 11.520 5.441 684 HG2 LYS 87 HG3 LYS 87 -14.965 13.639 5.637 685 HG3 LYS 87 HG2 LYS 87 -14.211 12.858 7.028 686 HD2 LYS 87 HD3 LYS 87 -12.144 13.062 6.170 687 HD3 LYS 87 HD2 LYS 87 -12.675 12.627 4.544 688 HE2 LYS 87 HE3 LYS 87 -11.930 14.854 4.388 689 HE3 LYS 87 HE2 LYS 87 -13.690 14.947 4.411 690 HZ1 LYS 87 HZ1 LYS 87 -11.758 15.868 6.373 691 HZ2 LYS 87 HZ2 LYS 87 -13.150 15.145 7.007 692 HZ3 LYS 87 HZ3 LYS 87 -13.285 16.484 5.982 693 H GLN 88 H GLN 88 -16.163 8.928 5.672 694 HA GLN 88 HA GLN 88 -17.912 9.360 7.805 695 HB2 GLN 88 HB3 GLN 88 -17.657 7.278 5.681 696 HB3 GLN 88 HB2 GLN 88 -18.778 6.996 7.003 697 HG2 GLN 88 HG3 GLN 88 -18.804 9.447 5.264 698 HG3 GLN 88 HG2 GLN 88 -19.799 8.018 4.985 699 HE21 GLN 88 HE21 GLN 88 -19.280 10.812 6.961 700 HE22 GLN 88 HE22 GLN 88 -20.767 10.729 7.836 701 H HIS 89 H HIS 89 -15.116 7.354 7.569 702 HA HIS 89 HA HIS 89 -15.834 6.010 10.089 703 HB2 HIS 89 HB3 HIS 89 -14.356 5.154 7.681 704 HB3 HIS 89 HB2 HIS 89 -13.655 4.645 9.214 705 HD1 HIS 89 HD1 HIS 89 -16.123 3.940 10.821 706 HD2 HIS 89 HD2 HIS 89 -15.658 2.948 6.814 707 HE1 HIS 89 HE1 HIS 89 -17.660 1.989 10.430 708 HE2 HIS 89 HE2 HIS 89 -17.429 1.463 7.977 709 HA PRO 90 HA PRO 90 -12.404 8.953 11.159 710 HB2 PRO 90 HB3 PRO 90 -13.582 10.144 13.252 711 HB3 PRO 90 HB2 PRO 90 -13.934 10.635 11.590 712 HG2 PRO 90 HG3 PRO 90 -15.514 8.862 13.415 713 HG3 PRO 90 HG2 PRO 90 -16.084 10.156 12.345 714 HD2 PRO 90 HD3 PRO 90 -16.194 7.501 11.699 715 HD3 PRO 90 HD2 PRO 90 -16.071 8.801 10.498 716 H ASP 91 H ASP 91 -13.920 6.297 12.534 717 HA ASP 91 HA ASP 91 -12.651 6.327 15.103 718 HB2 ASP 91 HB3 ASP 91 -14.111 4.186 13.556 719 HB3 ASP 91 HB2 ASP 91 -13.413 3.903 15.148 720 H GLN 92 H GLN 92 -11.701 5.392 11.931 721 HA GLN 92 HA GLN 92 -9.188 4.351 13.023 722 HB2 GLN 92 HB3 GLN 92 -10.971 2.999 11.013 723 HB3 GLN 92 HB2 GLN 92 -9.244 2.672 11.066 724 HG2 GLN 92 HG3 GLN 92 -10.199 0.976 12.338 725 HG3 GLN 92 HG2 GLN 92 -9.592 2.126 13.529 726 HE21 GLN 92 HE21 GLN 92 -12.532 1.504 11.638 727 HE22 GLN 92 HE22 GLN 92 -13.635 1.820 12.929 728 H GLU 93 H GLU 93 -7.511 4.140 11.225 729 HA GLU 93 HA GLU 93 -7.647 6.573 9.595 730 HB2 GLU 93 HB3 GLU 93 -5.272 4.868 10.371 731 HB3 GLU 93 HB2 GLU 93 -5.193 6.346 9.421 732 HG2 GLU 93 HG3 GLU 93 -6.454 6.407 12.119 733 HG3 GLU 93 HG2 GLU 93 -4.697 6.383 11.977 734 H LEU 94 H LEU 94 -6.702 6.508 7.420 735 HA LEU 94 HA LEU 94 -7.440 4.013 6.069 736 HB2 LEU 94 HB3 LEU 94 -8.159 6.591 5.538 737 HB3 LEU 94 HB2 LEU 94 -6.817 6.375 4.431 738 HG LEU 94 HG LEU 94 -7.986 4.309 3.573 739 HD11 LEU 94 HD11 LEU 94 -9.915 5.201 5.614 740 HD12 LEU 94 HD12 LEU 94 -9.593 3.587 4.979 741 HD13 LEU 94 HD13 LEU 94 -10.599 4.710 4.064 742 HD21 LEU 94 HD21 LEU 94 -8.083 6.173 2.174 743 HD22 LEU 94 HD22 LEU 94 -9.122 7.069 3.283 744 HD23 LEU 94 HD23 LEU 94 -9.772 5.706 2.372 745 H VAL 95 H VAL 95 -5.948 2.733 5.213 746 HA VAL 95 HA VAL 95 -3.324 3.858 4.517 747 HB VAL 95 HB VAL 95 -3.658 1.214 5.933 748 HG11 VAL 95 HG11 VAL 95 -1.093 1.919 6.292 749 HG12 VAL 95 HG12 VAL 95 -1.397 2.689 4.735 750 HG13 VAL 95 HG13 VAL 95 -1.650 0.953 4.925 751 HG21 VAL 95 HG21 VAL 95 -4.255 2.966 7.481 752 HG22 VAL 95 HG22 VAL 95 -2.816 3.888 7.046 753 HG23 VAL 95 HG23 VAL 95 -2.655 2.349 7.892 754 H ILE 96 H ILE 96 -3.009 3.506 2.426 755 HA ILE 96 HA ILE 96 -4.421 1.416 1.020 756 HB ILE 96 HB ILE 96 -2.259 3.104 -0.195 757 HG12 ILE 96 HG13 ILE 96 -3.644 4.699 0.982 758 HG13 ILE 96 HG12 ILE 96 -4.022 4.787 -0.735 759 HG21 ILE 96 HG21 ILE 96 -3.675 1.130 -1.273 760 HG22 ILE 96 HG22 ILE 96 -3.166 2.542 -2.197 761 HG23 ILE 96 HG23 ILE 96 -4.806 2.453 -1.556 762 HD11 ILE 96 HD11 ILE 96 -5.984 4.876 0.811 763 HD12 ILE 96 HD12 ILE 96 -5.644 3.197 1.229 764 HD13 ILE 96 HD13 ILE 96 -6.062 3.625 -0.430 765 H ALA 97 H ALA 97 -3.643 -0.515 0.400 766 HA ALA 97 HA ALA 97 -0.832 -1.106 1.039 767 HB1 ALA 97 HB1 ALA 97 -1.729 -3.534 0.931 768 HB2 ALA 97 HB2 ALA 97 -3.312 -2.774 1.091 769 HB3 ALA 97 HB3 ALA 97 -2.092 -2.542 2.343 770 H GLY 98 H GLY 98 -3.231 -1.140 -1.489 771 HA2 GLY 98 HA3 GLY 98 -1.397 -1.172 -3.579 772 HA3 GLY 98 HA2 GLY 98 -1.859 -2.843 -3.298 773 H GLY 99 H GLY 99 -4.119 -1.614 -5.908 774 HA2 GLY 99 HA3 GLY 99 -1.349 -2.356 -5.295 775 HA3 GLY 99 HA2 GLY 99 -2.178 -2.600 -6.822 776 H ALA 100 H ALA 100 -0.408 -1.696 -7.935 777 HA ALA 100 HA ALA 100 0.723 0.808 -7.447 778 HB1 ALA 100 HB1 ALA 100 1.822 -0.721 -8.911 779 HB2 ALA 100 HB2 ALA 100 1.419 0.719 -9.845 780 HB3 ALA 100 HB3 ALA 100 0.446 -0.742 -10.014 781 H GLN 101 H GLN 101 -2.052 -0.083 -9.475 782 HA GLN 101 HA GLN 101 -2.481 2.466 -10.583 783 HB2 GLN 101 HB3 GLN 101 -3.676 -0.065 -10.757 784 HB3 GLN 101 HB2 GLN 101 -4.954 1.016 -10.219 785 HG2 GLN 101 HG3 GLN 101 -3.292 2.003 -12.435 786 HG3 GLN 101 HG2 GLN 101 -4.304 0.605 -12.794 787 HE21 GLN 101 HE21 GLN 101 -4.688 3.567 -10.871 788 HE22 GLN 101 HE22 GLN 101 -6.190 4.038 -11.583 789 H ILE 102 H ILE 102 -3.561 0.986 -7.579 790 HA ILE 102 HA ILE 102 -5.441 2.987 -6.877 791 HB ILE 102 HB ILE 102 -3.873 1.212 -5.002 792 HG12 ILE 102 HG13 ILE 102 -5.060 -0.062 -6.775 793 HG13 ILE 102 HG12 ILE 102 -5.708 -0.367 -5.166 794 HG21 ILE 102 HG21 ILE 102 -4.882 2.655 -3.564 795 HG22 ILE 102 HG22 ILE 102 -6.215 1.523 -3.788 796 HG23 ILE 102 HG23 ILE 102 -6.186 3.039 -4.688 797 HD11 ILE 102 HD11 ILE 102 -7.204 0.183 -7.339 798 HD12 ILE 102 HD12 ILE 102 -7.027 1.794 -6.645 799 HD13 ILE 102 HD13 ILE 102 -7.712 0.488 -5.678 800 H PHE 103 H PHE 103 -1.983 2.634 -6.412 801 HA PHE 103 HA PHE 103 -1.685 4.775 -4.569 802 HB2 PHE 103 HB3 PHE 103 0.345 3.546 -6.446 803 HB3 PHE 103 HB2 PHE 103 0.718 4.617 -5.101 804 HD1 PHE 103 HD1 PHE 103 -1.305 3.421 -3.149 805 HD2 PHE 103 HD2 PHE 103 1.581 1.666 -5.737 806 HE1 PHE 103 HE1 PHE 103 -1.145 1.480 -1.647 807 HE2 PHE 103 HE2 PHE 103 1.745 -0.280 -4.241 808 HZ PHE 103 HZ PHE 103 0.382 -0.374 -2.193 809 H THR 104 H THR 104 -1.931 4.576 -8.024 810 HA THR 104 HA THR 104 -0.745 7.062 -8.660 811 HB THR 104 HB THR 104 -2.828 5.483 -10.176 812 HG1 THR 104 HG1 THR 104 -0.752 4.454 -9.717 813 HG21 THR 104 HG21 THR 104 -0.945 7.045 -11.731 814 HG22 THR 104 HG22 THR 104 -2.002 8.042 -10.729 815 HG23 THR 104 HG23 THR 104 -2.696 6.898 -11.879 816 H ALA 105 H ALA 105 -4.198 6.149 -8.433 817 HA ALA 105 HA ALA 105 -5.247 8.688 -8.872 818 HB1 ALA 105 HB1 ALA 105 -7.273 7.797 -8.345 819 HB2 ALA 105 HB2 ALA 105 -6.652 6.930 -6.941 820 HB3 ALA 105 HB3 ALA 105 -6.364 6.302 -8.563 821 H PHE 106 H PHE 106 -4.799 7.122 -5.670 822 HA PHE 106 HA PHE 106 -5.387 9.461 -4.237 823 HB2 PHE 106 HB3 PHE 106 -3.903 6.950 -3.451 824 HB3 PHE 106 HB2 PHE 106 -4.355 8.216 -2.315 825 HD1 PHE 106 HD2 PHE 106 -5.806 5.867 -4.811 826 HD2 PHE 106 HD1 PHE 106 -6.419 8.141 -1.267 827 HE1 PHE 106 HE2 PHE 106 -7.995 4.790 -4.508 828 HE2 PHE 106 HE1 PHE 106 -8.610 7.064 -0.956 829 HZ PHE 106 HZ PHE 106 -9.394 5.386 -2.580 830 H LYS 107 H LYS 107 -2.595 8.603 -5.996 831 HA LYS 107 HA LYS 107 -0.457 9.514 -4.576 832 HB2 LYS 107 HB3 LYS 107 0.678 9.692 -6.564 833 HB3 LYS 107 HB2 LYS 107 -0.688 8.714 -7.072 834 HG2 LYS 107 HG3 LYS 107 -1.801 10.834 -7.828 835 HG3 LYS 107 HG2 LYS 107 -0.274 11.659 -7.515 836 HD2 LYS 107 HD3 LYS 107 0.855 10.179 -9.101 837 HD3 LYS 107 HD2 LYS 107 -0.667 9.339 -9.406 838 HE2 LYS 107 HE3 LYS 107 -1.641 11.400 -10.275 839 HE3 LYS 107 HE2 LYS 107 -0.139 12.261 -9.941 840 HZ1 LYS 107 HZ1 LYS 107 0.744 10.240 -11.446 841 HZ2 LYS 107 HZ2 LYS 107 0.299 11.749 -12.067 842 HZ3 LYS 107 HZ3 LYS 107 -0.796 10.461 -12.114 843 H ASP 108 H ASP 108 -2.866 11.492 -6.226 844 HA ASP 108 HA ASP 108 -1.554 13.949 -5.407 845 HB2 ASP 108 HB3 ASP 108 -3.275 13.236 -7.508 846 HB3 ASP 108 HB2 ASP 108 -4.212 14.324 -6.488 847 H ASP 109 H ASP 109 -4.335 11.996 -4.538 848 HA ASP 109 HA ASP 109 -5.293 13.990 -2.649 849 HB2 ASP 109 HB3 ASP 109 -6.578 12.103 -4.146 850 HB3 ASP 109 HB2 ASP 109 -6.512 11.317 -2.572 851 H VAL 110 H VAL 110 -2.755 12.042 -2.441 852 HA VAL 110 HA VAL 110 -3.308 10.807 0.122 853 HB VAL 110 HB VAL 110 -1.904 9.643 -1.535 854 HG11 VAL 110 HG11 VAL 110 -0.607 12.154 -1.711 855 HG12 VAL 110 HG12 VAL 110 -0.284 10.687 -2.634 856 HG13 VAL 110 HG13 VAL 110 0.575 10.983 -1.124 857 HG21 VAL 110 HG21 VAL 110 -0.429 8.730 0.013 858 HG22 VAL 110 HG22 VAL 110 -1.693 9.426 1.027 859 HG23 VAL 110 HG23 VAL 110 -0.161 10.275 0.818 860 H ASP 111 H ASP 111 -1.946 11.153 2.000 861 HA ASP 111 HA ASP 111 -0.864 13.886 2.165 862 HB2 ASP 111 HB3 ASP 111 -2.673 12.448 4.098 863 HB3 ASP 111 HB2 ASP 111 -1.688 13.821 4.591 864 H THR 112 H THR 112 -0.724 10.566 3.358 865 HA THR 112 HA THR 112 1.936 11.154 4.484 866 HB THR 112 HB THR 112 -0.026 8.999 5.289 867 HG1 THR 112 HG1 THR 112 0.791 11.422 6.485 868 HG21 THR 112 HG21 THR 112 2.003 8.007 5.769 869 HG22 THR 112 HG22 THR 112 1.608 8.839 7.273 870 HG23 THR 112 HG23 THR 112 2.780 9.542 6.159 871 H LEU 113 H LEU 113 3.543 9.446 4.313 872 HA LEU 113 HA LEU 113 3.080 7.567 2.111 873 HB2 LEU 113 HB3 LEU 113 4.420 9.870 1.727 874 HB3 LEU 113 HB2 LEU 113 5.737 8.846 2.262 875 HG LEU 113 HG LEU 113 5.217 7.260 0.440 876 HD11 LEU 113 HD11 LEU 113 3.224 9.370 -0.377 877 HD12 LEU 113 HD12 LEU 113 2.851 7.736 0.169 878 HD13 LEU 113 HD13 LEU 113 3.705 7.983 -1.354 879 HD21 LEU 113 HD21 LEU 113 6.892 8.524 -0.349 880 HD22 LEU 113 HD22 LEU 113 6.106 10.031 0.121 881 HD23 LEU 113 HD23 LEU 113 5.647 9.228 -1.382 882 H LEU 114 H LEU 114 3.876 5.591 2.442 883 HA LEU 114 HA LEU 114 5.975 5.182 4.446 884 HB2 LEU 114 HB3 LEU 114 3.242 3.957 4.418 885 HB3 LEU 114 HB2 LEU 114 4.596 3.033 5.040 886 HG LEU 114 HG LEU 114 4.036 5.784 6.093 887 HD11 LEU 114 HD11 LEU 114 2.744 4.635 7.919 888 HD12 LEU 114 HD12 LEU 114 2.667 3.220 6.870 889 HD13 LEU 114 HD13 LEU 114 1.926 4.738 6.360 890 HD21 LEU 114 HD21 LEU 114 5.992 5.155 7.042 891 HD22 LEU 114 HD22 LEU 114 5.665 3.434 6.841 892 HD23 LEU 114 HD23 LEU 114 4.910 4.327 8.161 893 H VAL 115 H VAL 115 7.581 4.382 3.212 894 HA VAL 115 HA VAL 115 6.891 2.171 1.393 895 HB VAL 115 HB VAL 115 8.437 2.960 -0.265 896 HG11 VAL 115 HG11 VAL 115 7.226 4.789 -1.092 897 HG12 VAL 115 HG12 VAL 115 6.838 5.373 0.527 898 HG13 VAL 115 HG13 VAL 115 6.078 3.905 -0.087 899 HG21 VAL 115 HG21 VAL 115 9.019 5.241 1.621 900 HG22 VAL 115 HG22 VAL 115 9.599 5.114 -0.040 901 HG23 VAL 115 HG23 VAL 115 10.127 3.945 1.171 902 H THR 116 H THR 116 8.374 0.559 1.099 903 HA THR 116 HA THR 116 10.623 0.507 3.003 904 HB THR 116 HB THR 116 8.874 -1.735 1.967 905 HG1 THR 116 HG1 THR 116 8.293 -1.940 4.089 906 HG21 THR 116 HG21 THR 116 11.590 -1.875 2.956 907 HG22 THR 116 HG22 THR 116 10.587 -3.119 2.209 908 HG23 THR 116 HG23 THR 116 10.463 -2.808 3.942 909 H ARG 117 H ARG 117 12.273 1.198 1.718 910 HA ARG 117 HA ARG 117 12.539 0.216 -0.988 911 HB2 ARG 117 HB3 ARG 117 13.789 2.327 0.657 912 HB3 ARG 117 HB2 ARG 117 14.829 1.598 -0.559 913 HG2 ARG 117 HG3 ARG 117 12.399 2.107 -1.850 914 HG3 ARG 117 HG2 ARG 117 12.737 3.535 -0.871 915 HD2 ARG 117 HD3 ARG 117 14.501 4.134 -2.133 916 HD3 ARG 117 HD2 ARG 117 15.051 2.471 -2.329 917 HE ARG 117 HE ARG 117 12.832 2.596 -3.884 918 HH11 ARG 117 HH11 ARG 117 15.747 4.505 -3.688 919 HH12 ARG 117 HH12 ARG 117 15.736 4.922 -5.368 920 HH21 ARG 117 HH21 ARG 117 12.816 3.144 -6.096 921 HH22 ARG 117 HH22 ARG 117 14.073 4.151 -6.735 922 H LEU 118 H LEU 118 13.331 -1.728 -1.335 923 HA LEU 118 HA LEU 118 15.100 -3.034 0.516 924 HB2 LEU 118 HB3 LEU 118 13.530 -3.757 -1.839 925 HB3 LEU 118 HB2 LEU 118 15.092 -4.552 -1.794 926 HG LEU 118 HG LEU 118 14.524 -5.329 0.534 927 HD11 LEU 118 HD11 LEU 118 11.657 -5.014 0.030 928 HD12 LEU 118 HD12 LEU 118 12.504 -3.511 0.392 929 HD13 LEU 118 HD13 LEU 118 12.572 -4.857 1.528 930 HD21 LEU 118 HD21 LEU 118 14.199 -6.573 -1.728 931 HD22 LEU 118 HD22 LEU 118 12.482 -6.354 -1.387 932 HD23 LEU 118 HD23 LEU 118 13.501 -7.238 -0.251 933 H ALA 119 H ALA 119 17.262 -3.236 0.403 934 HA ALA 119 HA ALA 119 18.810 -1.503 -1.149 935 HB1 ALA 119 HB1 ALA 119 20.737 -2.760 -0.347 936 HB2 ALA 119 HB2 ALA 119 19.677 -4.065 0.185 937 HB3 ALA 119 HB3 ALA 119 19.583 -2.481 0.957 938 H GLY 120 H GLY 120 18.117 -4.957 -1.570 939 HA2 GLY 120 HA3 GLY 120 19.757 -5.413 -3.787 940 HA3 GLY 120 HA2 GLY 120 18.312 -6.332 -3.392 941 H SER 121 H SER 121 19.401 -5.455 -5.984 942 HA SER 121 HA SER 121 17.301 -3.633 -6.915 943 HB2 SER 121 HB3 SER 121 19.890 -4.566 -8.161 944 HB3 SER 121 HB2 SER 121 18.676 -3.655 -9.059 945 HG SER 121 HG SER 121 20.311 -2.839 -6.934 946 H PHE 122 H PHE 122 15.494 -4.577 -7.582 947 HA PHE 122 HA PHE 122 15.681 -7.184 -8.937 948 HB2 PHE 122 HB3 PHE 122 13.410 -5.978 -7.349 949 HB3 PHE 122 HB2 PHE 122 13.280 -7.469 -8.275 950 HD1 PHE 122 HD2 PHE 122 15.172 -5.879 -5.506 951 HD2 PHE 122 HD1 PHE 122 13.879 -9.502 -7.325 952 HE1 PHE 122 HE2 PHE 122 16.015 -7.146 -3.572 953 HE2 PHE 122 HE1 PHE 122 14.717 -10.776 -5.394 954 HZ PHE 122 HZ PHE 122 15.788 -9.598 -3.515 955 H GLU 123 H GLU 123 13.950 -7.586 -10.562 956 HA GLU 123 HA GLU 123 13.161 -5.135 -11.983 957 HB2 GLU 123 HB3 GLU 123 13.777 -6.123 -14.118 958 HB3 GLU 123 HB2 GLU 123 15.177 -6.059 -13.056 959 HG2 GLU 123 HG3 GLU 123 14.055 -8.548 -12.568 960 HG3 GLU 123 HG2 GLU 123 13.907 -8.328 -14.311 961 H GLY 124 H GLY 124 11.134 -5.131 -12.780 962 HA2 GLY 124 HA3 GLY 124 9.706 -7.619 -13.229 963 HA3 GLY 124 HA2 GLY 124 9.106 -6.646 -11.895 964 H ASP 125 H ASP 125 7.107 -6.375 -12.961 965 HA ASP 125 HA ASP 125 7.220 -4.521 -15.249 966 HB2 ASP 125 HB3 ASP 125 6.084 -7.026 -15.239 967 HB3 ASP 125 HB2 ASP 125 4.702 -5.984 -14.914 968 H THR 126 H THR 126 6.115 -5.021 -12.042 969 HA THR 126 HA THR 126 4.281 -2.733 -12.257 970 HB THR 126 HB THR 126 4.397 -4.385 -9.784 971 HG1 THR 126 HG1 THR 126 3.277 -5.259 -12.234 972 HG21 THR 126 HG21 THR 126 2.025 -4.046 -9.743 973 HG22 THR 126 HG22 THR 126 2.061 -3.326 -11.352 974 HG23 THR 126 HG23 THR 126 2.827 -2.496 -9.997 975 H LYS 127 H LYS 127 5.226 -0.875 -11.779 976 HA LYS 127 HA LYS 127 7.021 -0.769 -9.446 977 HB2 LYS 127 HB3 LYS 127 8.259 1.048 -10.609 978 HB3 LYS 127 HB2 LYS 127 8.381 -0.507 -11.420 979 HG2 LYS 127 HG3 LYS 127 7.812 0.560 -13.280 980 HG3 LYS 127 HG2 LYS 127 6.184 0.664 -12.608 981 HD2 LYS 127 HD3 LYS 127 6.394 2.881 -12.732 982 HD3 LYS 127 HD2 LYS 127 7.553 2.761 -11.408 983 HE2 LYS 127 HE3 LYS 127 8.516 4.025 -13.232 984 HE3 LYS 127 HE2 LYS 127 9.367 2.491 -13.050 985 HZ1 LYS 127 HZ1 LYS 127 8.476 3.409 -15.378 986 HZ2 LYS 127 HZ2 LYS 127 7.136 2.491 -14.909 987 HZ3 LYS 127 HZ3 LYS 127 8.655 1.761 -15.040 988 H MET 128 H MET 128 7.197 1.471 -8.523 989 HA MET 128 HA MET 128 4.609 2.448 -7.904 990 HB2 MET 128 HB3 MET 128 6.564 2.508 -6.358 991 HB3 MET 128 HB2 MET 128 7.273 3.766 -7.361 992 HG2 MET 128 HG3 MET 128 6.193 4.696 -5.394 993 HG3 MET 128 HG2 MET 128 5.406 5.237 -6.874 994 HE1 MET 128 HE1 MET 128 2.697 4.996 -4.034 995 HE2 MET 128 HE2 MET 128 2.804 5.839 -5.580 996 HE3 MET 128 HE3 MET 128 4.170 5.864 -4.465 997 H ILE 129 H ILE 129 3.946 4.735 -8.101 998 HA ILE 129 HA ILE 129 4.506 5.706 -10.809 999 HB ILE 129 HB ILE 129 2.461 7.059 -10.546 1000 HG12 ILE 129 HG13 ILE 129 1.092 5.989 -8.429 1001 HG13 ILE 129 HG12 ILE 129 2.722 6.107 -7.775 1002 HG21 ILE 129 HG21 ILE 129 1.357 5.338 -11.408 1003 HG22 ILE 129 HG22 ILE 129 1.253 4.555 -9.831 1004 HG23 ILE 129 HG23 ILE 129 2.658 4.280 -10.862 1005 HD11 ILE 129 HD11 ILE 129 2.348 8.536 -9.005 1006 HD12 ILE 129 HD12 ILE 129 2.217 8.201 -7.278 1007 HD13 ILE 129 HD13 ILE 129 0.777 8.178 -8.294 1008 HA PRO 130 HA PRO 130 6.746 9.316 -9.647 1009 HB2 PRO 130 HB3 PRO 130 4.789 10.930 -11.197 1010 HB3 PRO 130 HB2 PRO 130 6.546 10.830 -11.359 1011 HG2 PRO 130 HG3 PRO 130 4.948 9.653 -13.135 1012 HG3 PRO 130 HG2 PRO 130 6.453 8.877 -12.606 1013 HD2 PRO 130 HD3 PRO 130 3.631 8.283 -11.815 1014 HD3 PRO 130 HD2 PRO 130 4.982 7.167 -12.101 1015 H LEU 131 H LEU 131 6.742 10.903 -8.098 1016 HA LEU 131 HA LEU 131 4.167 11.859 -7.074 1017 HB2 LEU 131 HB3 LEU 131 6.166 11.199 -5.004 1018 HB3 LEU 131 HB2 LEU 131 4.419 11.077 -4.958 1019 HG LEU 131 HG LEU 131 5.833 9.109 -6.670 1020 HD11 LEU 131 HD11 LEU 131 5.949 7.768 -4.365 1021 HD12 LEU 131 HD12 LEU 131 6.291 9.390 -3.765 1022 HD13 LEU 131 HD13 LEU 131 7.312 8.679 -5.015 1023 HD21 LEU 131 HD21 LEU 131 3.296 9.373 -6.092 1024 HD22 LEU 131 HD22 LEU 131 3.752 8.525 -4.615 1025 HD23 LEU 131 HD23 LEU 131 4.026 7.771 -6.186 1026 H ASN 132 H ASN 132 4.250 13.857 -5.993 1027 HA ASN 132 HA ASN 132 6.411 15.567 -6.801 1028 HB2 ASN 132 HB3 ASN 132 3.788 16.026 -6.326 1029 HB3 ASN 132 HB2 ASN 132 4.466 16.544 -4.786 1030 HD21 ASN 132 HD21 ASN 132 6.845 17.629 -5.546 1031 HD22 ASN 132 HD22 ASN 132 6.569 19.018 -6.535 1032 H TRP 133 H TRP 133 8.091 14.369 -5.688 1033 HA TRP 133 HA TRP 133 8.268 13.941 -2.970 1034 HB2 TRP 133 HB3 TRP 133 10.464 14.528 -4.956 1035 HB3 TRP 133 HB2 TRP 133 10.741 13.931 -3.321 1036 HD1 TRP 133 HD1 TRP 133 9.288 12.832 -6.696 1037 HE1 TRP 133 HE1 TRP 133 9.144 10.261 -6.731 1038 HE3 TRP 133 HE3 TRP 133 10.599 11.881 -1.848 1039 HZ2 TRP 133 HZ2 TRP 133 9.545 8.115 -4.941 1040 HZ3 TRP 133 HZ3 TRP 133 10.696 9.542 -1.089 1041 HH2 TRP 133 HH2 TRP 133 10.179 7.699 -2.605 1042 H ASP 134 H ASP 134 9.283 16.896 -4.755 1043 HA ASP 134 HA ASP 134 10.449 18.218 -2.615 1044 HB2 ASP 134 HB3 ASP 134 8.952 19.246 -5.025 1045 HB3 ASP 134 HB2 ASP 134 9.736 20.320 -3.871 1046 H ASP 135 H ASP 135 7.057 18.094 -3.614 1047 HA ASP 135 HA ASP 135 6.153 19.880 -1.579 1048 HB2 ASP 135 HB3 ASP 135 4.905 18.192 -3.669 1049 HB3 ASP 135 HB2 ASP 135 3.901 18.563 -2.271 1050 H PHE 136 H PHE 136 7.419 16.880 -1.260 1051 HA PHE 136 HA PHE 136 5.752 16.288 1.093 1052 HB2 PHE 136 HB3 PHE 136 6.852 14.480 -1.020 1053 HB3 PHE 136 HB2 PHE 136 6.708 13.866 0.623 1054 HD1 PHE 136 HD2 PHE 136 4.559 15.988 -1.576 1055 HD2 PHE 136 HD1 PHE 136 4.875 12.526 0.877 1056 HE1 PHE 136 HE2 PHE 136 2.184 15.493 -1.978 1057 HE2 PHE 136 HE1 PHE 136 2.499 12.023 0.479 1058 HZ PHE 136 HZ PHE 136 1.150 13.508 -0.950 1059 H THR 137 H THR 137 6.776 16.074 2.976 1060 HA THR 137 HA THR 137 9.723 16.171 2.945 1061 HB THR 137 HB THR 137 7.756 17.257 4.966 1062 HG1 THR 137 HG1 THR 137 8.508 19.227 4.279 1063 HG21 THR 137 HG21 THR 137 10.378 18.233 5.405 1064 HG22 THR 137 HG22 THR 137 10.430 16.470 5.429 1065 HG23 THR 137 HG23 THR 137 9.332 17.335 6.504 1066 H LYS 138 H LYS 138 10.895 14.771 4.127 1067 HA LYS 138 HA LYS 138 9.762 12.303 4.861 1068 HB2 LYS 138 HB3 LYS 138 12.188 12.868 4.182 1069 HB3 LYS 138 HB2 LYS 138 12.416 13.273 5.878 1070 HG2 LYS 138 HG3 LYS 138 12.696 11.142 6.393 1071 HG3 LYS 138 HG2 LYS 138 11.132 10.730 5.689 1072 HD2 LYS 138 HD3 LYS 138 12.543 9.446 4.405 1073 HD3 LYS 138 HD2 LYS 138 12.441 10.913 3.431 1074 HE2 LYS 138 HE3 LYS 138 14.716 10.498 3.468 1075 HE3 LYS 138 HE2 LYS 138 14.518 11.664 4.776 1076 HZ1 LYS 138 HZ1 LYS 138 15.797 9.322 5.011 1077 HZ2 LYS 138 HZ2 LYS 138 14.258 8.897 5.570 1078 HZ3 LYS 138 HZ3 LYS 138 15.106 10.161 6.307 1079 H VAL 139 H VAL 139 8.627 11.811 6.593 1080 HA VAL 139 HA VAL 139 8.662 13.548 8.920 1081 HB VAL 139 HB VAL 139 7.051 11.026 8.767 1082 HG11 VAL 139 HG11 VAL 139 6.882 12.134 10.838 1083 HG12 VAL 139 HG12 VAL 139 5.411 12.549 9.957 1084 HG13 VAL 139 HG13 VAL 139 6.730 13.715 10.070 1085 HG21 VAL 139 HG21 VAL 139 6.705 13.466 7.107 1086 HG22 VAL 139 HG22 VAL 139 5.262 12.703 7.776 1087 HG23 VAL 139 HG23 VAL 139 6.345 11.781 6.733 1088 H SER 140 H SER 140 9.660 10.321 7.971 1089 HA SER 140 HA SER 140 11.367 10.143 10.289 1090 HB2 SER 140 HB3 SER 140 8.837 9.160 10.658 1091 HB3 SER 140 HB2 SER 140 9.704 7.722 10.119 1092 HG SER 140 HG SER 140 9.673 8.514 12.507 1093 H SER 141 H SER 141 12.746 8.210 10.241 1094 HA SER 141 HA SER 141 12.843 6.751 7.730 1095 HB2 SER 141 HB3 SER 141 14.953 7.477 7.025 1096 HB3 SER 141 HB2 SER 141 14.185 8.970 7.566 1097 HG SER 141 HG SER 141 15.268 8.572 9.622 1098 H ARG 142 H ARG 142 13.800 4.769 7.907 1099 HA ARG 142 HA ARG 142 15.335 4.116 10.293 1100 HB2 ARG 142 HB3 ARG 142 12.743 3.719 10.564 1101 HB3 ARG 142 HB2 ARG 142 13.075 2.280 9.610 1102 HG2 ARG 142 HG3 ARG 142 13.262 1.482 11.755 1103 HG3 ARG 142 HG2 ARG 142 14.941 1.863 11.368 1104 HD2 ARG 142 HD3 ARG 142 14.606 2.747 13.514 1105 HD3 ARG 142 HD2 ARG 142 14.496 4.135 12.432 1106 HE ARG 142 HE ARG 142 12.294 4.380 13.018 1107 HH11 ARG 142 HH11 ARG 142 13.411 1.250 14.081 1108 HH12 ARG 142 HH12 ARG 142 11.983 0.914 15.001 1109 HH21 ARG 142 HH21 ARG 142 10.415 3.941 14.229 1110 HH22 ARG 142 HH22 ARG 142 10.282 2.441 15.085 1111 H THR 143 H THR 143 16.749 2.427 10.009 1112 HA THR 143 HA THR 143 16.749 1.161 7.348 1113 HB THR 143 HB THR 143 19.235 1.736 8.950 1114 HG1 THR 143 HG1 THR 143 18.192 3.710 8.475 1115 HG21 THR 143 HG21 THR 143 19.337 1.772 6.035 1116 HG22 THR 143 HG22 THR 143 18.922 0.204 6.727 1117 HG23 THR 143 HG23 THR 143 20.415 1.013 7.205 1118 H VAL 144 H VAL 144 16.103 -0.876 7.646 1119 HA VAL 144 HA VAL 144 16.970 -2.332 10.034 1120 HB VAL 144 HB VAL 144 15.009 -3.243 7.926 1121 HG11 VAL 144 HG11 VAL 144 14.520 -5.027 9.274 1122 HG12 VAL 144 HG12 VAL 144 15.013 -4.192 10.747 1123 HG13 VAL 144 HG13 VAL 144 16.233 -4.824 9.641 1124 HG21 VAL 144 HG21 VAL 144 14.413 -1.094 9.177 1125 HG22 VAL 144 HG22 VAL 144 14.267 -2.114 10.608 1126 HG23 VAL 144 HG23 VAL 144 13.235 -2.405 9.208 1127 H GLU 145 H GLU 145 18.604 -3.724 9.949 1128 HA GLU 145 HA GLU 145 19.486 -4.681 7.309 1129 HB2 GLU 145 HB3 GLU 145 20.967 -4.020 9.829 1130 HB3 GLU 145 HB2 GLU 145 21.657 -5.161 8.683 1131 HG2 GLU 145 HG3 GLU 145 22.147 -3.564 7.178 1132 HG3 GLU 145 HG2 GLU 145 20.696 -2.628 7.537 1133 H ASP 146 H ASP 146 19.652 -6.818 6.908 1134 HA ASP 146 HA ASP 146 18.996 -8.655 9.118 1135 HB2 ASP 146 HB3 ASP 146 18.290 -8.877 6.184 1136 HB3 ASP 146 HB2 ASP 146 17.995 -10.135 7.379 1137 H THR 147 H THR 147 19.574 -11.048 8.153 1138 HA THR 147 HA THR 147 22.364 -11.225 8.306 1139 HB THR 147 HB THR 147 20.997 -13.104 8.935 1140 HG1 THR 147 HG1 THR 147 22.032 -14.739 7.716 1141 HG21 THR 147 HG21 THR 147 19.418 -12.557 6.792 1142 HG22 THR 147 HG22 THR 147 19.363 -14.040 7.746 1143 HG23 THR 147 HG23 THR 147 20.289 -13.990 6.246 1144 H ASN 148 H ASN 148 20.184 -11.178 5.540 1145 HA ASN 148 HA ASN 148 22.419 -11.474 3.691 1146 HB2 ASN 148 HB3 ASN 148 19.721 -12.228 3.606 1147 HB3 ASN 148 HB2 ASN 148 19.866 -10.924 2.431 1148 HD21 ASN 148 HD21 ASN 148 19.260 -12.878 1.090 1149 HD22 ASN 148 HD22 ASN 148 20.568 -13.782 0.415 1150 HA PRO 149 HA PRO 149 22.879 -7.098 3.147 1151 HB2 PRO 149 HB3 PRO 149 24.020 -7.099 0.667 1152 HB3 PRO 149 HB2 PRO 149 24.899 -7.503 2.145 1153 HG2 PRO 149 HG3 PRO 149 23.683 -9.325 0.105 1154 HG3 PRO 149 HG2 PRO 149 25.253 -9.447 0.921 1155 HD2 PRO 149 HD3 PRO 149 23.125 -10.916 1.684 1156 HD3 PRO 149 HD2 PRO 149 24.323 -10.318 2.850 1157 H ALA 150 H ALA 150 21.158 -9.102 0.881 1158 HA ALA 150 HA ALA 150 20.048 -6.857 -0.574 1159 HB1 ALA 150 HB1 ALA 150 20.271 -8.593 -2.034 1160 HB2 ALA 150 HB2 ALA 150 18.609 -8.866 -1.512 1161 HB3 ALA 150 HB3 ALA 150 19.921 -9.814 -0.811 1162 H LEU 151 H LEU 151 19.292 -8.645 2.242 1163 HA LEU 151 HA LEU 151 16.447 -8.163 2.119 1164 HB2 LEU 151 HB3 LEU 151 18.242 -9.310 4.247 1165 HB3 LEU 151 HB2 LEU 151 16.522 -9.069 4.483 1166 HG LEU 151 HG LEU 151 17.882 -10.969 2.587 1167 HD11 LEU 151 HD11 LEU 151 15.778 -11.418 4.696 1168 HD12 LEU 151 HD12 LEU 151 17.509 -11.652 4.943 1169 HD13 LEU 151 HD13 LEU 151 16.642 -12.647 3.771 1170 HD21 LEU 151 HD21 LEU 151 16.133 -9.946 1.302 1171 HD22 LEU 151 HD22 LEU 151 14.990 -10.121 2.633 1172 HD23 LEU 151 HD23 LEU 151 15.597 -11.552 1.799 1173 H THR 152 H THR 152 18.884 -6.096 2.567 1174 HA THR 152 HA THR 152 18.168 -4.750 4.961 1175 HB THR 152 HB THR 152 19.614 -3.691 2.525 1176 HG1 THR 152 HG1 THR 152 20.549 -5.547 3.639 1177 HG21 THR 152 HG21 THR 152 19.251 -1.753 3.660 1178 HG22 THR 152 HG22 THR 152 20.721 -2.308 4.461 1179 HG23 THR 152 HG23 THR 152 19.152 -2.557 5.226 1180 H HIS 153 H HIS 153 16.407 -3.574 5.342 1181 HA HIS 153 HA HIS 153 14.998 -2.383 3.042 1182 HB2 HIS 153 HB3 HIS 153 13.672 -2.958 5.675 1183 HB3 HIS 153 HB2 HIS 153 12.937 -2.756 4.089 1184 HD1 HIS 153 HD1 HIS 153 13.030 -5.268 6.315 1185 HD2 HIS 153 HD2 HIS 153 14.496 -5.066 2.436 1186 HE1 HIS 153 HE1 HIS 153 13.173 -7.650 5.527 1187 HE2 HIS 153 HE2 HIS 153 14.204 -7.508 3.233 1188 H THR 154 H THR 154 13.960 -0.348 3.357 1189 HA THR 154 HA THR 154 15.004 1.218 5.619 1190 HB THR 154 HB THR 154 14.699 2.386 2.863 1191 HG1 THR 154 HG1 THR 154 16.238 0.931 2.462 1192 HG21 THR 154 HG21 THR 154 16.138 3.211 5.355 1193 HG22 THR 154 HG22 THR 154 14.947 4.108 4.412 1194 HG23 THR 154 HG23 THR 154 16.570 3.854 3.771 1195 H TYR 155 H TYR 155 13.313 1.790 6.807 1196 HA TYR 155 HA TYR 155 10.710 2.209 5.562 1197 HB2 TYR 155 HB3 TYR 155 11.691 1.607 8.284 1198 HB3 TYR 155 HB2 TYR 155 10.293 2.673 8.210 1199 HD1 TYR 155 HD1 TYR 155 8.656 1.681 6.100 1200 HD2 TYR 155 HD2 TYR 155 11.032 -0.524 8.856 1201 HE1 TYR 155 HE1 TYR 155 7.184 -0.267 5.803 1202 HE2 TYR 155 HE2 TYR 155 9.566 -2.477 8.567 1203 HH TYR 155 HH TYR 155 7.993 -3.383 6.998 1204 H GLU 156 H GLU 156 10.356 4.178 4.749 1205 HA GLU 156 HA GLU 156 11.270 6.500 6.319 1206 HB2 GLU 156 HB3 GLU 156 11.029 6.212 3.322 1207 HB3 GLU 156 HB2 GLU 156 11.365 7.729 4.147 1208 HG2 GLU 156 HG3 GLU 156 13.470 6.993 4.876 1209 HG3 GLU 156 HG2 GLU 156 13.103 5.310 4.498 1210 H VAL 157 H VAL 157 9.872 8.164 6.667 1211 HA VAL 157 HA VAL 157 7.093 7.745 5.787 1212 HB VAL 157 HB VAL 157 7.965 9.345 8.195 1213 HG11 VAL 157 HG11 VAL 157 5.828 10.050 7.535 1214 HG12 VAL 157 HG12 VAL 157 5.530 8.875 8.816 1215 HG13 VAL 157 HG13 VAL 157 5.316 8.412 7.128 1216 HG21 VAL 157 HG21 VAL 157 6.670 6.687 8.496 1217 HG22 VAL 157 HG22 VAL 157 7.789 7.529 9.568 1218 HG23 VAL 157 HG23 VAL 157 8.392 6.731 8.116 1219 H TRP 158 H TRP 158 5.911 9.519 5.084 1220 HA TRP 158 HA TRP 158 7.289 12.072 4.758 1221 HB2 TRP 158 HB3 TRP 158 6.050 10.779 2.339 1222 HB3 TRP 158 HB2 TRP 158 7.040 12.227 2.405 1223 HD1 TRP 158 HD1 TRP 158 7.494 8.432 3.133 1224 HE1 TRP 158 HE1 TRP 158 9.871 7.781 2.386 1225 HE3 TRP 158 HE3 TRP 158 9.170 13.033 1.678 1226 HZ2 TRP 158 HZ2 TRP 158 12.157 9.054 1.318 1227 HZ3 TRP 158 HZ3 TRP 158 11.464 13.234 0.803 1228 HH2 TRP 158 HH2 TRP 158 12.924 11.285 0.629 1229 H GLN 159 H GLN 159 5.996 13.801 4.790 1230 HA GLN 159 HA GLN 159 3.099 13.406 4.497 1231 HB2 GLN 159 HB3 GLN 159 4.566 14.509 6.855 1232 HB3 GLN 159 HB2 GLN 159 3.009 15.207 6.430 1233 HG2 GLN 159 HG3 GLN 159 1.903 13.126 6.725 1234 HG3 GLN 159 HG2 GLN 159 3.434 12.266 6.876 1235 HE21 GLN 159 HE21 GLN 159 2.766 11.433 8.880 1236 HE22 GLN 159 HE22 GLN 159 2.775 12.403 10.309 1237 H LYS 160 H LYS 160 2.327 14.773 3.018 1238 HA LYS 160 HA LYS 160 3.825 16.731 1.760 1239 HB2 LYS 160 HB3 LYS 160 1.752 17.373 0.691 1240 HB3 LYS 160 HB2 LYS 160 1.837 15.627 0.809 1241 HG2 LYS 160 HG3 LYS 160 -0.271 15.836 1.543 1242 HG3 LYS 160 HG2 LYS 160 0.513 16.193 3.083 1243 HD2 LYS 160 HD3 LYS 160 0.004 18.408 2.984 1244 HD3 LYS 160 HD2 LYS 160 0.102 18.462 1.222 1245 HE2 LYS 160 HE3 LYS 160 -2.086 16.824 2.305 1246 HE3 LYS 160 HE2 LYS 160 -2.210 18.550 2.640 1247 HZ1 LYS 160 HZ1 LYS 160 -1.607 17.637 -0.090 1248 HZ2 LYS 160 HZ2 LYS 160 -2.365 19.061 0.419 1249 HZ3 LYS 160 HZ3 LYS 160 -3.203 17.593 0.471 1250 H LYS 161 H LYS 161 3.894 18.948 1.874 1251 HA LYS 161 HA LYS 161 3.459 20.086 4.473 1252 HB2 LYS 161 HB3 LYS 161 4.715 20.949 1.928 1253 HB3 LYS 161 HB2 LYS 161 4.122 22.225 2.983 1254 HG2 LYS 161 HG3 LYS 161 5.756 21.917 4.485 1255 HG3 LYS 161 HG2 LYS 161 5.703 20.160 4.334 1256 HD2 LYS 161 HD3 LYS 161 7.845 21.033 3.564 1257 HD3 LYS 161 HD2 LYS 161 6.948 20.307 2.229 1258 HE2 LYS 161 HE3 LYS 161 6.363 23.134 2.547 1259 HE3 LYS 161 HE2 LYS 161 8.079 22.834 2.277 1260 HZ1 LYS 161 HZ1 LYS 161 6.506 21.266 0.516 1261 HZ2 LYS 161 HZ2 LYS 161 7.686 22.421 0.150 1262 HZ3 LYS 161 HZ3 LYS 161 6.080 22.898 0.378 1263 H ALA 162 H ALA 162 1.976 21.606 5.101 1264 HA ALA 162 HA ALA 162 0.001 22.735 5.153 1265 HB1 ALA 162 HB1 ALA 162 -0.319 24.261 3.511 1266 HB2 ALA 162 HB2 ALA 162 -0.135 23.074 2.220 1267 HB3 ALA 162 HB3 ALA 162 1.291 23.726 3.028 1268 H51A NDP 170 H51A NDP 170 -5.469 -0.223 -9.161 1269 H52A NDP 170 H52A NDP 170 -5.883 -1.786 -8.450 1270 H4B NDP 170 H4B NDP 170 -7.233 -2.270 -10.555 1271 H3B NDP 170 H3B NDP 170 -6.536 0.604 -11.185 1272 HO3A NDP 170 HO3A NDP 170 -5.556 -1.106 -12.393 1273 H2B NDP 170 H2B NDP 170 -8.753 0.852 -12.059 1274 H1B NDP 170 H1B NDP 170 -10.033 -0.417 -9.970 1275 H8A NDP 170 H8A NDP 170 -6.971 1.534 -8.850 1276 H61A NDP 170 H61A NDP 170 -10.910 6.260 -8.028 1277 H62A NDP 170 H62A NDP 170 -9.279 5.689 -7.751 1278 H2A NDP 170 H2A NDP 170 -13.145 2.920 -10.014 1279 H51N NDP 170 H51N NDP 170 -1.225 -4.507 -7.997 1280 H52N NDP 170 H52N NDP 170 -0.366 -3.770 -9.360 1281 H4D NDP 170 H4D NDP 170 0.920 -5.904 -9.651 1282 H3D NDP 170 H3D NDP 170 -0.630 -6.800 -7.210 1283 HO3N NDP 170 HO3N NDP 170 0.368 -8.164 -9.517 1284 H2D NDP 170 H2D NDP 170 1.351 -7.973 -6.528 1285 HO2N NDP 170 HO2N NDP 170 2.204 -7.597 -9.195 1286 H1D NDP 170 H1D NDP 170 3.098 -5.908 -7.094 1287 H2N NDP 170 H2N NDP 170 3.613 -5.414 -4.817 1288 H71N NDP 170 H71N NDP 170 5.422 -4.754 -2.232 1289 H72N NDP 170 H72N NDP 170 4.979 -5.410 -3.788 1290 H41N NDP 170 H41N NDP 170 0.579 -3.919 -2.713 1291 H42N NDP 170 H42N NDP 170 0.559 -5.662 -2.273 1292 H5N NDP 170 H5N NDP 170 -1.259 -5.120 -3.885 1293 H6N NDP 170 H6N NDP 170 -0.517 -5.716 -6.200 Start of MODEL 5 1 H1 THR 1 HT1 THR 1 -5.376 8.447 5.675 2 H2 THR 1 HT2 THR 1 -6.238 9.667 4.829 3 H3 THR 1 HT3 THR 1 -4.680 10.000 5.468 4 HA THR 1 HA THR 1 -5.160 7.912 3.465 5 HB THR 1 HB THR 1 -4.372 9.643 1.822 6 HG1 THR 1 HG1 THR 1 -3.584 11.064 3.560 7 HG21 THR 1 HG21 THR 1 -6.708 11.060 2.589 8 HG22 THR 1 HG22 THR 1 -6.969 9.340 2.879 9 HG23 THR 1 HG23 THR 1 -6.492 9.902 1.276 10 H ALA 2 H ALA 2 -3.489 6.602 3.957 11 HA ALA 2 HA ALA 2 -0.807 7.809 3.992 12 HB1 ALA 2 HB1 ALA 2 -2.088 6.225 6.080 13 HB2 ALA 2 HB2 ALA 2 -0.665 7.263 6.154 14 HB3 ALA 2 HB3 ALA 2 -0.513 5.599 5.592 15 H PHE 3 H PHE 3 0.767 6.699 2.906 16 HA PHE 3 HA PHE 3 -0.150 4.398 1.324 17 HB2 PHE 3 HB3 PHE 3 1.874 6.558 0.866 18 HB3 PHE 3 HB2 PHE 3 2.067 5.014 0.046 19 HD1 PHE 3 HD1 PHE 3 -1.206 6.530 0.796 20 HD2 PHE 3 HD2 PHE 3 1.777 5.837 -2.159 21 HE1 PHE 3 HE1 PHE 3 -2.772 7.267 -0.952 22 HE2 PHE 3 HE2 PHE 3 0.217 6.573 -3.912 23 HZ PHE 3 HZ PHE 3 -2.061 7.289 -3.310 24 H LEU 4 H LEU 4 0.792 2.438 1.528 25 HA LEU 4 HA LEU 4 3.375 2.214 2.859 26 HB2 LEU 4 HB3 LEU 4 1.892 2.041 4.716 27 HB3 LEU 4 HB2 LEU 4 0.830 0.949 3.848 28 HG LEU 4 HG LEU 4 2.752 -0.712 3.839 29 HD11 LEU 4 HD11 LEU 4 3.896 1.455 5.533 30 HD12 LEU 4 HD12 LEU 4 4.682 0.418 4.342 31 HD13 LEU 4 HD13 LEU 4 4.258 -0.225 5.929 32 HD21 LEU 4 HD21 LEU 4 0.712 -0.374 5.534 33 HD22 LEU 4 HD22 LEU 4 2.055 -0.197 6.664 34 HD23 LEU 4 HD23 LEU 4 1.899 -1.668 5.703 35 H TRP 5 H TRP 5 4.572 1.042 1.501 36 HA TRP 5 HA TRP 5 3.686 -1.558 0.665 37 HB2 TRP 5 HB3 TRP 5 3.525 -1.264 -1.642 38 HB3 TRP 5 HB2 TRP 5 2.724 0.171 -1.015 39 HD1 TRP 5 HD1 TRP 5 5.779 -0.937 -2.980 40 HE1 TRP 5 HE1 TRP 5 6.941 1.134 -3.969 41 HE3 TRP 5 HE3 TRP 5 3.130 2.712 -0.568 42 HZ2 TRP 5 HZ2 TRP 5 6.765 3.939 -3.752 43 HZ3 TRP 5 HZ3 TRP 5 3.691 5.066 -1.020 44 HH2 TRP 5 HH2 TRP 5 5.469 5.665 -2.580 45 H ALA 6 H ALA 6 5.382 -2.792 -0.410 46 HA ALA 6 HA ALA 6 8.039 -1.840 0.401 47 HB1 ALA 6 HB1 ALA 6 7.651 -3.921 1.384 48 HB2 ALA 6 HB2 ALA 6 8.634 -4.306 -0.029 49 HB3 ALA 6 HB3 ALA 6 6.891 -4.572 -0.068 50 H GLN 7 H GLN 7 9.817 -1.925 -1.039 51 HA GLN 7 HA GLN 7 9.324 -2.654 -3.801 52 HB2 GLN 7 HB3 GLN 7 10.063 -0.402 -4.626 53 HB3 GLN 7 HB2 GLN 7 8.477 -0.427 -3.868 54 HG2 GLN 7 HG3 GLN 7 10.399 0.117 -1.856 55 HG3 GLN 7 HG2 GLN 7 10.727 1.173 -3.229 56 HE21 GLN 7 HE21 GLN 7 8.221 0.128 -0.982 57 HE22 GLN 7 HE22 GLN 7 7.286 1.577 -1.070 58 H ASP 8 H ASP 8 11.239 -2.512 -5.154 59 HA ASP 8 HA ASP 8 13.668 -3.035 -3.601 60 HB2 ASP 8 HB3 ASP 8 14.490 -4.196 -5.569 61 HB3 ASP 8 HB2 ASP 8 12.872 -4.775 -5.194 62 H ARG 9 H ARG 9 15.593 -2.576 -5.568 63 HA ARG 9 HA ARG 9 15.929 0.239 -5.344 64 HB2 ARG 9 HB3 ARG 9 17.435 -1.894 -6.851 65 HB3 ARG 9 HB2 ARG 9 17.901 -0.200 -6.903 66 HG2 ARG 9 HG3 ARG 9 17.653 -1.777 -4.355 67 HG3 ARG 9 HG2 ARG 9 19.157 -1.603 -5.260 68 HD2 ARG 9 HD3 ARG 9 17.543 0.748 -4.301 69 HD3 ARG 9 HD2 ARG 9 18.813 0.002 -3.332 70 HE ARG 9 HE ARG 9 19.855 0.609 -5.860 71 HH11 ARG 9 HH11 ARG 9 18.697 2.240 -2.999 72 HH12 ARG 9 HH12 ARG 9 19.705 3.629 -3.232 73 HH21 ARG 9 HH21 ARG 9 21.180 2.436 -6.167 74 HH22 ARG 9 HH22 ARG 9 21.114 3.741 -5.030 75 H ASP 10 H ASP 10 14.647 -1.869 -7.789 76 HA ASP 10 HA ASP 10 14.662 0.155 -9.858 77 HB2 ASP 10 HB3 ASP 10 14.860 -2.451 -10.105 78 HB3 ASP 10 HB2 ASP 10 13.101 -2.392 -10.057 79 H GLY 11 H GLY 11 12.868 -0.164 -7.176 80 HA2 GLY 11 HA3 GLY 11 10.958 1.045 -6.597 81 HA3 GLY 11 HA2 GLY 11 10.684 1.374 -8.301 82 H LEU 12 H LEU 12 11.199 -1.847 -8.164 83 HA LEU 12 HA LEU 12 8.703 -2.685 -8.894 84 HB2 LEU 12 HB3 LEU 12 10.916 -3.964 -8.857 85 HB3 LEU 12 HB2 LEU 12 10.546 -4.354 -7.191 86 HG LEU 12 HG LEU 12 8.497 -5.537 -7.935 87 HD11 LEU 12 HD11 LEU 12 9.532 -5.136 -10.734 88 HD12 LEU 12 HD12 LEU 12 8.231 -4.174 -10.034 89 HD13 LEU 12 HD13 LEU 12 8.031 -5.915 -10.232 90 HD21 LEU 12 HD21 LEU 12 9.627 -7.454 -8.348 91 HD22 LEU 12 HD22 LEU 12 11.002 -6.449 -7.884 92 HD23 LEU 12 HD23 LEU 12 10.644 -6.721 -9.590 93 H ILE 13 H ILE 13 7.307 -4.280 -7.609 94 HA ILE 13 HA ILE 13 7.084 -3.740 -4.780 95 HB ILE 13 HB ILE 13 4.779 -3.017 -4.815 96 HG12 ILE 13 HG13 ILE 13 4.615 -2.342 -7.658 97 HG13 ILE 13 HG12 ILE 13 4.658 -4.074 -7.362 98 HG21 ILE 13 HG21 ILE 13 6.501 -1.307 -6.597 99 HG22 ILE 13 HG22 ILE 13 6.467 -1.286 -4.834 100 HG23 ILE 13 HG23 ILE 13 5.050 -0.770 -5.751 101 HD11 ILE 13 HD11 ILE 13 2.740 -3.950 -5.953 102 HD12 ILE 13 HD12 ILE 13 2.379 -3.120 -7.467 103 HD13 ILE 13 HD13 ILE 13 2.754 -2.187 -6.016 104 H GLY 14 H GLY 14 5.972 -5.371 -7.682 105 HA2 GLY 14 HA3 GLY 14 5.505 -7.759 -6.078 106 HA3 GLY 14 HA2 GLY 14 4.161 -7.164 -7.040 107 H LYS 15 H LYS 15 4.733 -9.572 -7.645 108 HA LYS 15 HA LYS 15 6.268 -9.431 -10.146 109 HB2 LYS 15 HB3 LYS 15 7.149 -11.645 -9.794 110 HB3 LYS 15 HB2 LYS 15 7.539 -10.664 -8.388 111 HG2 LYS 15 HG3 LYS 15 6.521 -12.102 -7.045 112 HG3 LYS 15 HG2 LYS 15 5.027 -11.971 -7.973 113 HD2 LYS 15 HD3 LYS 15 6.564 -13.534 -9.601 114 HD3 LYS 15 HD2 LYS 15 7.086 -14.056 -7.999 115 HE2 LYS 15 HE3 LYS 15 5.189 -15.170 -7.659 116 HE3 LYS 15 HE2 LYS 15 4.212 -13.779 -8.128 117 HZ1 LYS 15 HZ1 LYS 15 3.644 -15.227 -9.763 118 HZ2 LYS 15 HZ2 LYS 15 5.128 -16.038 -9.743 119 HZ3 LYS 15 HZ3 LYS 15 4.997 -14.535 -10.507 120 H ASP 16 H ASP 16 3.678 -8.909 -10.278 121 HA ASP 16 HA ASP 16 1.836 -9.504 -11.505 122 HB2 ASP 16 HB3 ASP 16 3.683 -11.234 -12.496 123 HB3 ASP 16 HB2 ASP 16 2.529 -12.365 -11.794 124 H GLY 17 H GLY 17 2.140 -9.762 -8.625 125 HA2 GLY 17 HA3 GLY 17 -0.347 -10.841 -7.955 126 HA3 GLY 17 HA2 GLY 17 0.869 -12.066 -7.619 127 H HIS 18 H HIS 18 2.968 -10.593 -6.708 128 HA HIS 18 HA HIS 18 2.360 -8.591 -4.828 129 HB2 HIS 18 HB3 HIS 18 2.514 -9.835 -2.739 130 HB3 HIS 18 HB2 HIS 18 1.175 -10.455 -3.699 131 HD1 HIS 18 HD1 HIS 18 1.820 -12.457 -1.807 132 HD2 HIS 18 HD2 HIS 18 4.205 -12.021 -5.182 133 HE1 HIS 18 HE1 HIS 18 3.034 -14.645 -2.059 134 HE2 HIS 18 HE2 HIS 18 4.407 -14.386 -4.156 135 H LEU 19 H LEU 19 4.261 -8.893 -2.929 136 HA LEU 19 HA LEU 19 6.636 -8.370 -4.356 137 HB2 LEU 19 HB3 LEU 19 7.709 -8.467 -2.067 138 HB3 LEU 19 HB2 LEU 19 6.425 -7.295 -2.286 139 HG LEU 19 HG LEU 19 5.087 -9.518 -1.324 140 HD11 LEU 19 HD11 LEU 19 7.191 -10.624 -0.802 141 HD12 LEU 19 HD12 LEU 19 6.324 -10.193 0.672 142 HD13 LEU 19 HD13 LEU 19 7.703 -9.227 0.145 143 HD21 LEU 19 HD21 LEU 19 6.190 -7.326 0.411 144 HD22 LEU 19 HD22 LEU 19 4.656 -8.183 0.567 145 HD23 LEU 19 HD23 LEU 19 4.901 -7.049 -0.761 146 HA PRO 20 HA PRO 20 7.858 -12.657 -4.863 147 HB2 PRO 20 HB3 PRO 20 10.092 -12.207 -6.303 148 HB3 PRO 20 HB2 PRO 20 8.475 -12.039 -6.996 149 HG2 PRO 20 HG3 PRO 20 10.326 -9.921 -5.973 150 HG3 PRO 20 HG2 PRO 20 9.332 -9.923 -7.441 151 HD2 PRO 20 HD3 PRO 20 8.608 -8.639 -5.150 152 HD3 PRO 20 HD2 PRO 20 7.435 -9.301 -6.307 153 H TRP 21 H TRP 21 9.441 -10.237 -3.077 154 HA TRP 21 HA TRP 21 11.663 -11.966 -2.314 155 HB2 TRP 21 HB3 TRP 21 12.302 -9.939 -0.900 156 HB3 TRP 21 HB2 TRP 21 12.356 -9.734 -2.648 157 HD1 TRP 21 HD1 TRP 21 9.805 -9.051 0.204 158 HE1 TRP 21 HE1 TRP 21 8.598 -6.843 -0.332 159 HE3 TRP 21 HE3 TRP 21 11.990 -8.010 -4.296 160 HZ2 TRP 21 HZ2 TRP 21 8.575 -4.915 -2.396 161 HZ3 TRP 21 HZ3 TRP 21 11.316 -5.968 -5.491 162 HH2 TRP 21 HH2 TRP 21 9.644 -4.453 -4.560 163 H HIS 22 H HIS 22 11.959 -12.806 -0.283 164 HA HIS 22 HA HIS 22 9.560 -13.136 1.301 165 HB2 HIS 22 HB3 HIS 22 11.657 -14.791 0.725 166 HB3 HIS 22 HB2 HIS 22 12.083 -14.246 2.343 167 HD1 HIS 22 HD1 HIS 22 8.677 -15.172 0.922 168 HD2 HIS 22 HD2 HIS 22 11.298 -16.276 3.951 169 HE1 HIS 22 HE1 HIS 22 7.467 -16.933 2.248 170 HE2 HIS 22 HE2 HIS 22 9.037 -17.520 4.129 171 H LEU 23 H LEU 23 9.169 -11.175 2.290 172 HA LEU 23 HA LEU 23 11.226 -10.244 4.184 173 HB2 LEU 23 HB3 LEU 23 9.379 -8.835 2.382 174 HB3 LEU 23 HB2 LEU 23 9.454 -8.174 4.005 175 HG LEU 23 HG LEU 23 11.924 -7.992 3.761 176 HD11 LEU 23 HD11 LEU 23 11.855 -8.130 0.853 177 HD12 LEU 23 HD12 LEU 23 11.601 -9.690 1.637 178 HD13 LEU 23 HD13 LEU 23 13.050 -8.749 1.993 179 HD21 LEU 23 HD21 LEU 23 10.360 -6.109 3.329 180 HD22 LEU 23 HD22 LEU 23 10.391 -6.533 1.618 181 HD23 LEU 23 HD23 LEU 23 11.868 -6.004 2.422 182 HA PRO 24 HA PRO 24 7.874 -12.043 6.827 183 HB2 PRO 24 HB3 PRO 24 10.145 -12.139 8.719 184 HB3 PRO 24 HB2 PRO 24 9.005 -13.408 8.265 185 HG2 PRO 24 HG3 PRO 24 11.541 -13.450 7.414 186 HG3 PRO 24 HG2 PRO 24 10.208 -14.003 6.383 187 HD2 PRO 24 HD3 PRO 24 11.722 -11.424 6.306 188 HD3 PRO 24 HD2 PRO 24 11.127 -12.425 4.966 189 H ASP 25 H ASP 25 10.247 -9.522 7.362 190 HA ASP 25 HA ASP 25 9.119 -8.472 9.733 191 HB2 ASP 25 HB3 ASP 25 10.498 -6.443 9.088 192 HB3 ASP 25 HB2 ASP 25 11.385 -7.945 9.289 193 H ASP 26 H ASP 26 8.722 -7.702 6.298 194 HA ASP 26 HA ASP 26 7.120 -5.405 6.689 195 HB2 ASP 26 HB3 ASP 26 7.810 -7.162 4.403 196 HB3 ASP 26 HB2 ASP 26 6.335 -6.212 4.245 197 H LEU 27 H LEU 27 6.186 -8.729 5.757 198 HA LEU 27 HA LEU 27 3.442 -8.355 5.794 199 HB2 LEU 27 HB3 LEU 27 3.467 -10.873 6.449 200 HB3 LEU 27 HB2 LEU 27 4.039 -10.368 4.876 201 HG LEU 27 HG LEU 27 6.291 -10.346 6.583 202 HD11 LEU 27 HD11 LEU 27 4.377 -12.500 7.212 203 HD12 LEU 27 HD12 LEU 27 5.638 -11.769 8.204 204 HD13 LEU 27 HD13 LEU 27 6.060 -12.976 6.989 205 HD21 LEU 27 HD21 LEU 27 6.279 -10.819 4.183 206 HD22 LEU 27 HD22 LEU 27 5.435 -12.338 4.486 207 HD23 LEU 27 HD23 LEU 27 7.076 -12.106 5.086 208 H HIS 28 H HIS 28 5.605 -9.339 8.431 209 HA HIS 28 HA HIS 28 3.561 -9.624 10.375 210 HB2 HIS 28 HB3 HIS 28 5.756 -10.673 10.650 211 HB3 HIS 28 HB2 HIS 28 6.520 -9.089 10.725 212 HD1 HIS 28 HD1 HIS 28 3.351 -9.907 12.581 213 HD2 HIS 28 HD2 HIS 28 7.396 -9.333 13.336 214 HE1 HIS 28 HE1 HIS 28 3.559 -9.805 15.085 215 HE2 HIS 28 HE2 HIS 28 6.003 -9.365 15.515 216 H TYR 29 H TYR 29 5.455 -6.927 9.226 217 HA TYR 29 HA TYR 29 4.666 -5.160 11.361 218 HB2 TYR 29 HB3 TYR 29 6.832 -4.889 10.226 219 HB3 TYR 29 HB2 TYR 29 5.999 -4.562 8.711 220 HD1 TYR 29 HD1 TYR 29 6.827 -3.237 12.035 221 HD2 TYR 29 HD2 TYR 29 4.972 -2.420 8.295 222 HE1 TYR 29 HE1 TYR 29 6.773 -0.842 12.592 223 HE2 TYR 29 HE2 TYR 29 4.913 -0.023 8.841 224 HH TYR 29 HH TYR 29 6.680 1.433 10.928 225 H PHE 30 H PHE 30 3.433 -6.099 8.273 226 HA PHE 30 HA PHE 30 1.831 -3.793 7.786 227 HB2 PHE 30 HB3 PHE 30 2.476 -6.196 6.425 228 HB3 PHE 30 HB2 PHE 30 0.722 -6.134 6.552 229 HD1 PHE 30 HD2 PHE 30 3.701 -4.396 5.271 230 HD2 PHE 30 HD1 PHE 30 -0.551 -4.564 5.306 231 HE1 PHE 30 HE2 PHE 30 3.627 -2.828 3.377 232 HE2 PHE 30 HE1 PHE 30 -0.633 -2.998 3.411 233 HZ PHE 30 HZ PHE 30 1.458 -2.128 2.444 234 H ARG 31 H ARG 31 1.143 -7.017 9.108 235 HA ARG 31 HA ARG 31 -1.610 -6.480 9.600 236 HB2 ARG 31 HB3 ARG 31 0.304 -8.652 10.337 237 HB3 ARG 31 HB2 ARG 31 -1.229 -8.552 11.190 238 HG2 ARG 31 HG3 ARG 31 -1.218 -8.499 8.212 239 HG3 ARG 31 HG2 ARG 31 -0.981 -10.031 9.054 240 HD2 ARG 31 HD3 ARG 31 -3.334 -8.162 9.291 241 HD3 ARG 31 HD2 ARG 31 -3.316 -9.766 8.565 242 HE ARG 31 HE ARG 31 -3.213 -10.720 10.706 243 HH11 ARG 31 HH11 ARG 31 -3.345 -7.228 10.851 244 HH12 ARG 31 HH12 ARG 31 -3.831 -7.196 12.510 245 HH21 ARG 31 HH21 ARG 31 -3.850 -10.669 12.888 246 HH22 ARG 31 HH22 ARG 31 -4.116 -9.145 13.667 247 H ALA 32 H ALA 32 1.330 -6.189 11.493 248 HA ALA 32 HA ALA 32 0.087 -5.818 14.011 249 HB1 ALA 32 HB1 ALA 32 2.311 -6.413 14.176 250 HB2 ALA 32 HB2 ALA 32 2.365 -4.684 14.522 251 HB3 ALA 32 HB3 ALA 32 2.816 -5.278 12.924 252 H GLN 33 H GLN 33 0.965 -3.617 11.415 253 HA GLN 33 HA GLN 33 0.334 -1.275 12.995 254 HB2 GLN 33 HB3 GLN 33 1.750 -1.820 10.559 255 HB3 GLN 33 HB2 GLN 33 0.538 -0.582 10.261 256 HG2 GLN 33 HG3 GLN 33 2.242 -0.298 12.670 257 HG3 GLN 33 HG2 GLN 33 2.976 -0.001 11.096 258 HE21 GLN 33 HE21 GLN 33 2.317 1.755 9.885 259 HE22 GLN 33 HE22 GLN 33 1.357 3.032 10.542 260 H THR 34 H THR 34 -1.254 -3.351 10.708 261 HA THR 34 HA THR 34 -3.404 -1.464 10.223 262 HB THR 34 HB THR 34 -4.362 -3.326 8.861 263 HG1 THR 34 HG1 THR 34 -2.686 -5.049 8.496 264 HG21 THR 34 HG21 THR 34 -2.487 -3.451 7.186 265 HG22 THR 34 HG22 THR 34 -1.532 -2.490 8.315 266 HG23 THR 34 HG23 THR 34 -3.020 -1.831 7.635 267 H VAL 35 H VAL 35 -2.889 -2.554 12.966 268 HA VAL 35 HA VAL 35 -5.292 -4.139 13.446 269 HB VAL 35 HB VAL 35 -3.236 -3.237 15.465 270 HG11 VAL 35 HG11 VAL 35 -4.332 -4.466 17.008 271 HG12 VAL 35 HG12 VAL 35 -4.800 -5.705 15.843 272 HG13 VAL 35 HG13 VAL 35 -5.711 -4.198 15.941 273 HG21 VAL 35 HG21 VAL 35 -2.050 -4.551 13.886 274 HG22 VAL 35 HG22 VAL 35 -3.362 -5.724 13.774 275 HG23 VAL 35 HG23 VAL 35 -2.404 -5.610 15.251 276 H GLY 36 H GLY 36 -6.886 -2.577 13.044 277 HA2 GLY 36 HA3 GLY 36 -8.467 -1.347 14.445 278 HA3 GLY 36 HA2 GLY 36 -7.088 -0.517 15.151 279 H LYS 37 H LYS 37 -6.890 -1.029 11.774 280 HA LYS 37 HA LYS 37 -7.927 1.669 11.236 281 HB2 LYS 37 HB3 LYS 37 -5.320 0.540 10.200 282 HB3 LYS 37 HB2 LYS 37 -6.016 2.087 9.737 283 HG2 LYS 37 HG3 LYS 37 -5.952 2.448 12.374 284 HG3 LYS 37 HG2 LYS 37 -4.624 1.296 12.223 285 HD2 LYS 37 HD3 LYS 37 -3.302 2.763 11.108 286 HD3 LYS 37 HD2 LYS 37 -4.662 3.523 10.279 287 HE2 LYS 37 HE3 LYS 37 -3.837 3.945 13.150 288 HE3 LYS 37 HE2 LYS 37 -3.641 5.089 11.823 289 HZ1 LYS 37 HZ1 LYS 37 -6.214 4.768 11.644 290 HZ2 LYS 37 HZ2 LYS 37 -5.557 5.850 12.766 291 HZ3 LYS 37 HZ3 LYS 37 -6.071 4.319 13.269 292 H ILE 38 H ILE 38 -7.692 1.929 8.630 293 HA ILE 38 HA ILE 38 -9.012 -0.453 7.501 294 HB ILE 38 HB ILE 38 -9.528 2.073 6.100 295 HG12 ILE 38 HG13 ILE 38 -10.906 1.682 8.758 296 HG13 ILE 38 HG12 ILE 38 -9.510 2.739 8.572 297 HG21 ILE 38 HG21 ILE 38 -11.931 0.999 6.628 298 HG22 ILE 38 HG22 ILE 38 -10.912 -0.427 6.824 299 HG23 ILE 38 HG23 ILE 38 -10.894 0.467 5.304 300 HD11 ILE 38 HD11 ILE 38 -11.735 3.161 6.686 301 HD12 ILE 38 HD12 ILE 38 -10.686 4.327 7.492 302 HD13 ILE 38 HD13 ILE 38 -12.025 3.590 8.372 303 H MET 39 H MET 39 -8.405 -1.164 5.490 304 HA MET 39 HA MET 39 -6.143 0.251 4.233 305 HB2 MET 39 HB3 MET 39 -5.332 -1.751 5.347 306 HB3 MET 39 HB2 MET 39 -6.542 -2.730 4.532 307 HG2 MET 39 HG3 MET 39 -5.363 -1.750 2.379 308 HG3 MET 39 HG2 MET 39 -4.012 -1.582 3.498 309 HE1 MET 39 HE1 MET 39 -6.803 -3.858 2.350 310 HE2 MET 39 HE2 MET 39 -6.614 -4.742 3.866 311 HE3 MET 39 HE3 MET 39 -6.119 -5.484 2.343 312 H VAL 40 H VAL 40 -6.305 0.670 2.123 313 HA VAL 40 HA VAL 40 -8.650 -0.368 0.684 314 HB VAL 40 HB VAL 40 -6.899 1.968 -0.092 315 HG11 VAL 40 HG11 VAL 40 -9.224 0.631 -1.274 316 HG12 VAL 40 HG12 VAL 40 -8.000 1.657 -2.022 317 HG13 VAL 40 HG13 VAL 40 -9.363 2.386 -1.173 318 HG21 VAL 40 HG21 VAL 40 -7.956 2.385 2.077 319 HG22 VAL 40 HG22 VAL 40 -9.531 1.995 1.386 320 HG23 VAL 40 HG23 VAL 40 -8.646 3.411 0.819 321 H VAL 41 H VAL 41 -8.416 -1.728 -0.973 322 HA VAL 41 HA VAL 41 -5.708 -2.106 -2.068 323 HB VAL 41 HB VAL 41 -7.045 -3.953 -0.618 324 HG11 VAL 41 HG11 VAL 41 -8.166 -5.543 -1.883 325 HG12 VAL 41 HG12 VAL 41 -7.525 -4.928 -3.407 326 HG13 VAL 41 HG13 VAL 41 -8.757 -4.015 -2.535 327 HG21 VAL 41 HG21 VAL 41 -4.851 -3.965 -2.537 328 HG22 VAL 41 HG22 VAL 41 -5.584 -5.550 -2.290 329 HG23 VAL 41 HG23 VAL 41 -4.946 -4.649 -0.915 330 H GLY 42 H GLY 42 -5.690 -3.119 -4.279 331 HA2 GLY 42 HA3 GLY 42 -7.652 -1.727 -5.955 332 HA3 GLY 42 HA2 GLY 42 -6.097 -2.350 -6.484 333 H ARG 43 H ARG 43 -8.250 -2.845 -8.054 334 HA ARG 43 HA ARG 43 -9.780 -5.096 -7.554 335 HB2 ARG 43 HB3 ARG 43 -10.284 -3.766 -9.463 336 HB3 ARG 43 HB2 ARG 43 -8.676 -3.996 -10.133 337 HG2 ARG 43 HG3 ARG 43 -9.283 -5.855 -11.186 338 HG3 ARG 43 HG2 ARG 43 -10.029 -6.521 -9.733 339 HD2 ARG 43 HD3 ARG 43 -11.633 -6.235 -11.581 340 HD3 ARG 43 HD2 ARG 43 -12.055 -5.289 -10.158 341 HE ARG 43 HE ARG 43 -11.341 -3.321 -11.303 342 HH11 ARG 43 HH11 ARG 43 -11.430 -6.181 -13.320 343 HH12 ARG 43 HH12 ARG 43 -11.499 -5.283 -14.796 344 HH21 ARG 43 HH21 ARG 43 -11.433 -2.154 -13.252 345 HH22 ARG 43 HH22 ARG 43 -11.500 -3.003 -14.760 346 H ARG 44 H ARG 44 -6.794 -5.034 -9.507 347 HA ARG 44 HA ARG 44 -6.502 -7.829 -9.609 348 HB2 ARG 44 HB3 ARG 44 -4.515 -5.587 -9.972 349 HB3 ARG 44 HB2 ARG 44 -4.101 -7.278 -10.217 350 HG2 ARG 44 HG3 ARG 44 -6.255 -5.795 -11.709 351 HG3 ARG 44 HG2 ARG 44 -4.626 -6.105 -12.312 352 HD2 ARG 44 HD3 ARG 44 -5.471 -7.979 -13.182 353 HD3 ARG 44 HD2 ARG 44 -5.477 -8.599 -11.531 354 HE ARG 44 HE ARG 44 -7.846 -7.196 -11.885 355 HH11 ARG 44 HH11 ARG 44 -6.293 -10.028 -13.206 356 HH12 ARG 44 HH12 ARG 44 -7.784 -10.827 -13.574 357 HH21 ARG 44 HH21 ARG 44 -9.808 -8.245 -12.368 358 HH22 ARG 44 HH22 ARG 44 -9.780 -9.815 -13.099 359 H THR 45 H THR 45 -5.913 -5.591 -7.101 360 HA THR 45 HA THR 45 -3.873 -7.085 -5.757 361 HB THR 45 HB THR 45 -5.528 -5.185 -4.213 362 HG1 THR 45 HG1 THR 45 -4.120 -4.457 -6.545 363 HG21 THR 45 HG21 THR 45 -3.593 -5.708 -3.092 364 HG22 THR 45 HG22 THR 45 -3.148 -4.210 -3.908 365 HG23 THR 45 HG23 THR 45 -2.627 -5.761 -4.566 366 H TYR 46 H TYR 46 -7.344 -6.493 -5.059 367 HA TYR 46 HA TYR 46 -7.565 -8.092 -2.823 368 HB2 TYR 46 HB3 TYR 46 -9.921 -8.156 -3.180 369 HB3 TYR 46 HB2 TYR 46 -9.365 -6.604 -3.790 370 HD1 TYR 46 HD2 TYR 46 -9.953 -10.078 -5.071 371 HD2 TYR 46 HD1 TYR 46 -10.258 -5.895 -5.799 372 HE1 TYR 46 HE2 TYR 46 -11.027 -10.538 -7.221 373 HE2 TYR 46 HE1 TYR 46 -11.349 -6.352 -7.952 374 HH TYR 46 HH TYR 46 -11.535 -8.121 -9.587 375 H GLU 47 H GLU 47 -7.682 -9.048 -6.220 376 HA GLU 47 HA GLU 47 -8.194 -11.814 -5.601 377 HB2 GLU 47 HB3 GLU 47 -8.242 -10.159 -7.925 378 HB3 GLU 47 HB2 GLU 47 -7.177 -11.520 -8.246 379 HG2 GLU 47 HG3 GLU 47 -9.795 -12.099 -6.994 380 HG3 GLU 47 HG2 GLU 47 -9.787 -11.610 -8.687 381 H SER 48 H SER 48 -5.445 -9.786 -5.972 382 HA SER 48 HA SER 48 -3.654 -12.112 -6.122 383 HB2 SER 48 HB3 SER 48 -3.045 -9.177 -6.550 384 HB3 SER 48 HB2 SER 48 -1.888 -10.497 -6.717 385 HG SER 48 HG SER 48 -2.747 -11.031 -8.580 386 H PHE 49 H PHE 49 -5.121 -11.041 -3.695 387 HA PHE 49 HA PHE 49 -2.842 -10.286 -2.016 388 HB2 PHE 49 HB3 PHE 49 -5.286 -9.188 -2.075 389 HB3 PHE 49 HB2 PHE 49 -5.584 -10.446 -0.880 390 HD1 PHE 49 HD1 PHE 49 -3.057 -7.809 -1.655 391 HD2 PHE 49 HD2 PHE 49 -5.224 -9.940 1.325 392 HE1 PHE 49 HE1 PHE 49 -2.050 -6.393 0.086 393 HE2 PHE 49 HE2 PHE 49 -4.222 -8.527 3.070 394 HZ PHE 49 HZ PHE 49 -2.632 -6.750 2.452 395 HA PRO 50 HA PRO 50 -2.767 -14.467 -0.481 396 HB2 PRO 50 HB3 PRO 50 -0.805 -14.200 1.318 397 HB3 PRO 50 HB2 PRO 50 -0.483 -14.104 -0.418 398 HG2 PRO 50 HG3 PRO 50 -0.766 -11.898 1.583 399 HG3 PRO 50 HG2 PRO 50 0.402 -12.067 0.260 400 HD2 PRO 50 HD3 PRO 50 -1.879 -10.529 0.132 401 HD3 PRO 50 HD2 PRO 50 -1.047 -11.205 -1.282 402 H LYS 51 H LYS 51 -3.158 -11.698 1.663 403 HA LYS 51 HA LYS 51 -4.529 -13.464 3.585 404 HB2 LYS 51 HB3 LYS 51 -2.322 -12.287 4.278 405 HB3 LYS 51 HB2 LYS 51 -3.309 -10.835 4.367 406 HG2 LYS 51 HG3 LYS 51 -3.344 -11.607 6.539 407 HG3 LYS 51 HG2 LYS 51 -4.847 -12.258 5.881 408 HD2 LYS 51 HD3 LYS 51 -4.067 -14.174 6.806 409 HD3 LYS 51 HD2 LYS 51 -3.188 -14.278 5.279 410 HE2 LYS 51 HE3 LYS 51 -1.196 -13.914 6.258 411 HE3 LYS 51 HE2 LYS 51 -1.848 -12.706 7.365 412 HZ1 LYS 51 HZ1 LYS 51 -2.950 -14.932 8.332 413 HZ2 LYS 51 HZ2 LYS 51 -1.475 -14.307 8.875 414 HZ3 LYS 51 HZ3 LYS 51 -1.495 -15.559 7.738 415 H ARG 52 H ARG 52 -6.302 -12.910 1.936 416 HA ARG 52 HA ARG 52 -7.643 -10.437 2.807 417 HB2 ARG 52 HB3 ARG 52 -8.763 -10.412 0.589 418 HB3 ARG 52 HB2 ARG 52 -7.019 -10.208 0.489 419 HG2 ARG 52 HG3 ARG 52 -6.796 -12.009 -0.788 420 HG3 ARG 52 HG2 ARG 52 -7.765 -12.994 0.308 421 HD2 ARG 52 HD3 ARG 52 -8.967 -11.049 -1.649 422 HD3 ARG 52 HD2 ARG 52 -8.654 -12.738 -2.046 423 HE ARG 52 HE ARG 52 -10.809 -11.718 -0.489 424 HH11 ARG 52 HH11 ARG 52 -8.682 -14.462 -0.840 425 HH12 ARG 52 HH12 ARG 52 -9.805 -15.581 -0.145 426 HH21 ARG 52 HH21 ARG 52 -12.289 -13.189 0.425 427 HH22 ARG 52 HH22 ARG 52 -11.854 -14.859 0.573 428 HA PRO 53 HA PRO 53 -9.196 -9.631 3.499 429 HB2 PRO 53 HB3 PRO 53 -11.009 -9.774 5.668 430 HB3 PRO 53 HB2 PRO 53 -11.336 -9.152 4.051 431 HG2 PRO 53 HG3 PRO 53 -12.459 -11.446 5.189 432 HG3 PRO 53 HG2 PRO 53 -12.486 -11.013 3.472 433 HD2 PRO 53 HD3 PRO 53 -10.708 -12.916 4.923 434 HD3 PRO 53 HD2 PRO 53 -11.345 -12.999 3.266 435 H LEU 54 H LEU 54 -8.145 -8.536 5.194 436 HA LEU 54 HA LEU 54 -6.454 -10.153 6.813 437 HB2 LEU 54 HB3 LEU 54 -6.896 -7.191 6.590 438 HB3 LEU 54 HB2 LEU 54 -5.814 -7.866 7.794 439 HG LEU 54 HG LEU 54 -5.440 -8.618 4.927 440 HD11 LEU 54 HD11 LEU 54 -4.233 -6.695 4.396 441 HD12 LEU 54 HD12 LEU 54 -4.169 -6.159 6.076 442 HD13 LEU 54 HD13 LEU 54 -5.689 -6.085 5.183 443 HD21 LEU 54 HD21 LEU 54 -4.177 -9.681 6.809 444 HD22 LEU 54 HD22 LEU 54 -3.448 -8.107 7.125 445 HD23 LEU 54 HD23 LEU 54 -3.170 -8.914 5.582 446 HA PRO 55 HA PRO 55 -9.161 -10.521 10.322 447 HB2 PRO 55 HB3 PRO 55 -6.825 -11.255 11.913 448 HB3 PRO 55 HB2 PRO 55 -8.197 -12.249 11.421 449 HG2 PRO 55 HG3 PRO 55 -5.704 -12.595 10.422 450 HG3 PRO 55 HG2 PRO 55 -7.171 -12.943 9.490 451 HD2 PRO 55 HD3 PRO 55 -5.366 -10.557 9.367 452 HD3 PRO 55 HD2 PRO 55 -6.152 -11.450 8.046 453 H GLU 56 H GLU 56 -9.584 -9.600 12.342 454 HA GLU 56 HA GLU 56 -9.776 -7.821 13.744 455 HB2 GLU 56 HB3 GLU 56 -6.925 -8.653 13.840 456 HB3 GLU 56 HB2 GLU 56 -7.359 -7.154 14.651 457 HG2 GLU 56 HG3 GLU 56 -9.040 -9.533 15.186 458 HG3 GLU 56 HG2 GLU 56 -7.415 -9.505 15.870 459 H ARG 57 H ARG 57 -9.449 -7.127 10.886 460 HA ARG 57 HA ARG 57 -8.910 -4.314 11.318 461 HB2 ARG 57 HB3 ARG 57 -7.197 -4.023 9.771 462 HB3 ARG 57 HB2 ARG 57 -6.736 -5.501 10.596 463 HG2 ARG 57 HG3 ARG 57 -6.351 -6.063 8.410 464 HG3 ARG 57 HG2 ARG 57 -7.990 -6.670 8.637 465 HD2 ARG 57 HD3 ARG 57 -7.398 -5.262 6.523 466 HD3 ARG 57 HD2 ARG 57 -8.929 -5.008 7.352 467 HE ARG 57 HE ARG 57 -8.212 -2.917 7.996 468 HH11 ARG 57 HH11 ARG 57 -5.537 -4.702 6.641 469 HH12 ARG 57 HH12 ARG 57 -4.492 -3.324 6.573 470 HH21 ARG 57 HH21 ARG 57 -6.836 -1.108 7.914 471 HH22 ARG 57 HH22 ARG 57 -5.227 -1.284 7.298 472 H THR 58 H THR 58 -9.565 -2.972 9.450 473 HA THR 58 HA THR 58 -11.852 -4.217 8.096 474 HB THR 58 HB THR 58 -11.209 -1.299 8.573 475 HG1 THR 58 HG1 THR 58 -13.037 -1.473 9.975 476 HG21 THR 58 HG21 THR 58 -12.810 -2.249 6.574 477 HG22 THR 58 HG22 THR 58 -12.941 -0.662 7.331 478 HG23 THR 58 HG23 THR 58 -13.953 -1.993 7.892 479 H ASN 59 H ASN 59 -11.503 -4.851 6.082 480 HA ASN 59 HA ASN 59 -9.381 -3.605 4.519 481 HB2 ASN 59 HB3 ASN 59 -11.057 -6.067 3.998 482 HB3 ASN 59 HB2 ASN 59 -9.769 -5.491 2.944 483 HD21 ASN 59 HD21 ASN 59 -10.458 -6.601 6.213 484 HD22 ASN 59 HD22 ASN 59 -8.893 -7.267 6.514 485 H VAL 60 H VAL 60 -9.704 -2.961 2.331 486 HA VAL 60 HA VAL 60 -12.461 -2.330 1.569 487 HB VAL 60 HB VAL 60 -10.196 -0.350 1.769 488 HG11 VAL 60 HG11 VAL 60 -10.922 0.433 -0.215 489 HG12 VAL 60 HG12 VAL 60 -12.214 1.130 0.763 490 HG13 VAL 60 HG13 VAL 60 -12.477 -0.390 -0.093 491 HG21 VAL 60 HG21 VAL 60 -11.393 0.674 3.389 492 HG22 VAL 60 HG22 VAL 60 -12.067 -0.944 3.589 493 HG23 VAL 60 HG23 VAL 60 -12.944 0.268 2.654 494 H VAL 61 H VAL 61 -12.863 -2.636 -0.550 495 HA VAL 61 HA VAL 61 -10.573 -3.323 -2.266 496 HB VAL 61 HB VAL 61 -13.447 -4.241 -2.395 497 HG11 VAL 61 HG11 VAL 61 -13.172 -4.601 -4.569 498 HG12 VAL 61 HG12 VAL 61 -11.902 -5.758 -4.170 499 HG13 VAL 61 HG13 VAL 61 -11.490 -4.075 -4.497 500 HG21 VAL 61 HG21 VAL 61 -11.010 -5.964 -2.108 501 HG22 VAL 61 HG22 VAL 61 -12.691 -6.344 -1.730 502 HG23 VAL 61 HG23 VAL 61 -11.787 -5.229 -0.705 503 H LEU 62 H LEU 62 -10.331 -2.404 -4.249 504 HA LEU 62 HA LEU 62 -12.289 -0.344 -5.022 505 HB2 LEU 62 HB3 LEU 62 -9.970 0.401 -4.116 506 HB3 LEU 62 HB2 LEU 62 -9.370 -0.130 -5.676 507 HG LEU 62 HG LEU 62 -11.045 1.445 -6.735 508 HD11 LEU 62 HD11 LEU 62 -11.211 3.228 -4.506 509 HD12 LEU 62 HD12 LEU 62 -11.922 1.673 -4.073 510 HD13 LEU 62 HD13 LEU 62 -12.509 2.547 -5.489 511 HD21 LEU 62 HD21 LEU 62 -9.666 3.464 -6.225 512 HD22 LEU 62 HD22 LEU 62 -8.734 2.041 -6.694 513 HD23 LEU 62 HD23 LEU 62 -8.831 2.513 -4.997 514 H THR 63 H THR 63 -13.369 -1.378 -6.609 515 HA THR 63 HA THR 63 -11.797 -2.274 -8.924 516 HB THR 63 HB THR 63 -12.489 -4.326 -8.020 517 HG1 THR 63 HG1 THR 63 -13.302 -3.778 -10.266 518 HG21 THR 63 HG21 THR 63 -15.321 -3.423 -7.668 519 HG22 THR 63 HG22 THR 63 -14.123 -3.242 -6.387 520 HG23 THR 63 HG23 THR 63 -14.514 -4.845 -7.006 521 H HIS 64 H HIS 64 -12.795 -1.987 -10.964 522 HA HIS 64 HA HIS 64 -14.477 0.319 -11.118 523 HB2 HIS 64 HB3 HIS 64 -13.333 -1.566 -13.169 524 HB3 HIS 64 HB2 HIS 64 -14.457 -0.289 -13.620 525 HD1 HIS 64 HD1 HIS 64 -13.545 2.069 -13.778 526 HD2 HIS 64 HD2 HIS 64 -10.810 -0.634 -12.204 527 HE1 HIS 64 HE1 HIS 64 -11.354 3.299 -13.701 528 HE2 HIS 64 HE2 HIS 64 -9.734 1.673 -12.661 529 H GLN 65 H GLN 65 -14.964 -3.131 -11.346 530 HA GLN 65 HA GLN 65 -17.394 -3.293 -12.635 531 HB2 GLN 65 HB3 GLN 65 -16.031 -4.937 -10.562 532 HB3 GLN 65 HB2 GLN 65 -17.731 -5.263 -10.873 533 HG2 GLN 65 HG3 GLN 65 -17.324 -6.187 -12.877 534 HG3 GLN 65 HG2 GLN 65 -16.046 -5.037 -13.267 535 HE21 GLN 65 HE21 GLN 65 -13.952 -5.384 -12.312 536 HE22 GLN 65 HE22 GLN 65 -13.440 -6.989 -11.930 537 H GLU 66 H GLU 66 -19.415 -2.716 -12.197 538 HA GLU 66 HA GLU 66 -19.968 -1.288 -9.746 539 HB2 GLU 66 HB3 GLU 66 -22.131 -0.778 -10.778 540 HB3 GLU 66 HB2 GLU 66 -20.804 -0.414 -11.872 541 HG2 GLU 66 HG3 GLU 66 -21.213 -2.504 -13.066 542 HG3 GLU 66 HG2 GLU 66 -22.546 -2.866 -11.970 543 H ASP 67 H ASP 67 -20.765 -4.354 -11.223 544 HA ASP 67 HA ASP 67 -22.605 -5.006 -9.051 545 HB2 ASP 67 HB3 ASP 67 -21.944 -6.365 -11.660 546 HB3 ASP 67 HB2 ASP 67 -22.940 -7.128 -10.423 547 H TYR 68 H TYR 68 -19.555 -4.849 -8.823 548 HA TYR 68 HA TYR 68 -18.761 -7.572 -8.331 549 HB2 TYR 68 HB3 TYR 68 -17.148 -5.804 -9.040 550 HB3 TYR 68 HB2 TYR 68 -17.370 -5.025 -7.477 551 HD1 TYR 68 HD1 TYR 68 -15.963 -7.943 -9.211 552 HD2 TYR 68 HD2 TYR 68 -16.377 -5.943 -5.479 553 HE1 TYR 68 HE1 TYR 68 -14.203 -9.371 -8.256 554 HE2 TYR 68 HE2 TYR 68 -14.616 -7.363 -4.517 555 HH TYR 68 HH TYR 68 -13.475 -10.164 -6.040 556 H GLN 69 H GLN 69 -18.509 -8.596 -6.365 557 HA GLN 69 HA GLN 69 -19.590 -7.186 -4.016 558 HB2 GLN 69 HB3 GLN 69 -20.041 -10.108 -4.628 559 HB3 GLN 69 HB2 GLN 69 -20.756 -9.170 -3.324 560 HG2 GLN 69 HG3 GLN 69 -21.257 -8.735 -6.259 561 HG3 GLN 69 HG2 GLN 69 -22.330 -9.586 -5.149 562 HE21 GLN 69 HE21 GLN 69 -21.725 -6.697 -6.613 563 HE22 GLN 69 HE22 GLN 69 -22.599 -5.650 -5.552 564 H ALA 70 H ALA 70 -17.937 -6.896 -2.678 565 HA ALA 70 HA ALA 70 -15.912 -9.004 -2.411 566 HB1 ALA 70 HB1 ALA 70 -15.332 -6.538 -2.903 567 HB2 ALA 70 HB2 ALA 70 -14.403 -7.394 -1.673 568 HB3 ALA 70 HB3 ALA 70 -15.680 -6.275 -1.195 569 H GLN 71 H GLN 71 -16.837 -10.442 -1.016 570 HA GLN 71 HA GLN 71 -18.257 -9.676 1.326 571 HB2 GLN 71 HB3 GLN 71 -16.973 -12.351 0.771 572 HB3 GLN 71 HB2 GLN 71 -18.314 -12.017 1.858 573 HG2 GLN 71 HG3 GLN 71 -19.815 -12.153 0.224 574 HG3 GLN 71 HG2 GLN 71 -18.845 -11.165 -0.867 575 HE21 GLN 71 HE21 GLN 71 -18.068 -12.137 -2.594 576 HE22 GLN 71 HE22 GLN 71 -17.856 -13.840 -2.796 577 H GLY 72 H GLY 72 -17.484 -9.032 3.217 578 HA2 GLY 72 HA3 GLY 72 -16.063 -9.373 5.116 579 HA3 GLY 72 HA2 GLY 72 -14.809 -9.943 4.028 580 H ALA 73 H ALA 73 -15.317 -7.625 2.158 581 HA ALA 73 HA ALA 73 -14.166 -5.492 3.831 582 HB1 ALA 73 HB1 ALA 73 -12.307 -5.384 2.607 583 HB2 ALA 73 HB2 ALA 73 -13.203 -5.474 1.091 584 HB3 ALA 73 HB3 ALA 73 -12.771 -6.953 1.950 585 H VAL 74 H VAL 74 -14.189 -3.337 2.618 586 HA VAL 74 HA VAL 74 -16.901 -2.870 1.731 587 HB VAL 74 HB VAL 74 -14.737 -0.782 1.755 588 HG11 VAL 74 HG11 VAL 74 -17.529 -0.318 2.648 589 HG12 VAL 74 HG12 VAL 74 -17.245 -0.570 0.926 590 HG13 VAL 74 HG13 VAL 74 -16.427 0.744 1.771 591 HG21 VAL 74 HG21 VAL 74 -15.937 -2.191 4.059 592 HG22 VAL 74 HG22 VAL 74 -15.854 -0.433 4.172 593 HG23 VAL 74 HG23 VAL 74 -14.383 -1.370 3.913 594 H VAL 75 H VAL 75 -17.553 -2.144 -0.273 595 HA VAL 75 HA VAL 75 -15.550 -2.421 -2.417 596 HB VAL 75 HB VAL 75 -18.521 -2.897 -2.639 597 HG11 VAL 75 HG11 VAL 75 -17.431 -4.180 -4.730 598 HG12 VAL 75 HG12 VAL 75 -16.282 -2.853 -4.563 599 HG13 VAL 75 HG13 VAL 75 -17.995 -2.511 -4.804 600 HG21 VAL 75 HG21 VAL 75 -16.743 -5.182 -2.981 601 HG22 VAL 75 HG22 VAL 75 -18.237 -5.036 -2.056 602 HG23 VAL 75 HG23 VAL 75 -16.709 -4.509 -1.351 603 H VAL 76 H VAL 76 -15.302 -0.885 -3.887 604 HA VAL 76 HA VAL 76 -17.271 1.145 -4.401 605 HB VAL 76 HB VAL 76 -15.883 3.066 -3.840 606 HG11 VAL 76 HG11 VAL 76 -16.181 3.063 -1.482 607 HG12 VAL 76 HG12 VAL 76 -16.085 1.303 -1.409 608 HG13 VAL 76 HG13 VAL 76 -17.474 2.080 -2.169 609 HG21 VAL 76 HG21 VAL 76 -13.687 2.813 -3.661 610 HG22 VAL 76 HG22 VAL 76 -13.841 1.061 -3.535 611 HG23 VAL 76 HG23 VAL 76 -13.951 2.061 -2.087 612 H HIS 77 H HIS 77 -16.585 2.553 -6.219 613 HA HIS 77 HA HIS 77 -14.443 1.283 -7.795 614 HB2 HIS 77 HB3 HIS 77 -16.667 2.550 -9.282 615 HB3 HIS 77 HB2 HIS 77 -15.749 1.093 -9.646 616 HD1 HIS 77 HD1 HIS 77 -16.364 -0.810 -7.504 617 HD2 HIS 77 HD2 HIS 77 -19.239 1.839 -8.915 618 HE1 HIS 77 HE1 HIS 77 -18.576 -1.833 -6.891 619 HE2 HIS 77 HE2 HIS 77 -20.304 -0.252 -7.826 620 H ASP 78 H ASP 78 -15.617 4.207 -6.498 621 HA ASP 78 HA ASP 78 -13.775 5.697 -8.251 622 HB2 ASP 78 HB3 ASP 78 -16.476 6.072 -8.188 623 HB3 ASP 78 HB2 ASP 78 -15.938 7.253 -6.997 624 H VAL 79 H VAL 79 -12.711 7.525 -7.311 625 HA VAL 79 HA VAL 79 -11.693 7.042 -4.740 626 HB VAL 79 HB VAL 79 -10.827 9.467 -5.025 627 HG11 VAL 79 HG11 VAL 79 -9.137 8.005 -5.324 628 HG12 VAL 79 HG12 VAL 79 -9.321 8.477 -7.013 629 HG13 VAL 79 HG13 VAL 79 -10.070 6.992 -6.426 630 HG21 VAL 79 HG21 VAL 79 -12.630 9.511 -7.087 631 HG22 VAL 79 HG22 VAL 79 -11.100 9.218 -7.913 632 HG23 VAL 79 HG23 VAL 79 -11.285 10.631 -6.874 633 H ALA 80 H ALA 80 -14.161 9.232 -5.952 634 HA ALA 80 HA ALA 80 -14.515 10.688 -3.549 635 HB1 ALA 80 HB1 ALA 80 -15.295 11.623 -5.619 636 HB2 ALA 80 HB2 ALA 80 -16.687 11.370 -4.567 637 HB3 ALA 80 HB3 ALA 80 -16.366 10.249 -5.889 638 H ALA 81 H ALA 81 -16.090 7.826 -4.904 639 HA ALA 81 HA ALA 81 -18.126 7.493 -3.045 640 HB1 ALA 81 HB1 ALA 81 -17.413 6.127 -5.207 641 HB2 ALA 81 HB2 ALA 81 -18.430 5.422 -3.951 642 HB3 ALA 81 HB3 ALA 81 -16.704 5.063 -3.991 643 H VAL 82 H VAL 82 -15.037 5.697 -3.010 644 HA VAL 82 HA VAL 82 -15.212 4.646 -0.481 645 HB VAL 82 HB VAL 82 -13.451 4.253 -2.320 646 HG11 VAL 82 HG11 VAL 82 -12.056 6.442 -0.792 647 HG12 VAL 82 HG12 VAL 82 -12.627 6.542 -2.457 648 HG13 VAL 82 HG13 VAL 82 -11.336 5.420 -2.035 649 HG21 VAL 82 HG21 VAL 82 -12.429 4.369 0.508 650 HG22 VAL 82 HG22 VAL 82 -11.916 3.279 -0.780 651 HG23 VAL 82 HG23 VAL 82 -13.534 3.133 -0.091 652 H PHE 83 H PHE 83 -14.255 7.901 -1.428 653 HA PHE 83 HA PHE 83 -13.078 8.712 0.981 654 HB2 PHE 83 HB3 PHE 83 -14.290 10.084 -1.353 655 HB3 PHE 83 HB2 PHE 83 -14.172 11.028 0.128 656 HD1 PHE 83 HD2 PHE 83 -11.654 10.083 1.269 657 HD2 PHE 83 HD1 PHE 83 -12.679 10.935 -2.772 658 HE1 PHE 83 HE2 PHE 83 -9.291 10.559 0.774 659 HE2 PHE 83 HE1 PHE 83 -10.318 11.412 -3.275 660 HZ PHE 83 HZ PHE 83 -8.621 11.225 -1.501 661 H ALA 84 H ALA 84 -16.466 8.710 -0.048 662 HA ALA 84 HA ALA 84 -17.520 10.069 2.175 663 HB1 ALA 84 HB1 ALA 84 -18.790 7.961 0.425 664 HB2 ALA 84 HB2 ALA 84 -18.861 9.708 0.193 665 HB3 ALA 84 HB3 ALA 84 -19.661 8.970 1.581 666 H TYR 85 H TYR 85 -16.768 6.696 1.600 667 HA TYR 85 HA TYR 85 -17.878 5.651 3.972 668 HB2 TYR 85 HB3 TYR 85 -17.180 3.716 3.080 669 HB3 TYR 85 HB2 TYR 85 -16.391 4.624 1.801 670 HD1 TYR 85 HD1 TYR 85 -15.741 3.552 5.334 671 HD2 TYR 85 HD2 TYR 85 -14.162 4.244 1.451 672 HE1 TYR 85 HE1 TYR 85 -13.555 2.707 6.080 673 HE2 TYR 85 HE2 TYR 85 -11.969 3.405 2.181 674 HH TYR 85 HH TYR 85 -10.705 2.973 4.092 675 H ALA 86 H ALA 86 -14.454 6.419 3.269 676 HA ALA 86 HA ALA 86 -13.337 6.153 5.710 677 HB1 ALA 86 HB1 ALA 86 -12.676 8.620 4.158 678 HB2 ALA 86 HB2 ALA 86 -12.334 7.027 3.483 679 HB3 ALA 86 HB3 ALA 86 -11.601 7.513 5.012 680 H LYS 87 H LYS 87 -15.407 8.832 4.703 681 HA LYS 87 HA LYS 87 -14.964 10.441 7.002 682 HB2 LYS 87 HB3 LYS 87 -16.238 10.858 4.659 683 HB3 LYS 87 HB2 LYS 87 -17.624 10.522 5.686 684 HG2 LYS 87 HG3 LYS 87 -17.194 12.904 5.559 685 HG3 LYS 87 HG2 LYS 87 -16.943 12.310 7.201 686 HD2 LYS 87 HD3 LYS 87 -14.456 12.056 5.988 687 HD3 LYS 87 HD2 LYS 87 -15.080 13.593 5.386 688 HE2 LYS 87 HE3 LYS 87 -15.560 14.255 7.730 689 HE3 LYS 87 HE2 LYS 87 -14.794 12.762 8.271 690 HZ1 LYS 87 HZ1 LYS 87 -12.885 13.758 6.712 691 HZ2 LYS 87 HZ2 LYS 87 -12.991 14.079 8.369 692 HZ3 LYS 87 HZ3 LYS 87 -13.590 15.199 7.252 693 H GLN 88 H GLN 88 -17.406 8.068 6.120 694 HA GLN 88 HA GLN 88 -18.972 8.185 8.434 695 HB2 GLN 88 HB3 GLN 88 -19.502 7.002 6.250 696 HB3 GLN 88 HB2 GLN 88 -18.488 5.684 6.820 697 HG2 GLN 88 HG3 GLN 88 -20.697 5.074 7.327 698 HG3 GLN 88 HG2 GLN 88 -19.971 5.576 8.852 699 HE21 GLN 88 HE21 GLN 88 -21.650 7.098 6.116 700 HE22 GLN 88 HE22 GLN 88 -22.711 8.060 7.082 701 H HIS 89 H HIS 89 -15.818 6.922 7.979 702 HA HIS 89 HA HIS 89 -15.995 5.393 10.484 703 HB2 HIS 89 HB3 HIS 89 -14.503 5.030 7.985 704 HB3 HIS 89 HB2 HIS 89 -13.517 4.825 9.428 705 HD1 HIS 89 HD1 HIS 89 -15.321 3.335 11.295 706 HD2 HIS 89 HD2 HIS 89 -15.170 2.531 7.222 707 HE1 HIS 89 HE1 HIS 89 -16.161 0.978 11.044 708 HE2 HIS 89 HE2 HIS 89 -15.978 0.483 8.580 709 HA PRO 90 HA PRO 90 -13.578 9.216 11.571 710 HB2 PRO 90 HB3 PRO 90 -14.912 9.830 13.822 711 HB3 PRO 90 HB2 PRO 90 -15.512 10.298 12.226 712 HG2 PRO 90 HG3 PRO 90 -16.324 7.983 13.947 713 HG3 PRO 90 HG2 PRO 90 -17.348 9.115 13.044 714 HD2 PRO 90 HD3 PRO 90 -16.716 6.634 12.124 715 HD3 PRO 90 HD2 PRO 90 -17.022 8.015 11.052 716 H ASP 91 H ASP 91 -14.045 6.137 12.811 717 HA ASP 91 HA ASP 91 -12.245 6.587 15.087 718 HB2 ASP 91 HB3 ASP 91 -14.575 5.232 15.059 719 HB3 ASP 91 HB2 ASP 91 -13.464 3.920 14.677 720 H GLN 92 H GLN 92 -11.869 5.970 11.954 721 HA GLN 92 HA GLN 92 -9.426 4.454 12.412 722 HB2 GLN 92 HB3 GLN 92 -11.430 3.595 10.320 723 HB3 GLN 92 HB2 GLN 92 -9.883 2.835 10.670 724 HG2 GLN 92 HG3 GLN 92 -10.674 2.168 12.859 725 HG3 GLN 92 HG2 GLN 92 -12.208 2.990 12.576 726 HE21 GLN 92 HE21 GLN 92 -10.176 0.782 10.679 727 HE22 GLN 92 HE22 GLN 92 -11.432 -0.351 10.332 728 H GLU 93 H GLU 93 -7.986 4.467 10.522 729 HA GLU 93 HA GLU 93 -8.382 6.909 8.924 730 HB2 GLU 93 HB3 GLU 93 -5.847 5.557 9.857 731 HB3 GLU 93 HB2 GLU 93 -5.875 6.880 8.699 732 HG2 GLU 93 HG3 GLU 93 -6.814 8.364 10.336 733 HG3 GLU 93 HG2 GLU 93 -6.981 7.044 11.492 734 H LEU 94 H LEU 94 -7.409 6.895 6.749 735 HA LEU 94 HA LEU 94 -7.846 4.290 5.474 736 HB2 LEU 94 HB3 LEU 94 -8.455 7.031 4.773 737 HB3 LEU 94 HB2 LEU 94 -7.562 6.241 3.488 738 HG LEU 94 HG LEU 94 -9.257 4.413 3.500 739 HD11 LEU 94 HD11 LEU 94 -10.323 4.348 5.513 740 HD12 LEU 94 HD12 LEU 94 -11.490 5.299 4.595 741 HD13 LEU 94 HD13 LEU 94 -10.356 6.103 5.680 742 HD21 LEU 94 HD21 LEU 94 -10.236 7.220 3.002 743 HD22 LEU 94 HD22 LEU 94 -11.036 5.759 2.422 744 HD23 LEU 94 HD23 LEU 94 -9.416 6.162 1.854 745 H VAL 95 H VAL 95 -6.248 3.204 4.504 746 HA VAL 95 HA VAL 95 -3.753 4.609 3.864 747 HB VAL 95 HB VAL 95 -3.786 1.928 5.249 748 HG11 VAL 95 HG11 VAL 95 -1.423 3.737 5.106 749 HG12 VAL 95 HG12 VAL 95 -1.863 2.799 3.679 750 HG13 VAL 95 HG13 VAL 95 -1.494 1.977 5.195 751 HG21 VAL 95 HG21 VAL 95 -4.593 3.562 6.821 752 HG22 VAL 95 HG22 VAL 95 -3.287 4.670 6.400 753 HG23 VAL 95 HG23 VAL 95 -2.926 3.155 7.227 754 H ILE 96 H ILE 96 -2.915 4.063 1.943 755 HA ILE 96 HA ILE 96 -4.299 2.062 0.356 756 HB ILE 96 HB ILE 96 -1.997 3.789 -0.539 757 HG12 ILE 96 HG13 ILE 96 -3.705 5.268 0.363 758 HG13 ILE 96 HG12 ILE 96 -3.712 5.364 -1.395 759 HG21 ILE 96 HG21 ILE 96 -2.417 2.059 -2.088 760 HG22 ILE 96 HG22 ILE 96 -3.190 3.498 -2.752 761 HG23 ILE 96 HG23 ILE 96 -4.164 2.261 -1.956 762 HD11 ILE 96 HD11 ILE 96 -5.593 3.565 0.084 763 HD12 ILE 96 HD12 ILE 96 -5.712 4.178 -1.565 764 HD13 ILE 96 HD13 ILE 96 -5.955 5.267 -0.199 765 H ALA 97 H ALA 97 -3.522 0.112 -0.181 766 HA ALA 97 HA ALA 97 -0.748 -0.519 0.596 767 HB1 ALA 97 HB1 ALA 97 -3.287 -1.980 1.026 768 HB2 ALA 97 HB2 ALA 97 -1.860 -1.855 2.054 769 HB3 ALA 97 HB3 ALA 97 -1.853 -2.940 0.664 770 H GLY 98 H GLY 98 -3.020 -0.439 -1.962 771 HA2 GLY 98 HA3 GLY 98 -1.438 -0.764 -4.079 772 HA3 GLY 98 HA2 GLY 98 -1.623 -2.433 -3.560 773 H GLY 99 H GLY 99 -4.175 -2.022 -6.096 774 HA2 GLY 99 HA3 GLY 99 -1.398 -2.465 -5.685 775 HA3 GLY 99 HA2 GLY 99 -2.242 -2.497 -7.224 776 H ALA 100 H ALA 100 -0.311 -1.499 -8.073 777 HA ALA 100 HA ALA 100 0.651 1.008 -7.262 778 HB1 ALA 100 HB1 ALA 100 2.010 -0.384 -8.640 779 HB2 ALA 100 HB2 ALA 100 1.668 1.092 -9.543 780 HB3 ALA 100 HB3 ALA 100 0.799 -0.395 -9.921 781 H GLN 101 H GLN 101 -1.888 0.115 -9.548 782 HA GLN 101 HA GLN 101 -2.258 2.687 -10.659 783 HB2 GLN 101 HB3 GLN 101 -3.484 0.103 -10.868 784 HB3 GLN 101 HB2 GLN 101 -4.740 1.318 -10.679 785 HG2 GLN 101 HG3 GLN 101 -2.783 2.230 -12.561 786 HG3 GLN 101 HG2 GLN 101 -3.347 0.620 -13.008 787 HE21 GLN 101 HE21 GLN 101 -4.876 3.490 -11.580 788 HE22 GLN 101 HE22 GLN 101 -6.170 3.579 -12.721 789 H ILE 102 H ILE 102 -3.511 1.100 -7.805 790 HA ILE 102 HA ILE 102 -5.477 3.097 -7.225 791 HB ILE 102 HB ILE 102 -4.271 0.928 -5.498 792 HG12 ILE 102 HG13 ILE 102 -6.539 -0.094 -5.790 793 HG13 ILE 102 HG12 ILE 102 -6.922 1.187 -6.935 794 HG21 ILE 102 HG21 ILE 102 -6.151 3.118 -4.856 795 HG22 ILE 102 HG22 ILE 102 -5.009 2.261 -3.820 796 HG23 ILE 102 HG23 ILE 102 -6.554 1.518 -4.234 797 HD11 ILE 102 HD11 ILE 102 -5.348 0.395 -8.493 798 HD12 ILE 102 HD12 ILE 102 -6.211 -1.025 -7.909 799 HD13 ILE 102 HD13 ILE 102 -4.593 -0.665 -7.307 800 H PHE 103 H PHE 103 -2.138 2.489 -6.337 801 HA PHE 103 HA PHE 103 -1.901 4.374 -4.267 802 HB2 PHE 103 HB3 PHE 103 0.017 3.043 -6.141 803 HB3 PHE 103 HB2 PHE 103 0.583 4.399 -5.171 804 HD1 PHE 103 HD1 PHE 103 -0.491 4.126 -2.604 805 HD2 PHE 103 HD2 PHE 103 0.676 1.032 -5.281 806 HE1 PHE 103 HE1 PHE 103 -0.131 2.616 -0.696 807 HE2 PHE 103 HE2 PHE 103 1.036 -0.485 -3.378 808 HZ PHE 103 HZ PHE 103 0.632 0.307 -1.081 809 H THR 104 H THR 104 -1.529 4.631 -7.767 810 HA THR 104 HA THR 104 -0.561 7.240 -7.915 811 HB THR 104 HB THR 104 -2.448 5.977 -9.900 812 HG1 THR 104 HG1 THR 104 -0.982 4.528 -10.181 813 HG21 THR 104 HG21 THR 104 -1.006 7.165 -11.540 814 HG22 THR 104 HG22 THR 104 -0.244 7.997 -10.182 815 HG23 THR 104 HG23 THR 104 -1.965 8.221 -10.502 816 H ALA 105 H ALA 105 -3.935 6.093 -8.077 817 HA ALA 105 HA ALA 105 -5.233 8.482 -8.445 818 HB1 ALA 105 HB1 ALA 105 -7.128 7.357 -7.964 819 HB2 ALA 105 HB2 ALA 105 -6.491 6.721 -6.448 820 HB3 ALA 105 HB3 ALA 105 -6.053 5.958 -7.976 821 H PHE 106 H PHE 106 -4.580 7.058 -5.210 822 HA PHE 106 HA PHE 106 -5.300 9.501 -3.927 823 HB2 PHE 106 HB3 PHE 106 -3.965 7.012 -2.848 824 HB3 PHE 106 HB2 PHE 106 -4.567 8.342 -1.864 825 HD1 PHE 106 HD2 PHE 106 -5.577 5.661 -4.193 826 HD2 PHE 106 HD1 PHE 106 -6.846 8.500 -1.290 827 HE1 PHE 106 HE2 PHE 106 -7.798 4.602 -4.137 828 HE2 PHE 106 HE1 PHE 106 -9.069 7.446 -1.228 829 HZ PHE 106 HZ PHE 106 -9.547 5.495 -2.654 830 H LYS 107 H LYS 107 -2.435 8.426 -5.431 831 HA LYS 107 HA LYS 107 -0.392 9.362 -3.864 832 HB2 LYS 107 HB3 LYS 107 0.945 9.344 -5.741 833 HB3 LYS 107 HB2 LYS 107 -0.384 8.330 -6.273 834 HG2 LYS 107 HG3 LYS 107 -0.461 9.632 -8.073 835 HG3 LYS 107 HG2 LYS 107 -1.189 10.852 -7.035 836 HD2 LYS 107 HD3 LYS 107 1.479 11.184 -6.529 837 HD3 LYS 107 HD2 LYS 107 1.476 10.748 -8.239 838 HE2 LYS 107 HE3 LYS 107 0.903 12.836 -8.732 839 HE3 LYS 107 HE2 LYS 107 -0.620 12.591 -7.881 840 HZ1 LYS 107 HZ1 LYS 107 0.092 14.207 -6.546 841 HZ2 LYS 107 HZ2 LYS 107 1.688 14.106 -7.097 842 HZ3 LYS 107 HZ3 LYS 107 1.147 13.064 -5.879 843 H ASP 108 H ASP 108 -2.697 11.221 -5.716 844 HA ASP 108 HA ASP 108 -1.367 13.729 -5.143 845 HB2 ASP 108 HB3 ASP 108 -3.502 14.618 -6.306 846 HB3 ASP 108 HB2 ASP 108 -2.312 13.768 -7.278 847 H ASP 109 H ASP 109 -4.312 11.983 -4.263 848 HA ASP 109 HA ASP 109 -5.157 14.083 -2.449 849 HB2 ASP 109 HB3 ASP 109 -6.532 12.230 -3.886 850 HB3 ASP 109 HB2 ASP 109 -6.506 11.466 -2.299 851 H VAL 110 H VAL 110 -2.729 12.025 -2.123 852 HA VAL 110 HA VAL 110 -3.360 10.914 0.476 853 HB VAL 110 HB VAL 110 -1.998 9.618 -1.100 854 HG11 VAL 110 HG11 VAL 110 -0.788 11.928 -1.763 855 HG12 VAL 110 HG12 VAL 110 -0.099 10.336 -2.083 856 HG13 VAL 110 HG13 VAL 110 0.417 11.252 -0.666 857 HG21 VAL 110 HG21 VAL 110 -0.372 10.411 1.311 858 HG22 VAL 110 HG22 VAL 110 -0.329 8.872 0.452 859 HG23 VAL 110 HG23 VAL 110 -1.766 9.333 1.364 860 H ASP 111 H ASP 111 -2.006 11.276 2.357 861 HA ASP 111 HA ASP 111 -0.906 14.009 2.452 862 HB2 ASP 111 HB3 ASP 111 -3.072 12.959 3.902 863 HB3 ASP 111 HB2 ASP 111 -1.737 13.044 5.048 864 H THR 112 H THR 112 -0.651 10.702 3.677 865 HA THR 112 HA THR 112 2.080 11.327 4.586 866 HB THR 112 HB THR 112 0.228 9.152 5.577 867 HG1 THR 112 HG1 THR 112 -0.481 10.799 6.682 868 HG21 THR 112 HG21 THR 112 3.037 9.866 6.353 869 HG22 THR 112 HG22 THR 112 2.387 8.295 5.882 870 HG23 THR 112 HG23 THR 112 1.942 9.004 7.433 871 H LEU 113 H LEU 113 3.682 9.624 4.321 872 HA LEU 113 HA LEU 113 3.060 7.630 2.274 873 HB2 LEU 113 HB3 LEU 113 4.387 10.019 1.732 874 HB3 LEU 113 HB2 LEU 113 5.666 8.830 1.860 875 HG LEU 113 HG LEU 113 4.645 7.491 0.104 876 HD11 LEU 113 HD11 LEU 113 2.667 9.603 -0.545 877 HD12 LEU 113 HD12 LEU 113 2.281 8.506 0.779 878 HD13 LEU 113 HD13 LEU 113 2.604 7.864 -0.830 879 HD21 LEU 113 HD21 LEU 113 6.092 8.846 -0.967 880 HD22 LEU 113 HD22 LEU 113 5.409 10.309 -0.255 881 HD23 LEU 113 HD23 LEU 113 4.616 9.545 -1.635 882 H LEU 114 H LEU 114 3.995 5.720 2.631 883 HA LEU 114 HA LEU 114 6.347 5.550 4.373 884 HB2 LEU 114 HB3 LEU 114 3.935 3.754 4.659 885 HB3 LEU 114 HB2 LEU 114 5.400 3.700 5.621 886 HG LEU 114 HG LEU 114 3.748 6.194 5.604 887 HD11 LEU 114 HD11 LEU 114 3.005 3.582 6.770 888 HD12 LEU 114 HD12 LEU 114 1.989 4.923 6.242 889 HD13 LEU 114 HD13 LEU 114 2.810 4.999 7.801 890 HD21 LEU 114 HD21 LEU 114 5.016 5.099 8.031 891 HD22 LEU 114 HD22 LEU 114 4.953 6.755 7.428 892 HD23 LEU 114 HD23 LEU 114 6.110 5.612 6.746 893 H VAL 115 H VAL 115 7.887 4.429 3.339 894 HA VAL 115 HA VAL 115 7.049 2.229 1.581 895 HB VAL 115 HB VAL 115 8.608 2.919 -0.155 896 HG11 VAL 115 HG11 VAL 115 6.808 5.227 0.550 897 HG12 VAL 115 HG12 VAL 115 6.233 3.708 -0.139 898 HG13 VAL 115 HG13 VAL 115 7.341 4.729 -1.055 899 HG21 VAL 115 HG21 VAL 115 9.225 5.112 1.781 900 HG22 VAL 115 HG22 VAL 115 9.430 5.372 0.048 901 HG23 VAL 115 HG23 VAL 115 10.328 4.089 0.860 902 H THR 116 H THR 116 8.419 0.535 1.378 903 HA THR 116 HA THR 116 10.764 0.514 3.159 904 HB THR 116 HB THR 116 9.031 -1.749 2.136 905 HG1 THR 116 HG1 THR 116 8.384 -1.922 4.232 906 HG21 THR 116 HG21 THR 116 11.549 -1.844 3.760 907 HG22 THR 116 HG22 THR 116 11.170 -2.705 2.267 908 HG23 THR 116 HG23 THR 116 10.352 -3.139 3.769 909 H ARG 117 H ARG 117 12.393 1.198 1.828 910 HA ARG 117 HA ARG 117 12.584 0.219 -0.883 911 HB2 ARG 117 HB3 ARG 117 13.868 2.315 0.732 912 HB3 ARG 117 HB2 ARG 117 14.924 1.552 -0.448 913 HG2 ARG 117 HG3 ARG 117 12.231 2.479 -1.312 914 HG3 ARG 117 HG2 ARG 117 13.515 3.664 -1.069 915 HD2 ARG 117 HD3 ARG 117 14.727 1.632 -2.518 916 HD3 ARG 117 HD2 ARG 117 13.119 1.768 -3.228 917 HE ARG 117 HE ARG 117 15.263 3.650 -3.441 918 HH11 ARG 117 HH11 ARG 117 11.789 3.317 -3.437 919 HH12 ARG 117 HH12 ARG 117 11.525 4.755 -4.365 920 HH21 ARG 117 HH21 ARG 117 14.918 5.542 -4.662 921 HH22 ARG 117 HH22 ARG 117 13.301 6.018 -5.061 922 H LEU 118 H LEU 118 13.213 -1.822 -1.127 923 HA LEU 118 HA LEU 118 15.019 -3.154 0.629 924 HB2 LEU 118 HB3 LEU 118 13.467 -3.802 -1.779 925 HB3 LEU 118 HB2 LEU 118 14.985 -4.670 -1.657 926 HG LEU 118 HG LEU 118 14.211 -5.296 0.718 927 HD11 LEU 118 HD11 LEU 118 12.339 -4.237 1.342 928 HD12 LEU 118 HD12 LEU 118 11.516 -5.456 0.369 929 HD13 LEU 118 HD13 LEU 118 11.874 -3.872 -0.320 930 HD21 LEU 118 HD21 LEU 118 14.238 -6.670 -1.504 931 HD22 LEU 118 HD22 LEU 118 12.485 -6.524 -1.379 932 HD23 LEU 118 HD23 LEU 118 13.400 -7.292 -0.082 933 H ALA 119 H ALA 119 17.137 -3.889 0.173 934 HA ALA 119 HA ALA 119 18.714 -2.006 -1.326 935 HB1 ALA 119 HB1 ALA 119 19.285 -3.257 0.897 936 HB2 ALA 119 HB2 ALA 119 20.554 -2.899 -0.273 937 HB3 ALA 119 HB3 ALA 119 19.858 -4.518 -0.195 938 H GLY 120 H GLY 120 17.842 -5.423 -1.614 939 HA2 GLY 120 HA3 GLY 120 19.462 -6.025 -3.833 940 HA3 GLY 120 HA2 GLY 120 18.008 -6.893 -3.365 941 H SER 121 H SER 121 19.064 -6.120 -6.018 942 HA SER 121 HA SER 121 16.969 -4.300 -6.961 943 HB2 SER 121 HB3 SER 121 19.446 -5.367 -8.338 944 HB3 SER 121 HB2 SER 121 18.268 -4.294 -9.094 945 HG SER 121 HG SER 121 18.955 -2.660 -7.893 946 H PHE 122 H PHE 122 15.130 -5.232 -7.557 947 HA PHE 122 HA PHE 122 15.250 -7.875 -8.853 948 HB2 PHE 122 HB3 PHE 122 12.957 -6.643 -7.310 949 HB3 PHE 122 HB2 PHE 122 12.958 -8.239 -8.053 950 HD1 PHE 122 HD2 PHE 122 14.629 -6.180 -5.464 951 HD2 PHE 122 HD1 PHE 122 13.771 -10.094 -6.896 952 HE1 PHE 122 HE2 PHE 122 15.556 -7.136 -3.395 953 HE2 PHE 122 HE1 PHE 122 14.695 -11.058 -4.829 954 HZ PHE 122 HZ PHE 122 15.590 -9.578 -3.075 955 H GLU 123 H GLU 123 13.485 -8.296 -10.424 956 HA GLU 123 HA GLU 123 12.629 -5.865 -11.839 957 HB2 GLU 123 HB3 GLU 123 13.180 -6.878 -13.983 958 HB3 GLU 123 HB2 GLU 123 14.614 -6.782 -12.969 959 HG2 GLU 123 HG3 GLU 123 13.533 -9.277 -12.411 960 HG3 GLU 123 HG2 GLU 123 13.337 -9.083 -14.152 961 H GLY 124 H GLY 124 10.579 -5.889 -12.589 962 HA2 GLY 124 HA3 GLY 124 9.158 -8.393 -12.952 963 HA3 GLY 124 HA2 GLY 124 8.589 -7.403 -11.616 964 H ASP 125 H ASP 125 6.632 -6.771 -12.363 965 HA ASP 125 HA ASP 125 6.644 -4.985 -14.682 966 HB2 ASP 125 HB3 ASP 125 4.477 -5.990 -15.448 967 HB3 ASP 125 HB2 ASP 125 5.869 -7.054 -15.625 968 H THR 126 H THR 126 6.523 -4.595 -11.772 969 HA THR 126 HA THR 126 4.162 -2.895 -11.736 970 HB THR 126 HB THR 126 4.562 -4.451 -9.247 971 HG1 THR 126 HG1 THR 126 3.227 -5.587 -11.469 972 HG21 THR 126 HG21 THR 126 2.034 -3.802 -10.733 973 HG22 THR 126 HG22 THR 126 2.774 -2.739 -9.535 974 HG23 THR 126 HG23 THR 126 2.199 -4.337 -9.060 975 H LYS 127 H LYS 127 5.138 -0.989 -11.446 976 HA LYS 127 HA LYS 127 7.010 -0.740 -9.187 977 HB2 LYS 127 HB3 LYS 127 8.062 1.148 -10.571 978 HB3 LYS 127 HB2 LYS 127 8.426 -0.507 -11.036 979 HG2 LYS 127 HG3 LYS 127 7.995 0.416 -13.075 980 HG3 LYS 127 HG2 LYS 127 6.387 -0.171 -12.652 981 HD2 LYS 127 HD3 LYS 127 5.842 1.955 -13.267 982 HD3 LYS 127 HD2 LYS 127 6.208 2.245 -11.566 983 HE2 LYS 127 HE3 LYS 127 7.697 3.758 -12.229 984 HE3 LYS 127 HE2 LYS 127 8.663 2.432 -12.873 985 HZ1 LYS 127 HZ1 LYS 127 7.232 2.673 -14.940 986 HZ2 LYS 127 HZ2 LYS 127 8.372 3.890 -14.653 987 HZ3 LYS 127 HZ3 LYS 127 6.739 4.162 -14.304 988 H MET 128 H MET 128 7.211 1.536 -8.395 989 HA MET 128 HA MET 128 4.619 2.561 -7.798 990 HB2 MET 128 HB3 MET 128 6.540 2.618 -6.218 991 HB3 MET 128 HB2 MET 128 7.315 3.813 -7.248 992 HG2 MET 128 HG3 MET 128 6.245 4.865 -5.348 993 HG3 MET 128 HG2 MET 128 5.479 5.362 -6.853 994 HE1 MET 128 HE1 MET 128 4.098 6.257 -4.756 995 HE2 MET 128 HE2 MET 128 2.620 5.435 -4.255 996 HE3 MET 128 HE3 MET 128 2.793 6.003 -5.915 997 H ILE 129 H ILE 129 4.017 4.857 -8.064 998 HA ILE 129 HA ILE 129 4.710 5.779 -10.765 999 HB ILE 129 HB ILE 129 2.614 7.020 -10.736 1000 HG12 ILE 129 HG13 ILE 129 1.091 6.213 -8.662 1001 HG13 ILE 129 HG12 ILE 129 2.665 6.240 -7.874 1002 HG21 ILE 129 HG21 ILE 129 1.465 5.220 -11.393 1003 HG22 ILE 129 HG22 ILE 129 1.534 4.483 -9.791 1004 HG23 ILE 129 HG23 ILE 129 2.884 4.289 -10.910 1005 HD11 ILE 129 HD11 ILE 129 2.302 8.625 -9.411 1006 HD12 ILE 129 HD12 ILE 129 2.579 8.433 -7.681 1007 HD13 ILE 129 HD13 ILE 129 0.939 8.383 -8.321 1008 HA PRO 130 HA PRO 130 6.778 9.464 -9.506 1009 HB2 PRO 130 HB3 PRO 130 4.793 11.014 -11.095 1010 HB3 PRO 130 HB2 PRO 130 6.558 11.022 -11.181 1011 HG2 PRO 130 HG3 PRO 130 5.118 9.790 -13.048 1012 HG3 PRO 130 HG2 PRO 130 6.638 9.089 -12.461 1013 HD2 PRO 130 HD3 PRO 130 3.822 8.312 -11.834 1014 HD3 PRO 130 HD2 PRO 130 5.257 7.287 -12.044 1015 H LEU 131 H LEU 131 6.635 11.182 -8.044 1016 HA LEU 131 HA LEU 131 3.994 11.925 -7.038 1017 HB2 LEU 131 HB3 LEU 131 6.003 11.371 -4.938 1018 HB3 LEU 131 HB2 LEU 131 4.262 11.190 -4.901 1019 HG LEU 131 HG LEU 131 5.804 9.270 -6.573 1020 HD11 LEU 131 HD11 LEU 131 6.563 7.967 -4.815 1021 HD12 LEU 131 HD12 LEU 131 5.540 8.784 -3.634 1022 HD13 LEU 131 HD13 LEU 131 6.957 9.603 -4.290 1023 HD21 LEU 131 HD21 LEU 131 3.216 9.485 -6.108 1024 HD22 LEU 131 HD22 LEU 131 3.637 8.570 -4.660 1025 HD23 LEU 131 HD23 LEU 131 3.994 7.909 -6.256 1026 H ASN 132 H ASN 132 3.965 13.874 -5.809 1027 HA ASN 132 HA ASN 132 5.993 15.754 -6.625 1028 HB2 ASN 132 HB3 ASN 132 3.295 15.944 -5.996 1029 HB3 ASN 132 HB2 ASN 132 4.087 16.723 -4.631 1030 HD21 ASN 132 HD21 ASN 132 5.323 18.577 -4.983 1031 HD22 ASN 132 HD22 ASN 132 5.165 19.517 -6.424 1032 H TRP 133 H TRP 133 7.734 14.646 -5.512 1033 HA TRP 133 HA TRP 133 7.904 14.234 -2.780 1034 HB2 TRP 133 HB3 TRP 133 10.098 14.892 -4.746 1035 HB3 TRP 133 HB2 TRP 133 10.365 14.277 -3.117 1036 HD1 TRP 133 HD1 TRP 133 9.152 13.183 -6.569 1037 HE1 TRP 133 HE1 TRP 133 9.044 10.611 -6.634 1038 HE3 TRP 133 HE3 TRP 133 10.048 12.206 -1.631 1039 HZ2 TRP 133 HZ2 TRP 133 9.311 8.456 -4.832 1040 HZ3 TRP 133 HZ3 TRP 133 10.105 9.863 -0.884 1041 HH2 TRP 133 HH2 TRP 133 9.743 8.028 -2.453 1042 H ASP 134 H ASP 134 8.652 17.209 -4.617 1043 HA ASP 134 HA ASP 134 9.875 18.629 -2.569 1044 HB2 ASP 134 HB3 ASP 134 9.621 19.278 -5.022 1045 HB3 ASP 134 HB2 ASP 134 8.016 19.866 -4.598 1046 H ASP 135 H ASP 135 6.435 18.303 -3.350 1047 HA ASP 135 HA ASP 135 5.571 20.068 -1.276 1048 HB2 ASP 135 HB3 ASP 135 4.291 18.325 -3.291 1049 HB3 ASP 135 HB2 ASP 135 3.354 18.607 -1.826 1050 H PHE 136 H PHE 136 6.959 17.095 -1.055 1051 HA PHE 136 HA PHE 136 5.506 16.477 1.431 1052 HB2 PHE 136 HB3 PHE 136 6.511 14.662 -0.734 1053 HB3 PHE 136 HB2 PHE 136 6.403 14.070 0.920 1054 HD1 PHE 136 HD2 PHE 136 4.247 16.116 -1.343 1055 HD2 PHE 136 HD1 PHE 136 4.538 12.814 1.324 1056 HE1 PHE 136 HE2 PHE 136 1.857 15.637 -1.682 1057 HE2 PHE 136 HE1 PHE 136 2.149 12.328 0.991 1058 HZ PHE 136 HZ PHE 136 0.805 13.741 -0.513 1059 H THR 137 H THR 137 6.682 16.271 3.228 1060 HA THR 137 HA THR 137 9.614 16.392 2.960 1061 HB THR 137 HB THR 137 7.783 17.533 5.072 1062 HG1 THR 137 HG1 THR 137 9.702 18.799 3.419 1063 HG21 THR 137 HG21 THR 137 10.790 17.461 5.075 1064 HG22 THR 137 HG22 THR 137 9.709 16.706 6.248 1065 HG23 THR 137 HG23 THR 137 9.796 18.464 6.132 1066 H LYS 138 H LYS 138 10.818 14.855 3.874 1067 HA LYS 138 HA LYS 138 9.714 12.461 4.791 1068 HB2 LYS 138 HB3 LYS 138 11.996 12.696 3.853 1069 HB3 LYS 138 HB2 LYS 138 12.494 13.525 5.322 1070 HG2 LYS 138 HG3 LYS 138 12.625 11.619 6.516 1071 HG3 LYS 138 HG2 LYS 138 11.247 10.881 5.696 1072 HD2 LYS 138 HD3 LYS 138 12.948 9.581 4.881 1073 HD3 LYS 138 HD2 LYS 138 12.912 10.850 3.654 1074 HE2 LYS 138 HE3 LYS 138 14.709 12.028 4.864 1075 HE3 LYS 138 HE2 LYS 138 14.769 10.705 6.027 1076 HZ1 LYS 138 HZ1 LYS 138 16.325 9.899 4.661 1077 HZ2 LYS 138 HZ2 LYS 138 15.843 10.857 3.353 1078 HZ3 LYS 138 HZ3 LYS 138 15.030 9.412 3.685 1079 H VAL 139 H VAL 139 8.896 11.869 6.677 1080 HA VAL 139 HA VAL 139 9.136 13.679 8.955 1081 HB VAL 139 HB VAL 139 7.455 11.199 8.981 1082 HG11 VAL 139 HG11 VAL 139 7.191 12.119 11.024 1083 HG12 VAL 139 HG12 VAL 139 6.016 13.127 10.179 1084 HG13 VAL 139 HG13 VAL 139 7.646 13.732 10.476 1085 HG21 VAL 139 HG21 VAL 139 5.589 12.768 8.131 1086 HG22 VAL 139 HG22 VAL 139 6.691 12.048 6.957 1087 HG23 VAL 139 HG23 VAL 139 6.912 13.723 7.462 1088 H SER 140 H SER 140 9.958 10.414 7.957 1089 HA SER 140 HA SER 140 11.853 10.223 10.132 1090 HB2 SER 140 HB3 SER 140 9.387 9.300 10.749 1091 HB3 SER 140 HB2 SER 140 10.086 7.849 10.031 1092 HG SER 140 HG SER 140 10.418 8.621 12.457 1093 H SER 141 H SER 141 13.246 8.333 9.957 1094 HA SER 141 HA SER 141 13.123 6.750 7.549 1095 HB2 SER 141 HB3 SER 141 14.239 9.055 7.023 1096 HB3 SER 141 HB2 SER 141 15.624 8.378 7.879 1097 HG SER 141 HG SER 141 14.933 7.973 5.375 1098 H ARG 142 H ARG 142 13.809 4.779 8.055 1099 HA ARG 142 HA ARG 142 15.998 4.464 9.975 1100 HB2 ARG 142 HB3 ARG 142 13.881 4.228 11.230 1101 HB3 ARG 142 HB2 ARG 142 13.392 2.939 10.138 1102 HG2 ARG 142 HG3 ARG 142 15.253 1.571 10.883 1103 HG3 ARG 142 HG2 ARG 142 15.804 2.872 11.940 1104 HD2 ARG 142 HD3 ARG 142 13.508 2.740 13.030 1105 HD3 ARG 142 HD2 ARG 142 13.300 1.223 12.157 1106 HE ARG 142 HE ARG 142 15.684 0.931 13.439 1107 HH11 ARG 142 HH11 ARG 142 12.445 1.726 14.466 1108 HH12 ARG 142 HH12 ARG 142 12.634 1.017 16.034 1109 HH21 ARG 142 HH21 ARG 142 15.935 -0.002 15.501 1110 HH22 ARG 142 HH22 ARG 142 14.616 0.036 16.622 1111 H THR 143 H THR 143 17.486 3.095 9.246 1112 HA THR 143 HA THR 143 16.810 1.392 6.961 1113 HB THR 143 HB THR 143 19.623 1.614 7.852 1114 HG1 THR 143 HG1 THR 143 18.118 3.819 6.938 1115 HG21 THR 143 HG21 THR 143 18.401 0.770 5.562 1116 HG22 THR 143 HG22 THR 143 20.101 1.213 5.719 1117 HG23 THR 143 HG23 THR 143 18.931 2.397 5.136 1118 H VAL 144 H VAL 144 16.331 -0.654 7.374 1119 HA VAL 144 HA VAL 144 17.556 -1.958 9.708 1120 HB VAL 144 HB VAL 144 15.622 -3.697 8.990 1121 HG11 VAL 144 HG11 VAL 144 15.407 -1.301 10.794 1122 HG12 VAL 144 HG12 VAL 144 15.895 -2.940 11.224 1123 HG13 VAL 144 HG13 VAL 144 14.225 -2.609 10.765 1124 HG21 VAL 144 HG21 VAL 144 13.619 -2.607 8.321 1125 HG22 VAL 144 HG22 VAL 144 14.874 -2.125 7.180 1126 HG23 VAL 144 HG23 VAL 144 14.367 -1.015 8.453 1127 H GLU 145 H GLU 145 18.887 -3.645 9.428 1128 HA GLU 145 HA GLU 145 19.065 -4.814 6.729 1129 HB2 GLU 145 HB3 GLU 145 21.518 -5.266 7.444 1130 HB3 GLU 145 HB2 GLU 145 21.069 -3.656 6.897 1131 HG2 GLU 145 HG3 GLU 145 21.066 -2.803 9.089 1132 HG3 GLU 145 HG2 GLU 145 21.113 -4.416 9.798 1133 H ASP 146 H ASP 146 19.379 -7.005 6.546 1134 HA ASP 146 HA ASP 146 19.028 -8.554 9.029 1135 HB2 ASP 146 HB3 ASP 146 17.687 -8.674 6.413 1136 HB3 ASP 146 HB2 ASP 146 18.205 -10.241 7.027 1137 H THR 147 H THR 147 19.565 -11.064 8.203 1138 HA THR 147 HA THR 147 22.357 -11.177 8.185 1139 HB THR 147 HB THR 147 21.765 -13.625 7.278 1140 HG1 THR 147 HG1 THR 147 19.680 -13.623 6.911 1141 HG21 THR 147 HG21 THR 147 21.594 -12.431 9.965 1142 HG22 THR 147 HG22 THR 147 22.568 -13.778 9.374 1143 HG23 THR 147 HG23 THR 147 20.864 -14.022 9.758 1144 H ASN 148 H ASN 148 20.021 -11.499 5.545 1145 HA ASN 148 HA ASN 148 22.100 -11.898 3.582 1146 HB2 ASN 148 HB3 ASN 148 19.233 -12.199 3.691 1147 HB3 ASN 148 HB2 ASN 148 19.689 -11.271 2.266 1148 HD21 ASN 148 HD21 ASN 148 18.532 -13.757 2.072 1149 HD22 ASN 148 HD22 ASN 148 19.685 -14.878 1.441 1150 HA PRO 149 HA PRO 149 22.899 -7.598 2.803 1151 HB2 PRO 149 HB3 PRO 149 23.514 -8.409 0.032 1152 HB3 PRO 149 HB2 PRO 149 24.555 -7.642 1.235 1153 HG2 PRO 149 HG3 PRO 149 24.885 -10.206 0.537 1154 HG3 PRO 149 HG2 PRO 149 25.145 -9.653 2.199 1155 HD2 PRO 149 HD3 PRO 149 22.805 -11.105 1.033 1156 HD3 PRO 149 HD2 PRO 149 23.605 -11.330 2.603 1157 H ALA 150 H ALA 150 20.881 -9.529 0.714 1158 HA ALA 150 HA ALA 150 19.739 -7.233 -0.634 1159 HB1 ALA 150 HB1 ALA 150 19.946 -9.143 -1.995 1160 HB2 ALA 150 HB2 ALA 150 18.224 -8.998 -1.643 1161 HB3 ALA 150 HB3 ALA 150 19.203 -10.186 -0.783 1162 H LEU 151 H LEU 151 19.174 -8.937 2.263 1163 HA LEU 151 HA LEU 151 16.339 -8.374 2.362 1164 HB2 LEU 151 HB3 LEU 151 18.273 -9.597 4.314 1165 HB3 LEU 151 HB2 LEU 151 16.615 -9.236 4.750 1166 HG LEU 151 HG LEU 151 17.620 -11.260 2.766 1167 HD11 LEU 151 HD11 LEU 151 17.424 -12.429 4.683 1168 HD12 LEU 151 HD12 LEU 151 15.719 -12.464 4.234 1169 HD13 LEU 151 HD13 LEU 151 16.299 -11.275 5.400 1170 HD21 LEU 151 HD21 LEU 151 14.827 -10.159 3.031 1171 HD22 LEU 151 HD22 LEU 151 15.221 -11.673 2.216 1172 HD23 LEU 151 HD23 LEU 151 15.854 -10.147 1.597 1173 H THR 152 H THR 152 18.822 -6.349 2.540 1174 HA THR 152 HA THR 152 18.176 -4.951 4.977 1175 HB THR 152 HB THR 152 19.799 -3.840 2.696 1176 HG1 THR 152 HG1 THR 152 20.689 -5.836 3.094 1177 HG21 THR 152 HG21 THR 152 21.141 -3.097 4.835 1178 HG22 THR 152 HG22 THR 152 19.559 -3.272 5.595 1179 HG23 THR 152 HG23 THR 152 19.766 -2.170 4.234 1180 H HIS 153 H HIS 153 16.522 -3.598 5.211 1181 HA HIS 153 HA HIS 153 15.479 -2.236 2.813 1182 HB2 HIS 153 HB3 HIS 153 13.643 -2.686 5.102 1183 HB3 HIS 153 HB2 HIS 153 13.311 -2.686 3.375 1184 HD1 HIS 153 HD1 HIS 153 12.856 -4.894 5.895 1185 HD2 HIS 153 HD2 HIS 153 15.081 -5.193 2.401 1186 HE1 HIS 153 HE1 HIS 153 13.087 -7.359 5.454 1187 HE2 HIS 153 HE2 HIS 153 14.367 -7.515 3.291 1188 H THR 154 H THR 154 14.208 -0.244 3.347 1189 HA THR 154 HA THR 154 15.195 1.127 5.746 1190 HB THR 154 HB THR 154 15.231 2.348 2.979 1191 HG1 THR 154 HG1 THR 154 17.257 1.790 2.853 1192 HG21 THR 154 HG21 THR 154 15.096 3.677 5.349 1193 HG22 THR 154 HG22 THR 154 15.808 4.308 3.864 1194 HG23 THR 154 HG23 THR 154 16.837 3.563 5.088 1195 H TYR 155 H TYR 155 13.499 1.837 6.846 1196 HA TYR 155 HA TYR 155 10.960 2.283 5.482 1197 HB2 TYR 155 HB3 TYR 155 11.809 1.796 8.290 1198 HB3 TYR 155 HB2 TYR 155 10.356 2.760 8.049 1199 HD1 TYR 155 HD1 TYR 155 8.469 1.761 6.676 1200 HD2 TYR 155 HD2 TYR 155 11.746 -0.543 8.107 1201 HE1 TYR 155 HE1 TYR 155 7.150 -0.295 6.371 1202 HE2 TYR 155 HE2 TYR 155 10.440 -2.604 7.803 1203 HH TYR 155 HH TYR 155 7.898 -3.181 7.741 1204 H GLU 156 H GLU 156 10.272 4.244 4.924 1205 HA GLU 156 HA GLU 156 11.389 6.571 6.346 1206 HB2 GLU 156 HB3 GLU 156 10.886 6.375 3.371 1207 HB3 GLU 156 HB2 GLU 156 11.473 7.796 4.226 1208 HG2 GLU 156 HG3 GLU 156 13.573 7.057 4.233 1209 HG3 GLU 156 HG2 GLU 156 13.093 5.433 4.723 1210 H VAL 157 H VAL 157 10.038 8.275 6.729 1211 HA VAL 157 HA VAL 157 7.204 7.854 6.059 1212 HB VAL 157 HB VAL 157 8.269 9.489 8.363 1213 HG11 VAL 157 HG11 VAL 157 5.528 8.669 7.452 1214 HG12 VAL 157 HG12 VAL 157 6.131 10.279 7.844 1215 HG13 VAL 157 HG13 VAL 157 5.846 9.108 9.131 1216 HG21 VAL 157 HG21 VAL 157 8.004 7.704 9.804 1217 HG22 VAL 157 HG22 VAL 157 8.654 6.910 8.369 1218 HG23 VAL 157 HG23 VAL 157 6.924 6.843 8.707 1219 H TRP 158 H TRP 158 5.982 9.606 5.420 1220 HA TRP 158 HA TRP 158 7.313 12.151 4.919 1221 HB2 TRP 158 HB3 TRP 158 6.069 10.566 2.670 1222 HB3 TRP 158 HB2 TRP 158 6.690 12.206 2.544 1223 HD1 TRP 158 HD1 TRP 158 7.982 8.628 3.266 1224 HE1 TRP 158 HE1 TRP 158 10.429 8.494 2.479 1225 HE3 TRP 158 HE3 TRP 158 8.664 13.507 1.901 1226 HZ2 TRP 158 HZ2 TRP 158 12.389 10.228 1.419 1227 HZ3 TRP 158 HZ3 TRP 158 10.854 14.188 1.010 1228 HH2 TRP 158 HH2 TRP 158 12.677 12.581 0.775 1229 H GLN 159 H GLN 159 5.992 13.876 4.973 1230 HA GLN 159 HA GLN 159 3.094 13.440 4.867 1231 HB2 GLN 159 HB3 GLN 159 4.667 14.278 7.196 1232 HB3 GLN 159 HB2 GLN 159 3.340 15.368 6.820 1233 HG2 GLN 159 HG3 GLN 159 2.697 12.492 6.822 1234 HG3 GLN 159 HG2 GLN 159 3.096 13.208 8.383 1235 HE21 GLN 159 HE21 GLN 159 0.699 12.718 6.085 1236 HE22 GLN 159 HE22 GLN 159 -0.492 13.795 6.722 1237 H LYS 160 H LYS 160 2.124 14.887 3.572 1238 HA LYS 160 HA LYS 160 3.531 16.791 2.118 1239 HB2 LYS 160 HB3 LYS 160 1.083 15.701 1.903 1240 HB3 LYS 160 HB2 LYS 160 0.637 17.273 2.551 1241 HG2 LYS 160 HG3 LYS 160 2.514 17.174 0.249 1242 HG3 LYS 160 HG2 LYS 160 0.803 16.850 -0.036 1243 HD2 LYS 160 HD3 LYS 160 1.204 19.172 1.658 1244 HD3 LYS 160 HD2 LYS 160 2.017 19.341 0.101 1245 HE2 LYS 160 HE3 LYS 160 -0.135 20.209 -0.245 1246 HE3 LYS 160 HE2 LYS 160 -0.180 18.591 -0.944 1247 HZ1 LYS 160 HZ1 LYS 160 -2.150 18.955 0.344 1248 HZ2 LYS 160 HZ2 LYS 160 -1.249 19.405 1.703 1249 HZ3 LYS 160 HZ3 LYS 160 -1.195 17.809 1.144 1250 H LYS 161 H LYS 161 3.768 18.989 2.245 1251 HA LYS 161 HA LYS 161 3.688 20.113 4.892 1252 HB2 LYS 161 HB3 LYS 161 4.769 20.917 2.246 1253 HB3 LYS 161 HB2 LYS 161 4.397 22.211 3.376 1254 HG2 LYS 161 HG3 LYS 161 5.843 21.138 5.051 1255 HG3 LYS 161 HG2 LYS 161 6.248 19.889 3.872 1256 HD2 LYS 161 HD3 LYS 161 7.654 21.238 2.739 1257 HD3 LYS 161 HD2 LYS 161 6.615 22.651 2.935 1258 HE2 LYS 161 HE3 LYS 161 8.667 23.042 4.116 1259 HE3 LYS 161 HE2 LYS 161 7.375 22.813 5.293 1260 HZ1 LYS 161 HZ1 LYS 161 8.972 21.472 6.168 1261 HZ2 LYS 161 HZ2 LYS 161 9.649 21.078 4.669 1262 HZ3 LYS 161 HZ3 LYS 161 8.207 20.346 5.164 1263 H ALA 162 H ALA 162 2.380 21.709 5.674 1264 HA ALA 162 HA ALA 162 0.502 22.969 5.924 1265 HB1 ALA 162 HB1 ALA 162 0.622 23.367 2.941 1266 HB2 ALA 162 HB2 ALA 162 1.631 24.245 4.091 1267 HB3 ALA 162 HB3 ALA 162 -0.123 24.423 4.140 1268 H51A NDP 170 H51A NDP 170 -6.311 -3.271 -9.110 1269 H52A NDP 170 H52A NDP 170 -5.583 -1.677 -9.378 1270 H4B NDP 170 H4B NDP 170 -7.466 -3.084 -11.321 1271 H3B NDP 170 H3B NDP 170 -6.128 -0.371 -11.450 1272 HO3A NDP 170 HO3A NDP 170 -6.092 -1.072 -13.677 1273 H2B NDP 170 H2B NDP 170 -8.115 0.428 -12.532 1274 H1B NDP 170 H1B NDP 170 -9.885 -0.791 -10.795 1275 H8A NDP 170 H8A NDP 170 -6.581 0.589 -9.389 1276 H61A NDP 170 H61A NDP 170 -8.406 4.796 -7.744 1277 H62A NDP 170 H62A NDP 170 -10.001 5.510 -7.795 1278 H2A NDP 170 H2A NDP 170 -12.590 2.732 -10.186 1279 H51N NDP 170 H51N NDP 170 -1.899 -5.160 -7.243 1280 H52N NDP 170 H52N NDP 170 -2.134 -6.013 -8.778 1281 H4D NDP 170 H4D NDP 170 0.314 -6.323 -8.992 1282 H3D NDP 170 H3D NDP 170 -0.864 -7.273 -6.370 1283 HO3N NDP 170 HO3N NDP 170 -0.781 -8.159 -8.897 1284 H2D NDP 170 H2D NDP 170 1.327 -8.033 -5.793 1285 HO2N NDP 170 HO2N NDP 170 2.602 -7.304 -8.135 1286 H1D NDP 170 H1D NDP 170 2.651 -5.765 -6.679 1287 H2N NDP 170 H2N NDP 170 3.326 -5.536 -4.350 1288 H71N NDP 170 H71N NDP 170 5.307 -4.785 -1.928 1289 H72N NDP 170 H72N NDP 170 4.735 -5.590 -3.368 1290 H41N NDP 170 H41N NDP 170 0.542 -3.630 -2.231 1291 H42N NDP 170 H42N NDP 170 0.363 -5.337 -1.700 1292 H5N NDP 170 H5N NDP 170 -1.448 -4.681 -3.282 1293 H6N NDP 170 H6N NDP 170 -0.863 -5.471 -5.582 Start of MODEL 6 1 H1 THR 1 HT1 THR 1 -4.738 9.850 5.566 2 H2 THR 1 HT2 THR 1 -4.501 8.280 6.216 3 H3 THR 1 HT3 THR 1 -6.000 8.693 5.488 4 HA THR 1 HA THR 1 -4.955 7.447 3.909 5 HB THR 1 HB THR 1 -4.373 9.121 2.158 6 HG1 THR 1 HG1 THR 1 -3.327 10.562 3.731 7 HG21 THR 1 HG21 THR 1 -6.461 10.591 2.460 8 HG22 THR 1 HG22 THR 1 -6.784 9.570 3.861 9 HG23 THR 1 HG23 THR 1 -6.664 8.852 2.255 10 H ALA 2 H ALA 2 -3.234 6.157 4.244 11 HA ALA 2 HA ALA 2 -0.573 7.394 4.056 12 HB1 ALA 2 HB1 ALA 2 -1.362 5.206 5.975 13 HB2 ALA 2 HB2 ALA 2 -0.944 6.868 6.393 14 HB3 ALA 2 HB3 ALA 2 0.281 5.794 5.716 15 H PHE 3 H PHE 3 0.946 6.274 2.896 16 HA PHE 3 HA PHE 3 -0.064 3.974 1.367 17 HB2 PHE 3 HB3 PHE 3 2.024 6.067 0.813 18 HB3 PHE 3 HB2 PHE 3 2.014 4.551 -0.074 19 HD1 PHE 3 HD1 PHE 3 -1.019 6.356 1.017 20 HD2 PHE 3 HD2 PHE 3 1.586 5.427 -2.216 21 HE1 PHE 3 HE1 PHE 3 -2.651 7.298 -0.563 22 HE2 PHE 3 HE2 PHE 3 -0.041 6.366 -3.802 23 HZ PHE 3 HZ PHE 3 -2.161 7.305 -2.977 24 H LEU 4 H LEU 4 0.709 2.002 1.861 25 HA LEU 4 HA LEU 4 3.411 1.832 3.011 26 HB2 LEU 4 HB3 LEU 4 1.844 1.567 4.827 27 HB3 LEU 4 HB2 LEU 4 0.945 0.361 3.926 28 HG LEU 4 HG LEU 4 2.867 -1.167 4.047 29 HD11 LEU 4 HD11 LEU 4 4.128 1.202 5.337 30 HD12 LEU 4 HD12 LEU 4 4.801 0.055 4.178 31 HD13 LEU 4 HD13 LEU 4 4.599 -0.412 5.867 32 HD21 LEU 4 HD21 LEU 4 1.046 -0.675 5.956 33 HD22 LEU 4 HD22 LEU 4 2.526 -0.378 6.869 34 HD23 LEU 4 HD23 LEU 4 2.272 -1.937 6.084 35 H TRP 5 H TRP 5 4.651 0.767 1.622 36 HA TRP 5 HA TRP 5 3.907 -1.853 0.739 37 HB2 TRP 5 HB3 TRP 5 3.667 -1.549 -1.544 38 HB3 TRP 5 HB2 TRP 5 2.852 -0.127 -0.907 39 HD1 TRP 5 HD1 TRP 5 5.923 -1.184 -2.893 40 HE1 TRP 5 HE1 TRP 5 6.999 0.906 -3.940 41 HE3 TRP 5 HE3 TRP 5 3.165 2.410 -0.535 42 HZ2 TRP 5 HZ2 TRP 5 6.714 3.710 -3.788 43 HZ3 TRP 5 HZ3 TRP 5 3.628 4.776 -1.044 44 HH2 TRP 5 HH2 TRP 5 5.365 5.409 -2.636 45 H ALA 6 H ALA 6 5.658 -2.994 -0.312 46 HA ALA 6 HA ALA 6 8.266 -1.893 0.466 47 HB1 ALA 6 HB1 ALA 6 7.824 -4.732 -0.380 48 HB2 ALA 6 HB2 ALA 6 7.373 -4.198 1.239 49 HB3 ALA 6 HB3 ALA 6 9.048 -4.067 0.701 50 H GLN 7 H GLN 7 10.033 -1.889 -0.985 51 HA GLN 7 HA GLN 7 9.517 -2.623 -3.752 52 HB2 GLN 7 HB3 GLN 7 10.357 -0.327 -4.487 53 HB3 GLN 7 HB2 GLN 7 8.711 -0.421 -3.876 54 HG2 GLN 7 HG3 GLN 7 10.474 0.103 -1.700 55 HG3 GLN 7 HG2 GLN 7 10.813 1.240 -3.003 56 HE21 GLN 7 HE21 GLN 7 8.296 -0.024 -0.903 57 HE22 GLN 7 HE22 GLN 7 7.263 1.357 -0.999 58 H ASP 8 H ASP 8 11.424 -2.399 -5.138 59 HA ASP 8 HA ASP 8 13.874 -2.990 -3.632 60 HB2 ASP 8 HB3 ASP 8 14.651 -4.105 -5.674 61 HB3 ASP 8 HB2 ASP 8 13.087 -4.738 -5.181 62 H ARG 9 H ARG 9 15.758 -2.532 -5.653 63 HA ARG 9 HA ARG 9 16.139 0.271 -5.409 64 HB2 ARG 9 HB3 ARG 9 17.583 -2.003 -6.619 65 HB3 ARG 9 HB2 ARG 9 17.895 -0.437 -7.355 66 HG2 ARG 9 HG3 ARG 9 18.303 0.368 -4.941 67 HG3 ARG 9 HG2 ARG 9 18.449 -1.349 -4.562 68 HD2 ARG 9 HD3 ARG 9 20.641 -0.499 -5.003 69 HD3 ARG 9 HD2 ARG 9 20.170 -1.528 -6.353 70 HE ARG 9 HE ARG 9 20.005 0.356 -7.719 71 HH11 ARG 9 HH11 ARG 9 20.843 1.251 -4.445 72 HH12 ARG 9 HH12 ARG 9 21.364 2.841 -4.884 73 HH21 ARG 9 HH21 ARG 9 20.689 2.449 -8.289 74 HH22 ARG 9 HH22 ARG 9 21.275 3.522 -7.063 75 H ASP 10 H ASP 10 14.744 -1.783 -7.845 76 HA ASP 10 HA ASP 10 14.689 0.278 -9.874 77 HB2 ASP 10 HB3 ASP 10 14.918 -2.235 -10.301 78 HB3 ASP 10 HB2 ASP 10 13.195 -2.339 -9.951 79 H GLY 11 H GLY 11 13.009 -0.060 -7.129 80 HA2 GLY 11 HA3 GLY 11 11.133 1.138 -6.441 81 HA3 GLY 11 HA2 GLY 11 10.802 1.526 -8.122 82 H LEU 12 H LEU 12 11.286 -1.726 -8.027 83 HA LEU 12 HA LEU 12 8.773 -2.524 -8.743 84 HB2 LEU 12 HB3 LEU 12 11.003 -3.826 -8.654 85 HB3 LEU 12 HB2 LEU 12 10.530 -4.257 -7.025 86 HG LEU 12 HG LEU 12 8.524 -5.391 -7.893 87 HD11 LEU 12 HD11 LEU 12 8.897 -3.809 -10.131 88 HD12 LEU 12 HD12 LEU 12 7.759 -5.145 -9.971 89 HD13 LEU 12 HD13 LEU 12 9.350 -5.422 -10.676 90 HD21 LEU 12 HD21 LEU 12 11.093 -6.279 -7.946 91 HD22 LEU 12 HD22 LEU 12 10.584 -6.577 -9.610 92 HD23 LEU 12 HD23 LEU 12 9.674 -7.277 -8.271 93 H ILE 13 H ILE 13 7.366 -4.103 -7.443 94 HA ILE 13 HA ILE 13 7.179 -3.574 -4.621 95 HB ILE 13 HB ILE 13 4.949 -2.714 -4.574 96 HG12 ILE 13 HG13 ILE 13 4.673 -2.174 -7.456 97 HG13 ILE 13 HG12 ILE 13 4.561 -3.875 -7.025 98 HG21 ILE 13 HG21 ILE 13 6.531 -1.115 -6.576 99 HG22 ILE 13 HG22 ILE 13 6.796 -1.110 -4.833 100 HG23 ILE 13 HG23 ILE 13 5.276 -0.510 -5.496 101 HD11 ILE 13 HD11 ILE 13 2.390 -2.652 -7.102 102 HD12 ILE 13 HD12 ILE 13 2.934 -1.727 -5.703 103 HD13 ILE 13 HD13 ILE 13 2.724 -3.473 -5.578 104 H GLY 14 H GLY 14 5.987 -5.137 -7.524 105 HA2 GLY 14 HA3 GLY 14 5.527 -7.544 -5.960 106 HA3 GLY 14 HA2 GLY 14 4.146 -6.903 -6.832 107 H LYS 15 H LYS 15 4.635 -9.301 -7.525 108 HA LYS 15 HA LYS 15 6.062 -9.141 -10.089 109 HB2 LYS 15 HB3 LYS 15 6.836 -11.423 -9.825 110 HB3 LYS 15 HB2 LYS 15 7.369 -10.465 -8.450 111 HG2 LYS 15 HG3 LYS 15 6.368 -11.846 -7.037 112 HG3 LYS 15 HG2 LYS 15 4.825 -11.644 -7.868 113 HD2 LYS 15 HD3 LYS 15 6.045 -13.285 -9.601 114 HD3 LYS 15 HD2 LYS 15 6.855 -13.783 -8.115 115 HE2 LYS 15 HE3 LYS 15 3.958 -13.480 -7.845 116 HE3 LYS 15 HE2 LYS 15 4.440 -14.721 -9.001 117 HZ1 LYS 15 HZ1 LYS 15 5.505 -14.565 -6.237 118 HZ2 LYS 15 HZ2 LYS 15 5.684 -15.836 -7.338 119 HZ3 LYS 15 HZ3 LYS 15 4.166 -15.506 -6.668 120 H ASP 16 H ASP 16 3.556 -8.514 -10.268 121 HA ASP 16 HA ASP 16 1.650 -9.019 -11.417 122 HB2 ASP 16 HB3 ASP 16 2.625 -11.865 -11.677 123 HB3 ASP 16 HB2 ASP 16 1.468 -11.020 -12.699 124 H GLY 17 H GLY 17 2.001 -9.315 -8.544 125 HA2 GLY 17 HA3 GLY 17 -0.528 -10.285 -7.842 126 HA3 GLY 17 HA2 GLY 17 0.644 -11.555 -7.519 127 H HIS 18 H HIS 18 2.804 -10.205 -6.611 128 HA HIS 18 HA HIS 18 2.302 -8.166 -4.736 129 HB2 HIS 18 HB3 HIS 18 2.351 -9.380 -2.648 130 HB3 HIS 18 HB2 HIS 18 1.028 -10.008 -3.624 131 HD1 HIS 18 HD1 HIS 18 2.571 -12.011 -5.374 132 HD2 HIS 18 HD2 HIS 18 3.109 -11.602 -1.274 133 HE1 HIS 18 HE1 HIS 18 3.527 -14.204 -4.600 134 HE2 HIS 18 HE2 HIS 18 3.923 -13.903 -2.130 135 H LEU 19 H LEU 19 4.188 -8.504 -2.858 136 HA LEU 19 HA LEU 19 6.588 -8.146 -4.294 137 HB2 LEU 19 HB3 LEU 19 7.658 -8.168 -2.022 138 HB3 LEU 19 HB2 LEU 19 6.370 -7.001 -2.242 139 HG LEU 19 HG LEU 19 5.003 -9.134 -1.209 140 HD11 LEU 19 HD11 LEU 19 7.775 -9.559 -0.608 141 HD12 LEU 19 HD12 LEU 19 6.377 -10.554 -0.205 142 HD13 LEU 19 HD13 LEU 19 6.872 -9.251 0.875 143 HD21 LEU 19 HD21 LEU 19 6.331 -6.907 0.332 144 HD22 LEU 19 HD22 LEU 19 4.927 -7.841 0.849 145 HD23 LEU 19 HD23 LEU 19 4.811 -6.778 -0.554 146 HA PRO 20 HA PRO 20 7.682 -12.478 -4.599 147 HB2 PRO 20 HB3 PRO 20 9.892 -12.191 -6.085 148 HB3 PRO 20 HB2 PRO 20 8.282 -11.916 -6.759 149 HG2 PRO 20 HG3 PRO 20 10.302 -9.925 -5.808 150 HG3 PRO 20 HG2 PRO 20 9.273 -9.873 -7.250 151 HD2 PRO 20 HD3 PRO 20 8.719 -8.536 -4.917 152 HD3 PRO 20 HD2 PRO 20 7.487 -9.040 -6.090 153 H TRP 21 H TRP 21 9.591 -10.000 -3.117 154 HA TRP 21 HA TRP 21 11.697 -11.794 -2.282 155 HB2 TRP 21 HB3 TRP 21 12.375 -9.748 -0.883 156 HB3 TRP 21 HB2 TRP 21 12.454 -9.598 -2.635 157 HD1 TRP 21 HD1 TRP 21 9.887 -8.778 0.162 158 HE1 TRP 21 HE1 TRP 21 8.735 -6.560 -0.451 159 HE3 TRP 21 HE3 TRP 21 12.148 -7.914 -4.337 160 HZ2 TRP 21 HZ2 TRP 21 8.775 -4.694 -2.571 161 HZ3 TRP 21 HZ3 TRP 21 11.533 -5.893 -5.598 162 HH2 TRP 21 HH2 TRP 21 9.881 -4.317 -4.732 163 H HIS 22 H HIS 22 12.105 -12.489 -0.179 164 HA HIS 22 HA HIS 22 9.725 -12.866 1.427 165 HB2 HIS 22 HB3 HIS 22 11.330 -14.722 0.985 166 HB3 HIS 22 HB2 HIS 22 12.539 -13.856 1.926 167 HD1 HIS 22 HD1 HIS 22 8.981 -15.104 2.489 168 HD2 HIS 22 HD2 HIS 22 12.600 -14.693 4.488 169 HE1 HIS 22 HE1 HIS 22 8.606 -16.098 4.769 170 HE2 HIS 22 HE2 HIS 22 10.833 -15.910 5.933 171 H LEU 23 H LEU 23 9.241 -10.943 2.410 172 HA LEU 23 HA LEU 23 11.289 -9.822 4.203 173 HB2 LEU 23 HB3 LEU 23 9.618 -8.589 2.264 174 HB3 LEU 23 HB2 LEU 23 9.086 -8.036 3.840 175 HG LEU 23 HG LEU 23 11.634 -7.585 4.228 176 HD11 LEU 23 HD11 LEU 23 11.460 -8.146 1.347 177 HD12 LEU 23 HD12 LEU 23 12.837 -8.241 2.445 178 HD13 LEU 23 HD13 LEU 23 12.341 -6.682 1.786 179 HD21 LEU 23 HD21 LEU 23 10.347 -5.706 4.360 180 HD22 LEU 23 HD22 LEU 23 9.582 -5.986 2.796 181 HD23 LEU 23 HD23 LEU 23 11.226 -5.352 2.873 182 HA PRO 24 HA PRO 24 8.188 -11.825 7.001 183 HB2 PRO 24 HB3 PRO 24 10.526 -11.603 8.811 184 HB3 PRO 24 HB2 PRO 24 9.484 -12.991 8.482 185 HG2 PRO 24 HG3 PRO 24 11.968 -12.875 7.512 186 HG3 PRO 24 HG2 PRO 24 10.642 -13.576 6.565 187 HD2 PRO 24 HD3 PRO 24 11.946 -10.896 6.311 188 HD3 PRO 24 HD2 PRO 24 11.370 -11.997 5.043 189 H ASP 25 H ASP 25 10.500 -9.227 7.727 190 HA ASP 25 HA ASP 25 9.176 -8.175 9.954 191 HB2 ASP 25 HB3 ASP 25 10.472 -6.078 9.338 192 HB3 ASP 25 HB2 ASP 25 11.424 -7.529 9.603 193 H ASP 26 H ASP 26 8.809 -7.540 6.502 194 HA ASP 26 HA ASP 26 7.176 -5.262 6.712 195 HB2 ASP 26 HB3 ASP 26 8.351 -6.412 4.641 196 HB3 ASP 26 HB2 ASP 26 6.779 -7.185 4.461 197 H LEU 27 H LEU 27 6.190 -8.628 6.014 198 HA LEU 27 HA LEU 27 3.449 -8.205 6.181 199 HB2 LEU 27 HB3 LEU 27 3.538 -10.737 6.959 200 HB3 LEU 27 HB2 LEU 27 3.837 -10.256 5.303 201 HG LEU 27 HG LEU 27 6.298 -10.248 6.826 202 HD11 LEU 27 HD11 LEU 27 5.795 -11.957 8.198 203 HD12 LEU 27 HD12 LEU 27 6.164 -12.913 6.763 204 HD13 LEU 27 HD13 LEU 27 4.488 -12.546 7.172 205 HD21 LEU 27 HD21 LEU 27 6.979 -11.779 4.999 206 HD22 LEU 27 HD22 LEU 27 6.248 -10.282 4.421 207 HD23 LEU 27 HD23 LEU 27 5.312 -11.776 4.422 208 H HIS 28 H HIS 28 5.736 -9.154 8.725 209 HA HIS 28 HA HIS 28 3.885 -9.528 10.785 210 HB2 HIS 28 HB3 HIS 28 6.764 -9.249 10.544 211 HB3 HIS 28 HB2 HIS 28 6.168 -8.478 12.009 212 HD1 HIS 28 HD1 HIS 28 7.049 -10.207 13.639 213 HD2 HIS 28 HD2 HIS 28 4.642 -11.840 10.671 214 HE1 HIS 28 HE1 HIS 28 6.620 -12.581 14.351 215 HE2 HIS 28 HE2 HIS 28 5.088 -13.520 12.586 216 H TYR 29 H TYR 29 5.694 -6.612 9.858 217 HA TYR 29 HA TYR 29 4.522 -4.959 11.851 218 HB2 TYR 29 HB3 TYR 29 6.707 -4.625 10.466 219 HB3 TYR 29 HB2 TYR 29 5.638 -3.884 9.280 220 HD1 TYR 29 HD1 TYR 29 6.003 -3.731 13.004 221 HD2 TYR 29 HD2 TYR 29 5.673 -1.587 9.344 222 HE1 TYR 29 HE1 TYR 29 6.110 -1.610 14.244 223 HE2 TYR 29 HE2 TYR 29 5.780 0.540 10.573 224 HH TYR 29 HH TYR 29 6.750 0.760 13.787 225 H PHE 30 H PHE 30 3.572 -5.929 8.655 226 HA PHE 30 HA PHE 30 1.773 -3.849 8.062 227 HB2 PHE 30 HB3 PHE 30 2.616 -6.243 6.845 228 HB3 PHE 30 HB2 PHE 30 0.867 -6.375 6.999 229 HD1 PHE 30 HD2 PHE 30 -0.081 -3.686 6.591 230 HD2 PHE 30 HD1 PHE 30 3.100 -5.745 4.655 231 HE1 PHE 30 HE2 PHE 30 -0.363 -2.252 4.613 232 HE2 PHE 30 HE1 PHE 30 2.825 -4.313 2.673 233 HZ PHE 30 HZ PHE 30 1.091 -2.565 2.650 234 H ARG 31 H ARG 31 1.122 -7.106 9.365 235 HA ARG 31 HA ARG 31 -1.615 -6.588 9.890 236 HB2 ARG 31 HB3 ARG 31 0.043 -8.820 9.900 237 HB3 ARG 31 HB2 ARG 31 -0.446 -8.649 11.580 238 HG2 ARG 31 HG3 ARG 31 -2.835 -8.403 10.562 239 HG3 ARG 31 HG2 ARG 31 -2.106 -9.204 9.169 240 HD2 ARG 31 HD3 ARG 31 -2.288 -10.229 11.995 241 HD3 ARG 31 HD2 ARG 31 -3.076 -10.886 10.562 242 HE ARG 31 HE ARG 31 -0.367 -11.334 11.413 243 HH11 ARG 31 HH11 ARG 31 -2.545 -11.323 8.686 244 HH12 ARG 31 HH12 ARG 31 -1.586 -12.425 7.756 245 HH21 ARG 31 HH21 ARG 31 0.896 -12.783 10.191 246 HH22 ARG 31 HH22 ARG 31 0.367 -13.254 8.610 247 H ALA 32 H ALA 32 1.308 -6.044 11.694 248 HA ALA 32 HA ALA 32 0.059 -5.758 14.248 249 HB1 ALA 32 HB1 ALA 32 2.643 -4.414 13.716 250 HB2 ALA 32 HB2 ALA 32 2.590 -6.167 13.531 251 HB3 ALA 32 HB3 ALA 32 2.148 -5.429 15.070 252 H GLN 33 H GLN 33 0.603 -3.654 11.540 253 HA GLN 33 HA GLN 33 -0.073 -1.292 13.130 254 HB2 GLN 33 HB3 GLN 33 1.428 -1.779 10.682 255 HB3 GLN 33 HB2 GLN 33 0.273 -0.466 10.500 256 HG2 GLN 33 HG3 GLN 33 1.830 -0.359 12.973 257 HG3 GLN 33 HG2 GLN 33 2.788 -0.220 11.499 258 HE21 GLN 33 HE21 GLN 33 1.398 1.207 9.814 259 HE22 GLN 33 HE22 GLN 33 0.975 2.757 10.451 260 H THR 34 H THR 34 -1.402 -3.441 10.746 261 HA THR 34 HA THR 34 -3.651 -1.657 10.224 262 HB THR 34 HB THR 34 -4.343 -3.374 8.588 263 HG1 THR 34 HG1 THR 34 -1.951 -4.710 9.303 264 HG21 THR 34 HG21 THR 34 -1.797 -1.975 8.469 265 HG22 THR 34 HG22 THR 34 -3.076 -2.119 7.263 266 HG23 THR 34 HG23 THR 34 -1.870 -3.395 7.426 267 H VAL 35 H VAL 35 -3.434 -2.605 12.882 268 HA VAL 35 HA VAL 35 -5.404 -4.733 13.142 269 HB VAL 35 HB VAL 35 -4.061 -3.186 15.359 270 HG11 VAL 35 HG11 VAL 35 -5.628 -5.748 15.244 271 HG12 VAL 35 HG12 VAL 35 -5.947 -4.309 16.212 272 HG13 VAL 35 HG13 VAL 35 -4.573 -5.344 16.598 273 HG21 VAL 35 HG21 VAL 35 -3.197 -5.883 14.360 274 HG22 VAL 35 HG22 VAL 35 -2.342 -4.779 15.437 275 HG23 VAL 35 HG23 VAL 35 -2.506 -4.389 13.725 276 H GLY 36 H GLY 36 -7.428 -4.045 12.742 277 HA2 GLY 36 HA3 GLY 36 -9.450 -3.083 13.363 278 HA3 GLY 36 HA2 GLY 36 -8.595 -2.132 14.568 279 H LYS 37 H LYS 37 -7.339 -2.052 11.368 280 HA LYS 37 HA LYS 37 -8.493 0.636 11.010 281 HB2 LYS 37 HB3 LYS 37 -5.927 -0.365 9.781 282 HB3 LYS 37 HB2 LYS 37 -6.504 1.294 9.868 283 HG2 LYS 37 HG3 LYS 37 -5.995 -0.211 12.390 284 HG3 LYS 37 HG2 LYS 37 -4.638 0.457 11.480 285 HD2 LYS 37 HD3 LYS 37 -5.194 2.600 11.967 286 HD3 LYS 37 HD2 LYS 37 -6.927 2.268 11.940 287 HE2 LYS 37 HE3 LYS 37 -6.426 0.931 14.117 288 HE3 LYS 37 HE2 LYS 37 -4.959 1.908 14.163 289 HZ1 LYS 37 HZ1 LYS 37 -7.442 3.350 13.707 290 HZ2 LYS 37 HZ2 LYS 37 -6.106 3.766 14.658 291 HZ3 LYS 37 HZ3 LYS 37 -7.255 2.673 15.247 292 H ILE 38 H ILE 38 -8.379 1.291 8.574 293 HA ILE 38 HA ILE 38 -9.507 -0.944 7.017 294 HB ILE 38 HB ILE 38 -10.345 1.375 5.741 295 HG12 ILE 38 HG13 ILE 38 -11.047 1.713 8.646 296 HG13 ILE 38 HG12 ILE 38 -9.640 2.512 7.953 297 HG21 ILE 38 HG21 ILE 38 -12.537 0.650 6.290 298 HG22 ILE 38 HG22 ILE 38 -11.968 -0.172 7.741 299 HG23 ILE 38 HG23 ILE 38 -11.540 -0.799 6.150 300 HD11 ILE 38 HD11 ILE 38 -12.438 2.824 6.905 301 HD12 ILE 38 HD12 ILE 38 -11.007 3.737 6.427 302 HD13 ILE 38 HD13 ILE 38 -11.672 3.924 8.050 303 H MET 39 H MET 39 -8.172 -1.632 5.505 304 HA MET 39 HA MET 39 -6.303 0.273 4.273 305 HB2 MET 39 HB3 MET 39 -5.080 -1.516 5.174 306 HB3 MET 39 HB2 MET 39 -6.256 -2.708 4.644 307 HG2 MET 39 HG3 MET 39 -4.797 -1.139 2.584 308 HG3 MET 39 HG2 MET 39 -3.940 -2.420 3.439 309 HE1 MET 39 HE1 MET 39 -5.792 -5.590 2.643 310 HE2 MET 39 HE2 MET 39 -6.891 -4.600 3.604 311 HE3 MET 39 HE3 MET 39 -5.164 -4.604 3.964 312 H VAL 40 H VAL 40 -6.352 0.728 2.147 313 HA VAL 40 HA VAL 40 -8.599 -0.285 0.594 314 HB VAL 40 HB VAL 40 -6.579 1.801 -0.228 315 HG11 VAL 40 HG11 VAL 40 -9.085 0.727 -1.374 316 HG12 VAL 40 HG12 VAL 40 -7.649 1.364 -2.177 317 HG13 VAL 40 HG13 VAL 40 -8.839 2.470 -1.490 318 HG21 VAL 40 HG21 VAL 40 -8.909 1.962 1.585 319 HG22 VAL 40 HG22 VAL 40 -8.742 3.254 0.396 320 HG23 VAL 40 HG23 VAL 40 -7.437 2.932 1.537 321 H VAL 41 H VAL 41 -8.435 -1.584 -1.170 322 HA VAL 41 HA VAL 41 -5.746 -2.236 -2.150 323 HB VAL 41 HB VAL 41 -7.009 -3.934 -0.475 324 HG11 VAL 41 HG11 VAL 41 -7.633 -5.181 -3.122 325 HG12 VAL 41 HG12 VAL 41 -8.817 -4.160 -2.308 326 HG13 VAL 41 HG13 VAL 41 -8.216 -5.616 -1.515 327 HG21 VAL 41 HG21 VAL 41 -5.647 -5.700 -2.043 328 HG22 VAL 41 HG22 VAL 41 -4.921 -4.649 -0.827 329 HG23 VAL 41 HG23 VAL 41 -4.935 -4.159 -2.520 330 H GLY 42 H GLY 42 -5.627 -2.968 -4.307 331 HA2 GLY 42 HA3 GLY 42 -7.652 -1.858 -6.017 332 HA3 GLY 42 HA2 GLY 42 -6.178 -2.664 -6.534 333 H ARG 43 H ARG 43 -8.608 -3.058 -7.836 334 HA ARG 43 HA ARG 43 -10.183 -5.165 -7.019 335 HB2 ARG 43 HB3 ARG 43 -10.175 -5.625 -9.661 336 HB3 ARG 43 HB2 ARG 43 -11.070 -4.311 -8.923 337 HG2 ARG 43 HG3 ARG 43 -9.724 -2.722 -9.799 338 HG3 ARG 43 HG2 ARG 43 -8.282 -3.732 -9.699 339 HD2 ARG 43 HD3 ARG 43 -8.682 -3.525 -11.993 340 HD3 ARG 43 HD2 ARG 43 -9.339 -5.107 -11.578 341 HE ARG 43 HE ARG 43 -11.292 -3.015 -11.451 342 HH11 ARG 43 HH11 ARG 43 -9.658 -5.242 -13.584 343 HH12 ARG 43 HH12 ARG 43 -10.934 -5.252 -14.755 344 HH21 ARG 43 HH21 ARG 43 -12.971 -3.028 -12.989 345 HH22 ARG 43 HH22 ARG 43 -12.815 -3.995 -14.417 346 H ARG 44 H ARG 44 -7.434 -5.461 -9.282 347 HA ARG 44 HA ARG 44 -7.340 -8.245 -9.296 348 HB2 ARG 44 HB3 ARG 44 -5.090 -6.266 -9.674 349 HB3 ARG 44 HB2 ARG 44 -5.014 -7.969 -10.105 350 HG2 ARG 44 HG3 ARG 44 -6.971 -6.000 -11.270 351 HG3 ARG 44 HG2 ARG 44 -5.448 -6.472 -12.025 352 HD2 ARG 44 HD3 ARG 44 -6.474 -8.208 -12.948 353 HD3 ARG 44 HD2 ARG 44 -6.800 -8.852 -11.339 354 HE ARG 44 HE ARG 44 -8.792 -7.086 -11.641 355 HH11 ARG 44 HH11 ARG 44 -7.590 -9.600 -13.746 356 HH12 ARG 44 HH12 ARG 44 -9.127 -9.880 -14.493 357 HH21 ARG 44 HH21 ARG 44 -10.812 -7.456 -12.624 358 HH22 ARG 44 HH22 ARG 44 -10.955 -8.664 -13.857 359 H THR 45 H THR 45 -6.324 -5.986 -6.904 360 HA THR 45 HA THR 45 -4.403 -7.624 -5.602 361 HB THR 45 HB THR 45 -5.878 -5.630 -3.994 362 HG1 THR 45 HG1 THR 45 -4.309 -4.854 -6.225 363 HG21 THR 45 HG21 THR 45 -3.470 -4.788 -3.739 364 HG22 THR 45 HG22 THR 45 -3.013 -6.309 -4.508 365 HG23 THR 45 HG23 THR 45 -3.909 -6.323 -2.989 366 H TYR 46 H TYR 46 -7.765 -6.770 -4.674 367 HA TYR 46 HA TYR 46 -7.997 -8.385 -2.465 368 HB2 TYR 46 HB3 TYR 46 -10.371 -8.287 -2.715 369 HB3 TYR 46 HB2 TYR 46 -9.734 -6.767 -3.325 370 HD1 TYR 46 HD2 TYR 46 -10.565 -10.172 -4.662 371 HD2 TYR 46 HD1 TYR 46 -10.718 -5.957 -5.255 372 HE1 TYR 46 HE2 TYR 46 -11.754 -10.521 -6.770 373 HE2 TYR 46 HE1 TYR 46 -11.929 -6.303 -7.364 374 HH TYR 46 HH TYR 46 -11.991 -8.520 -9.115 375 H GLU 47 H GLU 47 -8.169 -9.303 -5.841 376 HA GLU 47 HA GLU 47 -8.886 -12.050 -5.203 377 HB2 GLU 47 HB3 GLU 47 -8.218 -12.130 -7.831 378 HB3 GLU 47 HB2 GLU 47 -9.827 -11.755 -7.234 379 HG2 GLU 47 HG3 GLU 47 -9.327 -9.373 -7.405 380 HG3 GLU 47 HG2 GLU 47 -7.707 -9.752 -7.985 381 H SER 48 H SER 48 -6.086 -10.181 -5.800 382 HA SER 48 HA SER 48 -4.424 -12.574 -6.156 383 HB2 SER 48 HB3 SER 48 -3.742 -9.646 -6.495 384 HB3 SER 48 HB2 SER 48 -2.611 -10.977 -6.740 385 HG SER 48 HG SER 48 -5.072 -10.793 -8.124 386 H PHE 49 H PHE 49 -5.652 -11.305 -3.568 387 HA PHE 49 HA PHE 49 -3.147 -11.091 -2.051 388 HB2 PHE 49 HB3 PHE 49 -5.221 -9.387 -2.011 389 HB3 PHE 49 HB2 PHE 49 -5.742 -10.491 -0.744 390 HD1 PHE 49 HD1 PHE 49 -3.013 -8.219 -1.787 391 HD2 PHE 49 HD2 PHE 49 -4.763 -10.448 1.391 392 HE1 PHE 49 HE1 PHE 49 -1.544 -7.076 -0.179 393 HE2 PHE 49 HE2 PHE 49 -3.297 -9.307 3.003 394 HZ PHE 49 HZ PHE 49 -1.685 -7.618 2.219 395 HA PRO 50 HA PRO 50 -3.883 -15.283 -0.646 396 HB2 PRO 50 HB3 PRO 50 -2.002 -14.469 1.498 397 HB3 PRO 50 HB2 PRO 50 -1.921 -15.843 0.392 398 HG2 PRO 50 HG3 PRO 50 -0.323 -13.734 0.071 399 HG3 PRO 50 HG2 PRO 50 -1.018 -14.578 -1.326 400 HD2 PRO 50 HD3 PRO 50 -1.828 -11.981 -0.082 401 HD3 PRO 50 HD2 PRO 50 -1.759 -12.439 -1.797 402 H LYS 51 H LYS 51 -4.329 -12.384 1.193 403 HA LYS 51 HA LYS 51 -6.088 -13.860 3.036 404 HB2 LYS 51 HB3 LYS 51 -4.278 -11.531 3.695 405 HB3 LYS 51 HB2 LYS 51 -5.503 -12.172 4.781 406 HG2 LYS 51 HG3 LYS 51 -3.311 -13.895 3.676 407 HG3 LYS 51 HG2 LYS 51 -3.100 -12.927 5.136 408 HD2 LYS 51 HD3 LYS 51 -5.472 -14.161 5.644 409 HD3 LYS 51 HD2 LYS 51 -4.629 -15.397 4.708 410 HE2 LYS 51 HE3 LYS 51 -3.178 -15.824 6.362 411 HE3 LYS 51 HE2 LYS 51 -2.965 -14.115 6.742 412 HZ1 LYS 51 HZ1 LYS 51 -3.980 -14.935 8.624 413 HZ2 LYS 51 HZ2 LYS 51 -4.976 -16.003 7.772 414 HZ3 LYS 51 HZ3 LYS 51 -5.309 -14.345 7.757 415 H ARG 52 H ARG 52 -7.770 -13.337 1.508 416 HA ARG 52 HA ARG 52 -8.653 -10.534 1.703 417 HB2 ARG 52 HB3 ARG 52 -9.881 -11.017 -0.467 418 HB3 ARG 52 HB2 ARG 52 -8.131 -10.886 -0.571 419 HG2 ARG 52 HG3 ARG 52 -7.945 -12.943 -1.374 420 HG3 ARG 52 HG2 ARG 52 -8.931 -13.610 -0.073 421 HD2 ARG 52 HD3 ARG 52 -10.057 -12.238 -2.508 422 HD3 ARG 52 HD2 ARG 52 -9.839 -13.980 -2.374 423 HE ARG 52 HE ARG 52 -11.538 -14.048 -0.743 424 HH11 ARG 52 HH11 ARG 52 -11.075 -10.833 -2.043 425 HH12 ARG 52 HH12 ARG 52 -12.609 -10.259 -1.485 426 HH21 ARG 52 HH21 ARG 52 -13.550 -13.283 -0.015 427 HH22 ARG 52 HH22 ARG 52 -14.011 -11.645 -0.336 428 HA PRO 53 HA PRO 53 -9.486 -9.648 3.022 429 HB2 PRO 53 HB3 PRO 53 -10.823 -9.057 5.243 430 HB3 PRO 53 HB2 PRO 53 -11.578 -8.862 3.656 431 HG2 PRO 53 HG3 PRO 53 -11.968 -11.005 5.691 432 HG3 PRO 53 HG2 PRO 53 -13.150 -10.261 4.601 433 HD2 PRO 53 HD3 PRO 53 -11.837 -12.711 4.202 434 HD3 PRO 53 HD2 PRO 53 -12.743 -11.797 2.981 435 H LEU 54 H LEU 54 -8.343 -8.934 5.063 436 HA LEU 54 HA LEU 54 -6.886 -11.184 6.152 437 HB2 LEU 54 HB3 LEU 54 -6.575 -8.211 6.511 438 HB3 LEU 54 HB2 LEU 54 -5.531 -9.393 7.271 439 HG LEU 54 HG LEU 54 -5.437 -10.100 4.601 440 HD11 LEU 54 HD11 LEU 54 -5.979 -7.210 4.867 441 HD12 LEU 54 HD12 LEU 54 -6.288 -8.307 3.522 442 HD13 LEU 54 HD13 LEU 54 -4.664 -7.672 3.787 443 HD21 LEU 54 HD21 LEU 54 -3.222 -8.582 4.869 444 HD22 LEU 54 HD22 LEU 54 -3.398 -10.198 5.552 445 HD23 LEU 54 HD23 LEU 54 -3.682 -8.780 6.561 446 HA PRO 55 HA PRO 55 -9.190 -11.453 9.901 447 HB2 PRO 55 HB3 PRO 55 -7.394 -12.686 11.493 448 HB3 PRO 55 HB2 PRO 55 -8.196 -13.507 10.149 449 HG2 PRO 55 HG3 PRO 55 -5.459 -12.297 10.267 450 HG3 PRO 55 HG2 PRO 55 -5.966 -13.850 9.575 451 HD2 PRO 55 HD3 PRO 55 -5.533 -11.635 8.065 452 HD3 PRO 55 HD2 PRO 55 -6.722 -12.880 7.631 453 H GLU 56 H GLU 56 -9.572 -10.400 11.748 454 HA GLU 56 HA GLU 56 -9.452 -8.865 13.404 455 HB2 GLU 56 HB3 GLU 56 -7.364 -10.390 13.837 456 HB3 GLU 56 HB2 GLU 56 -6.467 -8.954 13.365 457 HG2 GLU 56 HG3 GLU 56 -7.294 -7.708 15.168 458 HG3 GLU 56 HG2 GLU 56 -8.576 -8.874 15.493 459 H ARG 57 H ARG 57 -9.261 -7.942 10.570 460 HA ARG 57 HA ARG 57 -8.509 -5.219 11.223 461 HB2 ARG 57 HB3 ARG 57 -6.982 -4.916 9.417 462 HB3 ARG 57 HB2 ARG 57 -6.446 -6.320 10.326 463 HG2 ARG 57 HG3 ARG 57 -6.554 -7.601 8.530 464 HG3 ARG 57 HG2 ARG 57 -8.235 -7.150 8.251 465 HD2 ARG 57 HD3 ARG 57 -5.752 -6.093 7.048 466 HD3 ARG 57 HD2 ARG 57 -7.331 -6.370 6.325 467 HE ARG 57 HE ARG 57 -7.996 -4.305 7.669 468 HH11 ARG 57 HH11 ARG 57 -4.819 -4.796 6.293 469 HH12 ARG 57 HH12 ARG 57 -4.472 -3.105 6.192 470 HH21 ARG 57 HH21 ARG 57 -7.534 -2.089 7.530 471 HH22 ARG 57 HH22 ARG 57 -6.010 -1.568 6.894 472 H THR 58 H THR 58 -9.100 -3.699 9.407 473 HA THR 58 HA THR 58 -11.607 -4.624 8.192 474 HB THR 58 HB THR 58 -10.851 -1.749 8.153 475 HG1 THR 58 HG1 THR 58 -11.778 -3.005 10.515 476 HG21 THR 58 HG21 THR 58 -13.016 -2.455 7.284 477 HG22 THR 58 HG22 THR 58 -13.185 -1.405 8.691 478 HG23 THR 58 HG23 THR 58 -13.419 -3.146 8.856 479 H ASN 59 H ASN 59 -11.699 -4.960 6.063 480 HA ASN 59 HA ASN 59 -9.446 -4.024 4.432 481 HB2 ASN 59 HB3 ASN 59 -11.409 -6.279 4.010 482 HB3 ASN 59 HB2 ASN 59 -10.210 -5.787 2.818 483 HD21 ASN 59 HD21 ASN 59 -10.402 -6.622 6.263 484 HD22 ASN 59 HD22 ASN 59 -8.951 -7.556 6.292 485 H VAL 60 H VAL 60 -9.750 -3.112 2.415 486 HA VAL 60 HA VAL 60 -12.464 -2.226 1.735 487 HB VAL 60 HB VAL 60 -10.012 -0.458 1.821 488 HG11 VAL 60 HG11 VAL 60 -10.970 0.539 0.049 489 HG12 VAL 60 HG12 VAL 60 -12.073 1.208 1.252 490 HG13 VAL 60 HG13 VAL 60 -12.533 -0.226 0.334 491 HG21 VAL 60 HG21 VAL 60 -12.573 0.171 3.198 492 HG22 VAL 60 HG22 VAL 60 -10.920 0.615 3.627 493 HG23 VAL 60 HG23 VAL 60 -11.496 -1.026 3.917 494 H VAL 61 H VAL 61 -12.940 -2.586 -0.344 495 HA VAL 61 HA VAL 61 -10.740 -3.325 -2.145 496 HB VAL 61 HB VAL 61 -13.674 -4.035 -2.248 497 HG11 VAL 61 HG11 VAL 61 -11.605 -4.121 -4.306 498 HG12 VAL 61 HG12 VAL 61 -13.359 -4.247 -4.452 499 HG13 VAL 61 HG13 VAL 61 -12.404 -5.672 -4.042 500 HG21 VAL 61 HG21 VAL 61 -11.648 -6.147 -2.152 501 HG22 VAL 61 HG22 VAL 61 -13.163 -5.983 -1.264 502 HG23 VAL 61 HG23 VAL 61 -11.718 -5.136 -0.710 503 H LEU 62 H LEU 62 -10.334 -2.202 -3.934 504 HA LEU 62 HA LEU 62 -12.257 -0.117 -4.722 505 HB2 LEU 62 HB3 LEU 62 -10.087 0.692 -3.720 506 HB3 LEU 62 HB2 LEU 62 -9.268 -0.004 -5.105 507 HG LEU 62 HG LEU 62 -10.595 1.495 -6.588 508 HD11 LEU 62 HD11 LEU 62 -11.477 2.711 -3.976 509 HD12 LEU 62 HD12 LEU 62 -12.504 1.867 -5.136 510 HD13 LEU 62 HD13 LEU 62 -11.752 3.401 -5.575 511 HD21 LEU 62 HD21 LEU 62 -9.429 3.615 -5.829 512 HD22 LEU 62 HD22 LEU 62 -8.403 2.208 -6.113 513 HD23 LEU 62 HD23 LEU 62 -8.825 2.673 -4.465 514 H THR 63 H THR 63 -13.307 -1.171 -6.338 515 HA THR 63 HA THR 63 -11.679 -1.955 -8.658 516 HB THR 63 HB THR 63 -12.538 -3.963 -7.506 517 HG1 THR 63 HG1 THR 63 -12.961 -4.865 -9.362 518 HG21 THR 63 HG21 THR 63 -15.097 -2.509 -7.675 519 HG22 THR 63 HG22 THR 63 -14.512 -3.655 -6.469 520 HG23 THR 63 HG23 THR 63 -15.139 -4.239 -8.010 521 H HIS 64 H HIS 64 -12.548 -1.480 -10.687 522 HA HIS 64 HA HIS 64 -14.227 0.801 -10.795 523 HB2 HIS 64 HB3 HIS 64 -12.917 -0.974 -12.804 524 HB3 HIS 64 HB2 HIS 64 -14.214 0.083 -13.351 525 HD1 HIS 64 HD1 HIS 64 -13.387 2.474 -11.389 526 HD2 HIS 64 HD2 HIS 64 -10.906 0.473 -14.055 527 HE1 HIS 64 HE1 HIS 64 -11.500 4.063 -11.874 528 HE2 HIS 64 HE2 HIS 64 -10.058 2.864 -13.556 529 H GLN 65 H GLN 65 -14.780 -2.629 -11.243 530 HA GLN 65 HA GLN 65 -17.186 -2.715 -12.531 531 HB2 GLN 65 HB3 GLN 65 -15.938 -4.401 -10.417 532 HB3 GLN 65 HB2 GLN 65 -17.630 -4.685 -10.802 533 HG2 GLN 65 HG3 GLN 65 -17.170 -5.507 -12.867 534 HG3 GLN 65 HG2 GLN 65 -15.727 -4.514 -13.064 535 HE21 GLN 65 HE21 GLN 65 -14.085 -5.103 -11.151 536 HE22 GLN 65 HE22 GLN 65 -13.712 -6.789 -11.078 537 H GLU 66 H GLU 66 -19.222 -2.137 -12.133 538 HA GLU 66 HA GLU 66 -19.802 -0.683 -9.699 539 HB2 GLU 66 HB3 GLU 66 -22.051 -0.340 -10.824 540 HB3 GLU 66 HB2 GLU 66 -20.658 0.335 -11.655 541 HG2 GLU 66 HG3 GLU 66 -21.091 -0.844 -13.474 542 HG3 GLU 66 HG2 GLU 66 -21.143 -2.346 -12.555 543 H ASP 67 H ASP 67 -20.711 -3.704 -11.236 544 HA ASP 67 HA ASP 67 -22.565 -4.332 -9.078 545 HB2 ASP 67 HB3 ASP 67 -22.768 -4.826 -11.704 546 HB3 ASP 67 HB2 ASP 67 -21.984 -6.321 -11.204 547 H TYR 68 H TYR 68 -19.477 -4.298 -8.882 548 HA TYR 68 HA TYR 68 -18.810 -7.047 -8.366 549 HB2 TYR 68 HB3 TYR 68 -17.054 -5.533 -9.077 550 HB3 TYR 68 HB2 TYR 68 -17.356 -4.478 -7.700 551 HD1 TYR 68 HD1 TYR 68 -16.322 -7.961 -8.539 552 HD2 TYR 68 HD2 TYR 68 -16.133 -4.763 -5.740 553 HE1 TYR 68 HE1 TYR 68 -14.672 -9.220 -7.220 554 HE2 TYR 68 HE2 TYR 68 -14.482 -6.012 -4.415 555 HH TYR 68 HH TYR 68 -13.793 -9.324 -4.984 556 H GLN 69 H GLN 69 -18.820 -8.126 -6.457 557 HA GLN 69 HA GLN 69 -19.739 -6.637 -4.085 558 HB2 GLN 69 HB3 GLN 69 -20.464 -9.455 -4.904 559 HB3 GLN 69 HB2 GLN 69 -20.933 -8.691 -3.391 560 HG2 GLN 69 HG3 GLN 69 -21.677 -7.600 -6.090 561 HG3 GLN 69 HG2 GLN 69 -22.683 -8.729 -5.185 562 HE21 GLN 69 HE21 GLN 69 -21.142 -5.563 -5.024 563 HE22 GLN 69 HE22 GLN 69 -22.304 -4.849 -3.963 564 H ALA 70 H ALA 70 -18.145 -6.514 -2.667 565 HA ALA 70 HA ALA 70 -16.282 -8.776 -2.406 566 HB1 ALA 70 HB1 ALA 70 -14.600 -7.327 -1.977 567 HB2 ALA 70 HB2 ALA 70 -15.640 -6.213 -1.089 568 HB3 ALA 70 HB3 ALA 70 -15.642 -6.206 -2.852 569 H GLN 71 H GLN 71 -17.250 -10.100 -0.951 570 HA GLN 71 HA GLN 71 -18.630 -9.160 1.358 571 HB2 GLN 71 HB3 GLN 71 -17.629 -11.896 0.566 572 HB3 GLN 71 HB2 GLN 71 -18.549 -11.592 2.033 573 HG2 GLN 71 HG3 GLN 71 -20.062 -12.392 0.398 574 HG3 GLN 71 HG2 GLN 71 -20.374 -10.668 0.601 575 HE21 GLN 71 HE21 GLN 71 -18.020 -12.547 -1.279 576 HE22 GLN 71 HE22 GLN 71 -18.385 -11.808 -2.796 577 H GLY 72 H GLY 72 -17.815 -8.524 3.236 578 HA2 GLY 72 HA3 GLY 72 -16.424 -8.909 5.148 579 HA3 GLY 72 HA2 GLY 72 -15.213 -9.601 4.082 580 H ALA 73 H ALA 73 -15.661 -7.262 2.170 581 HA ALA 73 HA ALA 73 -14.269 -5.208 3.756 582 HB1 ALA 73 HB1 ALA 73 -12.831 -4.758 1.814 583 HB2 ALA 73 HB2 ALA 73 -13.572 -6.115 0.966 584 HB3 ALA 73 HB3 ALA 73 -12.626 -6.398 2.428 585 H VAL 74 H VAL 74 -14.207 -3.064 2.541 586 HA VAL 74 HA VAL 74 -16.921 -2.411 1.773 587 HB VAL 74 HB VAL 74 -14.563 -0.531 1.833 588 HG11 VAL 74 HG11 VAL 74 -16.190 1.195 2.077 589 HG12 VAL 74 HG12 VAL 74 -17.490 0.021 2.278 590 HG13 VAL 74 HG13 VAL 74 -16.686 0.187 0.717 591 HG21 VAL 74 HG21 VAL 74 -16.450 -1.071 4.118 592 HG22 VAL 74 HG22 VAL 74 -15.008 -0.055 4.121 593 HG23 VAL 74 HG23 VAL 74 -14.853 -1.806 3.981 594 H VAL 75 H VAL 75 -17.631 -1.788 -0.219 595 HA VAL 75 HA VAL 75 -15.716 -2.132 -2.429 596 HB VAL 75 HB VAL 75 -18.724 -2.354 -2.555 597 HG11 VAL 75 HG11 VAL 75 -18.244 -3.460 -4.731 598 HG12 VAL 75 HG12 VAL 75 -16.553 -2.992 -4.547 599 HG13 VAL 75 HG13 VAL 75 -17.800 -1.754 -4.688 600 HG21 VAL 75 HG21 VAL 75 -16.892 -4.692 -2.800 601 HG22 VAL 75 HG22 VAL 75 -18.580 -4.630 -2.291 602 HG23 VAL 75 HG23 VAL 75 -17.308 -4.092 -1.194 603 H VAL 76 H VAL 76 -15.351 -0.579 -3.861 604 HA VAL 76 HA VAL 76 -17.181 1.598 -4.310 605 HB VAL 76 HB VAL 76 -15.663 3.404 -3.734 606 HG11 VAL 76 HG11 VAL 76 -15.830 3.311 -1.340 607 HG12 VAL 76 HG12 VAL 76 -15.954 1.552 -1.374 608 HG13 VAL 76 HG13 VAL 76 -17.255 2.541 -2.038 609 HG21 VAL 76 HG21 VAL 76 -13.757 2.121 -2.075 610 HG22 VAL 76 HG22 VAL 76 -13.482 3.070 -3.535 611 HG23 VAL 76 HG23 VAL 76 -13.720 1.327 -3.650 612 H HIS 77 H HIS 77 -16.331 3.074 -6.060 613 HA HIS 77 HA HIS 77 -14.328 1.696 -7.721 614 HB2 HIS 77 HB3 HIS 77 -16.544 3.043 -9.151 615 HB3 HIS 77 HB2 HIS 77 -15.670 1.570 -9.554 616 HD1 HIS 77 HD1 HIS 77 -16.291 -0.324 -7.381 617 HD2 HIS 77 HD2 HIS 77 -19.126 2.363 -8.797 618 HE1 HIS 77 HE1 HIS 77 -18.520 -1.307 -6.756 619 HE2 HIS 77 HE2 HIS 77 -20.217 0.378 -7.548 620 H ASP 78 H ASP 78 -15.327 4.637 -6.352 621 HA ASP 78 HA ASP 78 -13.455 6.071 -8.113 622 HB2 ASP 78 HB3 ASP 78 -16.190 6.911 -7.195 623 HB3 ASP 78 HB2 ASP 78 -14.976 8.112 -7.624 624 H VAL 79 H VAL 79 -12.412 7.926 -7.156 625 HA VAL 79 HA VAL 79 -11.452 7.435 -4.563 626 HB VAL 79 HB VAL 79 -10.558 9.846 -4.826 627 HG11 VAL 79 HG11 VAL 79 -8.838 9.034 -6.479 628 HG12 VAL 79 HG12 VAL 79 -9.796 7.560 -6.616 629 HG13 VAL 79 HG13 VAL 79 -9.088 8.012 -5.064 630 HG21 VAL 79 HG21 VAL 79 -10.768 9.650 -7.714 631 HG22 VAL 79 HG22 VAL 79 -11.014 11.038 -6.655 632 HG23 VAL 79 HG23 VAL 79 -12.329 9.898 -6.933 633 H ALA 80 H ALA 80 -13.900 9.613 -5.826 634 HA ALA 80 HA ALA 80 -14.310 11.034 -3.391 635 HB1 ALA 80 HB1 ALA 80 -14.934 12.024 -5.519 636 HB2 ALA 80 HB2 ALA 80 -16.354 11.874 -4.482 637 HB3 ALA 80 HB3 ALA 80 -16.101 10.732 -5.803 638 H ALA 81 H ALA 81 -15.858 8.271 -4.960 639 HA ALA 81 HA ALA 81 -18.025 7.886 -3.276 640 HB1 ALA 81 HB1 ALA 81 -18.244 5.814 -4.233 641 HB2 ALA 81 HB2 ALA 81 -16.509 5.497 -4.209 642 HB3 ALA 81 HB3 ALA 81 -17.190 6.590 -5.415 643 H VAL 82 H VAL 82 -14.904 6.171 -3.043 644 HA VAL 82 HA VAL 82 -15.327 5.050 -0.531 645 HB VAL 82 HB VAL 82 -13.504 4.458 -2.168 646 HG11 VAL 82 HG11 VAL 82 -11.956 6.693 -0.888 647 HG12 VAL 82 HG12 VAL 82 -12.762 6.853 -2.449 648 HG13 VAL 82 HG13 VAL 82 -11.477 5.664 -2.238 649 HG21 VAL 82 HG21 VAL 82 -12.374 4.947 0.568 650 HG22 VAL 82 HG22 VAL 82 -12.078 3.595 -0.525 651 HG23 VAL 82 HG23 VAL 82 -13.639 3.753 0.281 652 H PHE 83 H PHE 83 -13.883 8.152 -1.447 653 HA PHE 83 HA PHE 83 -12.887 9.025 0.954 654 HB2 PHE 83 HB3 PHE 83 -13.796 10.257 -1.512 655 HB3 PHE 83 HB2 PHE 83 -14.145 11.284 -0.128 656 HD1 PHE 83 HD2 PHE 83 -11.254 9.076 0.063 657 HD2 PHE 83 HD1 PHE 83 -12.615 12.953 -1.054 658 HE1 PHE 83 HE2 PHE 83 -8.932 9.886 0.054 659 HE2 PHE 83 HE1 PHE 83 -10.293 13.767 -1.064 660 HZ PHE 83 HZ PHE 83 -8.449 12.234 -0.509 661 H ALA 84 H ALA 84 -16.257 9.209 -0.151 662 HA ALA 84 HA ALA 84 -17.269 10.560 2.097 663 HB1 ALA 84 HB1 ALA 84 -18.343 9.680 -0.249 664 HB2 ALA 84 HB2 ALA 84 -19.278 10.301 1.111 665 HB3 ALA 84 HB3 ALA 84 -19.065 8.563 0.909 666 H TYR 85 H TYR 85 -16.694 7.170 1.408 667 HA TYR 85 HA TYR 85 -17.882 6.092 3.721 668 HB2 TYR 85 HB3 TYR 85 -17.341 4.235 2.577 669 HB3 TYR 85 HB2 TYR 85 -16.250 5.143 1.542 670 HD1 TYR 85 HD1 TYR 85 -16.476 3.158 4.654 671 HD2 TYR 85 HD2 TYR 85 -13.893 5.010 1.833 672 HE1 TYR 85 HE1 TYR 85 -14.560 1.953 5.617 673 HE2 TYR 85 HE2 TYR 85 -11.975 3.817 2.786 674 HH TYR 85 HH TYR 85 -11.300 2.704 4.746 675 H ALA 86 H ALA 86 -14.407 6.665 3.073 676 HA ALA 86 HA ALA 86 -13.349 6.259 5.522 677 HB1 ALA 86 HB1 ALA 86 -12.517 8.670 3.941 678 HB2 ALA 86 HB2 ALA 86 -12.201 7.032 3.369 679 HB3 ALA 86 HB3 ALA 86 -11.518 7.578 4.901 680 H LYS 87 H LYS 87 -15.305 9.008 4.570 681 HA LYS 87 HA LYS 87 -14.739 10.603 6.864 682 HB2 LYS 87 HB3 LYS 87 -16.084 10.996 4.494 683 HB3 LYS 87 HB2 LYS 87 -17.398 10.939 5.660 684 HG2 LYS 87 HG3 LYS 87 -16.997 13.101 5.990 685 HG3 LYS 87 HG2 LYS 87 -15.563 12.584 6.879 686 HD2 LYS 87 HD3 LYS 87 -14.510 12.527 4.458 687 HD3 LYS 87 HD2 LYS 87 -15.802 13.682 4.121 688 HE2 LYS 87 HE3 LYS 87 -14.918 15.283 5.494 689 HE3 LYS 87 HE2 LYS 87 -14.143 14.104 6.551 690 HZ1 LYS 87 HZ1 LYS 87 -12.295 14.062 5.294 691 HZ2 LYS 87 HZ2 LYS 87 -12.823 15.585 4.782 692 HZ3 LYS 87 HZ3 LYS 87 -13.132 14.220 3.832 693 H GLN 88 H GLN 88 -17.315 8.372 5.979 694 HA GLN 88 HA GLN 88 -18.892 8.591 8.270 695 HB2 GLN 88 HB3 GLN 88 -18.512 6.506 6.170 696 HB3 GLN 88 HB2 GLN 88 -19.438 6.093 7.603 697 HG2 GLN 88 HG3 GLN 88 -21.188 7.360 7.003 698 HG3 GLN 88 HG2 GLN 88 -20.169 8.633 6.335 699 HE21 GLN 88 HE21 GLN 88 -19.439 8.459 4.200 700 HE22 GLN 88 HE22 GLN 88 -20.213 7.416 3.060 701 H HIS 89 H HIS 89 -15.848 7.047 7.803 702 HA HIS 89 HA HIS 89 -16.109 5.654 10.380 703 HB2 HIS 89 HB3 HIS 89 -14.685 5.050 7.870 704 HB3 HIS 89 HB2 HIS 89 -13.776 4.716 9.340 705 HD1 HIS 89 HD1 HIS 89 -15.957 3.604 11.146 706 HD2 HIS 89 HD2 HIS 89 -15.568 2.600 7.135 707 HE1 HIS 89 HE1 HIS 89 -17.108 1.382 10.896 708 HE2 HIS 89 HE2 HIS 89 -16.936 0.836 8.442 709 HA PRO 90 HA PRO 90 -13.235 9.198 11.228 710 HB2 PRO 90 HB3 PRO 90 -14.426 10.088 13.462 711 HB3 PRO 90 HB2 PRO 90 -15.020 10.530 11.856 712 HG2 PRO 90 HG3 PRO 90 -16.038 8.436 13.742 713 HG3 PRO 90 HG2 PRO 90 -16.952 9.613 12.780 714 HD2 PRO 90 HD3 PRO 90 -16.604 7.010 12.034 715 HD3 PRO 90 HD2 PRO 90 -16.832 8.337 10.878 716 H ASP 91 H ASP 91 -14.038 6.266 12.644 717 HA ASP 91 HA ASP 91 -12.186 6.611 14.890 718 HB2 ASP 91 HB3 ASP 91 -14.265 4.523 14.260 719 HB3 ASP 91 HB2 ASP 91 -13.074 4.305 15.539 720 H GLN 92 H GLN 92 -11.840 5.884 11.777 721 HA GLN 92 HA GLN 92 -9.591 4.094 12.316 722 HB2 GLN 92 HB3 GLN 92 -11.895 3.539 10.491 723 HB3 GLN 92 HB2 GLN 92 -10.296 2.951 10.055 724 HG2 GLN 92 HG3 GLN 92 -10.307 1.356 11.630 725 HG3 GLN 92 HG2 GLN 92 -11.118 2.382 12.813 726 HE21 GLN 92 HE21 GLN 92 -13.152 1.928 13.269 727 HE22 GLN 92 HE22 GLN 92 -14.210 0.946 12.320 728 H GLU 93 H GLU 93 -8.067 3.972 10.478 729 HA GLU 93 HA GLU 93 -8.039 6.512 8.985 730 HB2 GLU 93 HB3 GLU 93 -5.856 4.900 10.255 731 HB3 GLU 93 HB2 GLU 93 -5.488 5.936 8.883 732 HG2 GLU 93 HG3 GLU 93 -6.919 7.612 10.491 733 HG3 GLU 93 HG2 GLU 93 -6.051 6.623 11.663 734 H LEU 94 H LEU 94 -6.936 6.448 6.876 735 HA LEU 94 HA LEU 94 -7.588 3.955 5.477 736 HB2 LEU 94 HB3 LEU 94 -8.144 6.616 4.902 737 HB3 LEU 94 HB2 LEU 94 -6.848 6.209 3.794 738 HG LEU 94 HG LEU 94 -8.437 4.075 3.402 739 HD11 LEU 94 HD11 LEU 94 -10.762 5.366 3.174 740 HD12 LEU 94 HD12 LEU 94 -10.126 6.185 4.600 741 HD13 LEU 94 HD13 LEU 94 -10.321 4.432 4.603 742 HD21 LEU 94 HD21 LEU 94 -9.337 5.308 1.439 743 HD22 LEU 94 HD22 LEU 94 -7.591 5.458 1.633 744 HD23 LEU 94 HD23 LEU 94 -8.648 6.788 2.105 745 H VAL 95 H VAL 95 -6.064 2.704 4.601 746 HA VAL 95 HA VAL 95 -3.375 3.815 4.197 747 HB VAL 95 HB VAL 95 -3.858 1.088 5.393 748 HG11 VAL 95 HG11 VAL 95 -1.621 0.777 5.364 749 HG12 VAL 95 HG12 VAL 95 -1.271 2.481 5.657 750 HG13 VAL 95 HG13 VAL 95 -1.697 1.934 4.035 751 HG21 VAL 95 HG21 VAL 95 -3.128 3.681 6.747 752 HG22 VAL 95 HG22 VAL 95 -2.979 2.092 7.499 753 HG23 VAL 95 HG23 VAL 95 -4.565 2.698 7.023 754 H ILE 96 H ILE 96 -2.823 3.563 2.144 755 HA ILE 96 HA ILE 96 -4.159 1.605 0.479 756 HB ILE 96 HB ILE 96 -1.941 3.458 -0.373 757 HG12 ILE 96 HG13 ILE 96 -3.649 4.821 0.699 758 HG13 ILE 96 HG12 ILE 96 -3.722 5.045 -1.046 759 HG21 ILE 96 HG21 ILE 96 -4.240 2.312 -1.946 760 HG22 ILE 96 HG22 ILE 96 -2.633 1.589 -1.874 761 HG23 ILE 96 HG23 ILE 96 -2.846 3.195 -2.569 762 HD11 ILE 96 HD11 ILE 96 -5.555 3.312 0.594 763 HD12 ILE 96 HD12 ILE 96 -5.626 3.518 -1.156 764 HD13 ILE 96 HD13 ILE 96 -5.942 4.889 -0.093 765 H ALA 97 H ALA 97 -3.336 -0.276 -0.223 766 HA ALA 97 HA ALA 97 -0.515 -0.857 0.408 767 HB1 ALA 97 HB1 ALA 97 -2.963 -2.552 0.716 768 HB2 ALA 97 HB2 ALA 97 -1.694 -2.201 1.889 769 HB3 ALA 97 HB3 ALA 97 -1.370 -3.286 0.538 770 H GLY 98 H GLY 98 -3.045 -0.983 -1.970 771 HA2 GLY 98 HA3 GLY 98 -1.426 -1.126 -4.182 772 HA3 GLY 98 HA2 GLY 98 -1.726 -2.802 -3.747 773 H GLY 99 H GLY 99 -4.287 -2.064 -6.203 774 HA2 GLY 99 HA3 GLY 99 -1.542 -2.728 -5.874 775 HA3 GLY 99 HA2 GLY 99 -2.411 -2.608 -7.394 776 H ALA 100 H ALA 100 -0.501 -1.672 -8.291 777 HA ALA 100 HA ALA 100 0.669 0.706 -7.335 778 HB1 ALA 100 HB1 ALA 100 0.779 0.208 -10.237 779 HB2 ALA 100 HB2 ALA 100 1.366 -1.095 -9.204 780 HB3 ALA 100 HB3 ALA 100 2.078 0.515 -9.085 781 H GLN 101 H GLN 101 -2.033 0.097 -9.504 782 HA GLN 101 HA GLN 101 -2.237 2.793 -10.420 783 HB2 GLN 101 HB3 GLN 101 -3.450 0.311 -11.025 784 HB3 GLN 101 HB2 GLN 101 -4.747 1.417 -10.592 785 HG2 GLN 101 HG3 GLN 101 -3.167 2.933 -12.247 786 HG3 GLN 101 HG2 GLN 101 -3.072 1.325 -12.963 787 HE21 GLN 101 HE21 GLN 101 -5.518 3.455 -11.514 788 HE22 GLN 101 HE22 GLN 101 -6.729 3.161 -12.711 789 H ILE 102 H ILE 102 -3.446 1.016 -7.684 790 HA ILE 102 HA ILE 102 -5.516 2.819 -6.955 791 HB ILE 102 HB ILE 102 -3.956 1.020 -5.098 792 HG12 ILE 102 HG13 ILE 102 -4.821 -0.242 -7.038 793 HG13 ILE 102 HG12 ILE 102 -5.640 -0.691 -5.546 794 HG21 ILE 102 HG21 ILE 102 -5.870 1.110 -3.679 795 HG22 ILE 102 HG22 ILE 102 -6.804 1.977 -4.898 796 HG23 ILE 102 HG23 ILE 102 -5.444 2.768 -4.102 797 HD11 ILE 102 HD11 ILE 102 -7.627 0.114 -6.238 798 HD12 ILE 102 HD12 ILE 102 -6.923 -0.191 -7.826 799 HD13 ILE 102 HD13 ILE 102 -6.902 1.437 -7.149 800 H PHE 103 H PHE 103 -2.079 2.627 -6.300 801 HA PHE 103 HA PHE 103 -1.992 4.612 -4.274 802 HB2 PHE 103 HB3 PHE 103 0.100 3.509 -6.152 803 HB3 PHE 103 HB2 PHE 103 0.465 4.736 -4.945 804 HD1 PHE 103 HD1 PHE 103 -0.838 3.960 -2.570 805 HD2 PHE 103 HD2 PHE 103 0.927 1.471 -5.533 806 HE1 PHE 103 HE1 PHE 103 -0.490 2.206 -0.883 807 HE2 PHE 103 HE2 PHE 103 1.275 -0.291 -3.852 808 HZ PHE 103 HZ PHE 103 0.567 0.076 -1.522 809 H THR 104 H THR 104 -1.756 4.660 -7.780 810 HA THR 104 HA THR 104 -0.881 7.278 -8.157 811 HB THR 104 HB THR 104 -2.755 5.651 -9.883 812 HG1 THR 104 HG1 THR 104 0.037 5.992 -10.164 813 HG21 THR 104 HG21 THR 104 -1.010 7.388 -11.338 814 HG22 THR 104 HG22 THR 104 -1.998 8.322 -10.214 815 HG23 THR 104 HG23 THR 104 -2.768 7.260 -11.393 816 H ALA 105 H ALA 105 -4.199 6.023 -7.858 817 HA ALA 105 HA ALA 105 -5.542 8.430 -8.319 818 HB1 ALA 105 HB1 ALA 105 -6.743 6.636 -6.315 819 HB2 ALA 105 HB2 ALA 105 -6.338 5.895 -7.864 820 HB3 ALA 105 HB3 ALA 105 -7.419 7.287 -7.808 821 H PHE 106 H PHE 106 -4.827 6.957 -5.111 822 HA PHE 106 HA PHE 106 -5.542 9.332 -3.747 823 HB2 PHE 106 HB3 PHE 106 -4.047 6.855 -2.880 824 HB3 PHE 106 HB2 PHE 106 -4.483 8.161 -1.782 825 HD1 PHE 106 HD2 PHE 106 -5.901 5.640 -4.100 826 HD2 PHE 106 HD1 PHE 106 -6.608 8.252 -0.815 827 HE1 PHE 106 HE2 PHE 106 -8.109 4.606 -3.759 828 HE2 PHE 106 HE1 PHE 106 -8.815 7.222 -0.467 829 HZ PHE 106 HZ PHE 106 -9.568 5.397 -1.940 830 H LYS 107 H LYS 107 -2.746 8.456 -5.474 831 HA LYS 107 HA LYS 107 -0.616 9.457 -4.098 832 HB2 LYS 107 HB3 LYS 107 0.498 9.507 -6.089 833 HB3 LYS 107 HB2 LYS 107 -0.913 8.598 -6.606 834 HG2 LYS 107 HG3 LYS 107 -1.915 10.756 -7.381 835 HG3 LYS 107 HG2 LYS 107 -0.367 11.526 -7.031 836 HD2 LYS 107 HD3 LYS 107 0.716 10.438 -8.749 837 HD3 LYS 107 HD2 LYS 107 -0.424 9.092 -8.755 838 HE2 LYS 107 HE3 LYS 107 -2.120 10.484 -9.770 839 HE3 LYS 107 HE2 LYS 107 -1.066 11.894 -9.666 840 HZ1 LYS 107 HZ1 LYS 107 0.427 10.911 -11.231 841 HZ2 LYS 107 HZ2 LYS 107 -1.129 10.856 -11.892 842 HZ3 LYS 107 HZ3 LYS 107 -0.439 9.457 -11.241 843 H ASP 108 H ASP 108 -3.159 11.274 -5.681 844 HA ASP 108 HA ASP 108 -1.915 13.825 -5.049 845 HB2 ASP 108 HB3 ASP 108 -3.536 13.044 -7.100 846 HB3 ASP 108 HB2 ASP 108 -4.698 13.813 -6.023 847 H ASP 109 H ASP 109 -4.671 11.858 -4.069 848 HA ASP 109 HA ASP 109 -5.530 13.820 -2.108 849 HB2 ASP 109 HB3 ASP 109 -6.655 11.436 -3.358 850 HB3 ASP 109 HB2 ASP 109 -6.984 11.516 -1.630 851 H VAL 110 H VAL 110 -2.975 11.905 -2.041 852 HA VAL 110 HA VAL 110 -3.378 10.606 0.515 853 HB VAL 110 HB VAL 110 -2.038 9.500 -1.218 854 HG11 VAL 110 HG11 VAL 110 0.313 11.218 -0.822 855 HG12 VAL 110 HG12 VAL 110 -0.998 11.942 -1.754 856 HG13 VAL 110 HG13 VAL 110 -0.280 10.419 -2.278 857 HG21 VAL 110 HG21 VAL 110 -0.233 8.771 0.186 858 HG22 VAL 110 HG22 VAL 110 -1.644 9.071 1.202 859 HG23 VAL 110 HG23 VAL 110 -0.328 10.244 1.151 860 H ASP 111 H ASP 111 -1.938 10.939 2.334 861 HA ASP 111 HA ASP 111 -0.931 13.700 2.520 862 HB2 ASP 111 HB3 ASP 111 -3.109 13.210 3.768 863 HB3 ASP 111 HB2 ASP 111 -2.141 12.203 4.840 864 H THR 112 H THR 112 -0.616 10.361 3.653 865 HA THR 112 HA THR 112 2.114 11.009 4.552 866 HB THR 112 HB THR 112 0.419 8.691 5.485 867 HG1 THR 112 HG1 THR 112 -0.528 10.555 6.240 868 HG21 THR 112 HG21 THR 112 3.153 9.589 6.084 869 HG22 THR 112 HG22 THR 112 2.424 7.987 6.202 870 HG23 THR 112 HG23 THR 112 2.156 9.173 7.479 871 H LEU 113 H LEU 113 3.759 9.400 4.197 872 HA LEU 113 HA LEU 113 3.159 7.401 2.147 873 HB2 LEU 113 HB3 LEU 113 4.345 9.830 1.562 874 HB3 LEU 113 HB2 LEU 113 5.710 8.742 1.716 875 HG LEU 113 HG LEU 113 4.849 7.318 -0.030 876 HD11 LEU 113 HD11 LEU 113 2.708 7.229 -0.621 877 HD12 LEU 113 HD12 LEU 113 2.671 8.958 -0.966 878 HD13 LEU 113 HD13 LEU 113 2.363 8.379 0.670 879 HD21 LEU 113 HD21 LEU 113 6.081 8.827 -1.154 880 HD22 LEU 113 HD22 LEU 113 5.243 10.202 -0.434 881 HD23 LEU 113 HD23 LEU 113 4.515 9.335 -1.788 882 H LEU 114 H LEU 114 3.846 5.517 2.876 883 HA LEU 114 HA LEU 114 6.346 5.405 4.434 884 HB2 LEU 114 HB3 LEU 114 3.783 3.864 4.811 885 HB3 LEU 114 HB2 LEU 114 5.306 3.337 5.502 886 HG LEU 114 HG LEU 114 4.449 6.118 6.092 887 HD11 LEU 114 HD11 LEU 114 2.390 5.375 6.663 888 HD12 LEU 114 HD12 LEU 114 3.240 4.885 8.129 889 HD13 LEU 114 HD13 LEU 114 2.924 3.705 6.857 890 HD21 LEU 114 HD21 LEU 114 6.564 4.810 6.870 891 HD22 LEU 114 HD22 LEU 114 5.456 4.088 8.037 892 HD23 LEU 114 HD23 LEU 114 5.694 5.836 8.011 893 H VAL 115 H VAL 115 7.871 4.453 3.232 894 HA VAL 115 HA VAL 115 7.085 2.133 1.598 895 HB VAL 115 HB VAL 115 8.609 2.834 -0.171 896 HG11 VAL 115 HG11 VAL 115 7.274 4.597 -1.092 897 HG12 VAL 115 HG12 VAL 115 6.708 5.070 0.510 898 HG13 VAL 115 HG13 VAL 115 6.216 3.522 -0.177 899 HG21 VAL 115 HG21 VAL 115 9.375 5.291 -0.059 900 HG22 VAL 115 HG22 VAL 115 10.286 4.088 0.855 901 HG23 VAL 115 HG23 VAL 115 9.131 5.134 1.681 902 H THR 116 H THR 116 8.605 0.532 1.288 903 HA THR 116 HA THR 116 10.939 0.627 3.086 904 HB THR 116 HB THR 116 9.272 -1.732 2.176 905 HG1 THR 116 HG1 THR 116 8.620 -1.824 4.258 906 HG21 THR 116 HG21 THR 116 10.663 -3.020 3.825 907 HG22 THR 116 HG22 THR 116 11.808 -1.679 3.777 908 HG23 THR 116 HG23 THR 116 11.458 -2.593 2.310 909 H ARG 117 H ARG 117 12.524 1.315 1.716 910 HA ARG 117 HA ARG 117 12.723 0.252 -0.965 911 HB2 ARG 117 HB3 ARG 117 14.052 2.398 0.593 912 HB3 ARG 117 HB2 ARG 117 14.982 1.676 -0.713 913 HG2 ARG 117 HG3 ARG 117 13.766 2.681 -2.296 914 HG3 ARG 117 HG2 ARG 117 12.244 2.377 -1.457 915 HD2 ARG 117 HD3 ARG 117 12.209 4.431 -0.588 916 HD3 ARG 117 HD2 ARG 117 13.887 4.315 -0.060 917 HE ARG 117 HE ARG 117 14.492 5.534 -1.888 918 HH11 ARG 117 HH11 ARG 117 11.326 4.185 -2.467 919 HH12 ARG 117 HH12 ARG 117 11.099 5.035 -3.958 920 HH21 ARG 117 HH21 ARG 117 14.195 6.654 -3.849 921 HH22 ARG 117 HH22 ARG 117 12.727 6.437 -4.743 922 H LEU 118 H LEU 118 13.431 -1.773 -1.149 923 HA LEU 118 HA LEU 118 15.310 -2.963 0.642 924 HB2 LEU 118 HB3 LEU 118 13.724 -3.782 -1.686 925 HB3 LEU 118 HB2 LEU 118 15.284 -4.575 -1.586 926 HG LEU 118 HG LEU 118 14.714 -5.307 0.723 927 HD11 LEU 118 HD11 LEU 118 12.846 -4.698 1.794 928 HD12 LEU 118 HD12 LEU 118 11.849 -4.862 0.349 929 HD13 LEU 118 HD13 LEU 118 12.778 -3.386 0.617 930 HD21 LEU 118 HD21 LEU 118 13.754 -7.196 -0.052 931 HD22 LEU 118 HD22 LEU 118 14.090 -6.458 -1.619 932 HD23 LEU 118 HD23 LEU 118 12.480 -6.327 -0.910 933 H ALA 119 H ALA 119 17.477 -3.285 0.406 934 HA ALA 119 HA ALA 119 18.922 -1.540 -1.301 935 HB1 ALA 119 HB1 ALA 119 19.493 -2.933 0.992 936 HB2 ALA 119 HB2 ALA 119 20.658 -2.037 0.017 937 HB3 ALA 119 HB3 ALA 119 20.458 -3.773 -0.223 938 H GLY 120 H GLY 120 18.145 -4.975 -1.425 939 HA2 GLY 120 HA3 GLY 120 19.850 -5.678 -3.551 940 HA3 GLY 120 HA2 GLY 120 18.391 -6.538 -3.085 941 H SER 121 H SER 121 19.509 -5.928 -5.742 942 HA SER 121 HA SER 121 17.466 -4.154 -6.862 943 HB2 SER 121 HB3 SER 121 20.041 -5.286 -7.947 944 HB3 SER 121 HB2 SER 121 18.844 -4.538 -9.005 945 HG SER 121 HG SER 121 19.239 -2.616 -8.129 946 H PHE 122 H PHE 122 15.617 -5.088 -7.422 947 HA PHE 122 HA PHE 122 15.715 -7.781 -8.617 948 HB2 PHE 122 HB3 PHE 122 13.461 -6.589 -6.989 949 HB3 PHE 122 HB2 PHE 122 13.505 -8.210 -7.674 950 HD1 PHE 122 HD2 PHE 122 15.007 -5.988 -5.146 951 HD2 PHE 122 HD1 PHE 122 14.631 -9.977 -6.579 952 HE1 PHE 122 HE2 PHE 122 16.063 -6.822 -3.086 953 HE2 PHE 122 HE1 PHE 122 15.685 -10.819 -4.521 954 HZ PHE 122 HZ PHE 122 16.403 -9.241 -2.772 955 H GLU 123 H GLU 123 13.881 -8.253 -10.093 956 HA GLU 123 HA GLU 123 12.884 -5.853 -11.466 957 HB2 GLU 123 HB3 GLU 123 13.363 -6.848 -13.635 958 HB3 GLU 123 HB2 GLU 123 14.841 -6.706 -12.693 959 HG2 GLU 123 HG3 GLU 123 13.873 -9.234 -12.084 960 HG3 GLU 123 HG2 GLU 123 13.576 -9.047 -13.812 961 H GLY 124 H GLY 124 10.800 -5.947 -12.110 962 HA2 GLY 124 HA3 GLY 124 9.458 -8.548 -12.229 963 HA3 GLY 124 HA2 GLY 124 8.845 -7.366 -11.083 964 H ASP 125 H ASP 125 6.843 -7.185 -12.080 965 HA ASP 125 HA ASP 125 6.881 -5.920 -14.742 966 HB2 ASP 125 HB3 ASP 125 4.817 -7.743 -13.502 967 HB3 ASP 125 HB2 ASP 125 4.537 -6.821 -14.976 968 H THR 126 H THR 126 5.883 -5.642 -11.450 969 HA THR 126 HA THR 126 4.230 -3.302 -12.111 970 HB THR 126 HB THR 126 4.345 -4.725 -9.454 971 HG1 THR 126 HG1 THR 126 2.731 -5.224 -11.718 972 HG21 THR 126 HG21 THR 126 3.338 -2.585 -9.234 973 HG22 THR 126 HG22 THR 126 2.050 -3.789 -9.226 974 HG23 THR 126 HG23 THR 126 2.356 -2.835 -10.677 975 H LYS 127 H LYS 127 5.085 -1.372 -11.812 976 HA LYS 127 HA LYS 127 7.192 -1.048 -9.776 977 HB2 LYS 127 HB3 LYS 127 6.983 0.160 -12.532 978 HB3 LYS 127 HB2 LYS 127 8.040 0.819 -11.291 979 HG2 LYS 127 HG3 LYS 127 9.560 -0.542 -12.217 980 HG3 LYS 127 HG2 LYS 127 8.776 -1.777 -11.230 981 HD2 LYS 127 HD3 LYS 127 7.777 -2.763 -13.016 982 HD3 LYS 127 HD2 LYS 127 7.583 -1.238 -13.884 983 HE2 LYS 127 HE3 LYS 127 9.177 -2.296 -15.165 984 HE3 LYS 127 HE2 LYS 127 10.180 -1.339 -14.076 985 HZ1 LYS 127 HZ1 LYS 127 10.540 -3.934 -14.490 986 HZ2 LYS 127 HZ2 LYS 127 9.494 -4.011 -13.163 987 HZ3 LYS 127 HZ3 LYS 127 10.953 -3.166 -13.040 988 H MET 128 H MET 128 7.417 1.256 -9.033 989 HA MET 128 HA MET 128 4.891 2.197 -8.125 990 HB2 MET 128 HB3 MET 128 7.058 2.368 -6.862 991 HB3 MET 128 HB2 MET 128 7.542 3.638 -7.978 992 HG2 MET 128 HG3 MET 128 6.668 4.500 -5.848 993 HG3 MET 128 HG2 MET 128 5.742 5.045 -7.245 994 HE1 MET 128 HE1 MET 128 2.827 5.260 -5.799 995 HE2 MET 128 HE2 MET 128 4.430 5.888 -5.420 996 HE3 MET 128 HE3 MET 128 3.537 4.965 -4.212 997 H ILE 129 H ILE 129 4.194 4.491 -8.342 998 HA ILE 129 HA ILE 129 4.454 5.341 -11.142 999 HB ILE 129 HB ILE 129 2.335 6.519 -10.843 1000 HG12 ILE 129 HG13 ILE 129 1.151 5.649 -8.566 1001 HG13 ILE 129 HG12 ILE 129 2.814 5.801 -8.010 1002 HG21 ILE 129 HG21 ILE 129 1.594 4.563 -11.617 1003 HG22 ILE 129 HG22 ILE 129 1.113 4.214 -9.956 1004 HG23 ILE 129 HG23 ILE 129 2.668 3.644 -10.562 1005 HD11 ILE 129 HD11 ILE 129 2.861 8.093 -8.413 1006 HD12 ILE 129 HD12 ILE 129 1.267 7.801 -7.718 1007 HD13 ILE 129 HD13 ILE 129 1.442 8.031 -9.458 1008 HA PRO 130 HA PRO 130 6.498 9.097 -10.029 1009 HB2 PRO 130 HB3 PRO 130 4.852 10.560 -11.981 1010 HB3 PRO 130 HB2 PRO 130 6.593 10.269 -11.978 1011 HG2 PRO 130 HG3 PRO 130 4.957 9.046 -13.724 1012 HG3 PRO 130 HG2 PRO 130 6.392 8.243 -13.061 1013 HD2 PRO 130 HD3 PRO 130 3.514 7.925 -12.291 1014 HD3 PRO 130 HD2 PRO 130 4.776 6.688 -12.472 1015 H LEU 131 H LEU 131 6.152 10.349 -8.303 1016 HA LEU 131 HA LEU 131 3.481 11.543 -7.945 1017 HB2 LEU 131 HB3 LEU 131 5.067 11.085 -5.509 1018 HB3 LEU 131 HB2 LEU 131 3.349 10.885 -5.785 1019 HG LEU 131 HG LEU 131 4.879 8.839 -7.166 1020 HD11 LEU 131 HD11 LEU 131 5.019 8.411 -4.253 1021 HD12 LEU 131 HD12 LEU 131 6.192 9.538 -4.935 1022 HD13 LEU 131 HD13 LEU 131 6.108 7.882 -5.536 1023 HD21 LEU 131 HD21 LEU 131 2.387 9.013 -6.423 1024 HD22 LEU 131 HD22 LEU 131 2.997 8.370 -4.898 1025 HD23 LEU 131 HD23 LEU 131 3.211 7.454 -6.390 1026 H ASN 132 H ASN 132 3.528 13.441 -6.407 1027 HA ASN 132 HA ASN 132 5.662 15.237 -7.225 1028 HB2 ASN 132 HB3 ASN 132 2.988 15.631 -6.884 1029 HB3 ASN 132 HB2 ASN 132 3.605 16.216 -5.341 1030 HD21 ASN 132 HD21 ASN 132 3.876 18.315 -5.342 1031 HD22 ASN 132 HD22 ASN 132 4.424 19.278 -6.667 1032 H TRP 133 H TRP 133 7.343 14.205 -6.031 1033 HA TRP 133 HA TRP 133 7.291 13.786 -3.264 1034 HB2 TRP 133 HB3 TRP 133 9.647 14.238 -5.099 1035 HB3 TRP 133 HB2 TRP 133 9.754 13.621 -3.452 1036 HD1 TRP 133 HD1 TRP 133 8.345 12.622 -6.901 1037 HE1 TRP 133 HE1 TRP 133 8.159 10.057 -6.986 1038 HE3 TRP 133 HE3 TRP 133 9.654 11.554 -2.076 1039 HZ2 TRP 133 HZ2 TRP 133 8.525 7.870 -5.241 1040 HZ3 TRP 133 HZ3 TRP 133 9.712 9.199 -1.364 1041 HH2 TRP 133 HH2 TRP 133 9.157 7.396 -2.916 1042 H ASP 134 H ASP 134 8.071 16.705 -5.112 1043 HA ASP 134 HA ASP 134 9.448 18.107 -3.149 1044 HB2 ASP 134 HB3 ASP 134 8.278 18.663 -5.683 1045 HB3 ASP 134 HB2 ASP 134 7.753 19.918 -4.566 1046 H ASP 135 H ASP 135 5.960 17.827 -3.700 1047 HA ASP 135 HA ASP 135 5.240 19.644 -1.634 1048 HB2 ASP 135 HB3 ASP 135 3.814 17.758 -3.425 1049 HB3 ASP 135 HB2 ASP 135 2.990 18.200 -1.932 1050 H PHE 136 H PHE 136 6.596 16.627 -1.401 1051 HA PHE 136 HA PHE 136 5.401 16.223 1.261 1052 HB2 PHE 136 HB3 PHE 136 6.224 14.152 -0.776 1053 HB3 PHE 136 HB2 PHE 136 5.927 13.766 0.916 1054 HD1 PHE 136 HD1 PHE 136 3.608 14.748 1.816 1055 HD2 PHE 136 HD2 PHE 136 4.497 13.821 -2.240 1056 HE1 PHE 136 HE1 PHE 136 1.204 14.521 1.346 1057 HE2 PHE 136 HE2 PHE 136 2.094 13.590 -2.718 1058 HZ PHE 136 HZ PHE 136 0.444 13.941 -0.924 1059 H THR 137 H THR 137 6.763 16.100 2.917 1060 HA THR 137 HA THR 137 9.649 16.027 2.316 1061 HB THR 137 HB THR 137 8.108 17.458 4.477 1062 HG1 THR 137 HG1 THR 137 9.950 18.371 2.526 1063 HG21 THR 137 HG21 THR 137 10.231 18.283 5.350 1064 HG22 THR 137 HG22 THR 137 11.098 17.183 4.277 1065 HG23 THR 137 HG23 THR 137 10.070 16.539 5.558 1066 H LYS 138 H LYS 138 11.016 14.780 3.550 1067 HA LYS 138 HA LYS 138 9.919 12.408 4.651 1068 HB2 LYS 138 HB3 LYS 138 12.222 12.787 3.537 1069 HB3 LYS 138 HB2 LYS 138 12.737 13.319 5.132 1070 HG2 LYS 138 HG3 LYS 138 13.042 11.222 5.746 1071 HG3 LYS 138 HG2 LYS 138 11.344 10.869 5.437 1072 HD2 LYS 138 HD3 LYS 138 12.810 9.377 4.170 1073 HD3 LYS 138 HD2 LYS 138 11.853 10.404 3.100 1074 HE2 LYS 138 HE3 LYS 138 13.686 11.731 2.536 1075 HE3 LYS 138 HE2 LYS 138 14.616 11.205 3.938 1076 HZ1 LYS 138 HZ1 LYS 138 15.084 9.162 2.951 1077 HZ2 LYS 138 HZ2 LYS 138 15.258 10.266 1.682 1078 HZ3 LYS 138 HZ3 LYS 138 13.861 9.319 1.792 1079 H VAL 139 H VAL 139 8.978 12.247 6.551 1080 HA VAL 139 HA VAL 139 9.667 14.135 8.668 1081 HB VAL 139 HB VAL 139 7.730 12.652 9.817 1082 HG11 VAL 139 HG11 VAL 139 7.790 15.096 9.526 1083 HG12 VAL 139 HG12 VAL 139 6.191 14.417 9.221 1084 HG13 VAL 139 HG13 VAL 139 7.219 14.895 7.869 1085 HG21 VAL 139 HG21 VAL 139 7.582 11.273 7.693 1086 HG22 VAL 139 HG22 VAL 139 6.888 12.703 6.930 1087 HG23 VAL 139 HG23 VAL 139 6.068 11.947 8.297 1088 H SER 140 H SER 140 9.931 10.744 7.857 1089 HA SER 140 HA SER 140 11.713 10.405 10.144 1090 HB2 SER 140 HB3 SER 140 9.051 9.341 10.087 1091 HB3 SER 140 HB2 SER 140 10.203 8.008 10.035 1092 HG SER 140 HG SER 140 9.575 8.829 12.181 1093 H SER 141 H SER 141 13.185 8.667 9.932 1094 HA SER 141 HA SER 141 13.153 7.052 7.538 1095 HB2 SER 141 HB3 SER 141 15.428 7.849 6.816 1096 HB3 SER 141 HB2 SER 141 14.138 9.030 6.591 1097 HG SER 141 HG SER 141 16.130 9.827 7.585 1098 H ARG 142 H ARG 142 13.926 5.115 8.030 1099 HA ARG 142 HA ARG 142 16.077 4.867 9.999 1100 HB2 ARG 142 HB3 ARG 142 13.774 4.547 11.067 1101 HB3 ARG 142 HB2 ARG 142 13.658 3.073 10.116 1102 HG2 ARG 142 HG3 ARG 142 14.413 2.424 12.248 1103 HG3 ARG 142 HG2 ARG 142 15.824 2.353 11.190 1104 HD2 ARG 142 HD3 ARG 142 16.298 4.743 11.998 1105 HD3 ARG 142 HD2 ARG 142 15.140 4.394 13.281 1106 HE ARG 142 HE ARG 142 17.819 3.383 13.040 1107 HH11 ARG 142 HH11 ARG 142 14.661 2.816 14.412 1108 HH12 ARG 142 HH12 ARG 142 15.260 1.820 15.696 1109 HH21 ARG 142 HH21 ARG 142 18.609 2.074 14.728 1110 HH22 ARG 142 HH22 ARG 142 17.502 1.400 15.876 1111 H THR 143 H THR 143 17.606 3.487 9.347 1112 HA THR 143 HA THR 143 17.005 1.772 7.040 1113 HB THR 143 HB THR 143 19.738 2.533 8.065 1114 HG1 THR 143 HG1 THR 143 18.684 4.429 7.503 1115 HG21 THR 143 HG21 THR 143 18.879 0.814 5.989 1116 HG22 THR 143 HG22 THR 143 20.522 1.282 6.428 1117 HG23 THR 143 HG23 THR 143 19.616 2.238 5.255 1118 H VAL 144 H VAL 144 16.646 -0.291 7.471 1119 HA VAL 144 HA VAL 144 17.996 -1.516 9.780 1120 HB VAL 144 HB VAL 144 16.084 -3.325 9.160 1121 HG11 VAL 144 HG11 VAL 144 16.453 -2.549 11.379 1122 HG12 VAL 144 HG12 VAL 144 14.750 -2.283 11.007 1123 HG13 VAL 144 HG13 VAL 144 15.882 -0.931 10.971 1124 HG21 VAL 144 HG21 VAL 144 13.978 -2.162 8.730 1125 HG22 VAL 144 HG22 VAL 144 15.112 -1.948 7.396 1126 HG23 VAL 144 HG23 VAL 144 14.852 -0.640 8.550 1127 H GLU 145 H GLU 145 19.351 -3.184 9.459 1128 HA GLU 145 HA GLU 145 19.433 -4.385 6.770 1129 HB2 GLU 145 HB3 GLU 145 21.941 -4.667 7.263 1130 HB3 GLU 145 HB2 GLU 145 21.364 -3.067 6.816 1131 HG2 GLU 145 HG3 GLU 145 21.826 -2.185 8.832 1132 HG3 GLU 145 HG2 GLU 145 21.403 -3.661 9.698 1133 H ASP 146 H ASP 146 19.864 -6.561 6.617 1134 HA ASP 146 HA ASP 146 19.692 -8.062 9.144 1135 HB2 ASP 146 HB3 ASP 146 18.520 -8.485 6.435 1136 HB3 ASP 146 HB2 ASP 146 18.958 -9.913 7.366 1137 H THR 147 H THR 147 20.443 -10.549 8.371 1138 HA THR 147 HA THR 147 23.235 -10.430 8.387 1139 HB THR 147 HB THR 147 22.086 -12.384 9.216 1140 HG1 THR 147 HG1 THR 147 23.487 -13.134 6.872 1141 HG21 THR 147 HG21 THR 147 20.349 -12.190 7.192 1142 HG22 THR 147 HG22 THR 147 20.599 -13.666 8.124 1143 HG23 THR 147 HG23 THR 147 21.398 -13.461 6.565 1144 H ASN 148 H ASN 148 20.961 -10.964 5.735 1145 HA ASN 148 HA ASN 148 23.115 -11.134 3.796 1146 HB2 ASN 148 HB3 ASN 148 20.204 -11.651 3.802 1147 HB3 ASN 148 HB2 ASN 148 20.859 -11.033 2.288 1148 HD21 ASN 148 HD21 ASN 148 19.987 -13.755 3.679 1149 HD22 ASN 148 HD22 ASN 148 21.129 -14.862 3.005 1150 HA PRO 149 HA PRO 149 23.205 -6.783 2.957 1151 HB2 PRO 149 HB3 PRO 149 24.169 -6.870 0.398 1152 HB3 PRO 149 HB2 PRO 149 25.176 -7.084 1.834 1153 HG2 PRO 149 HG3 PRO 149 23.998 -9.152 0.020 1154 HG3 PRO 149 HG2 PRO 149 25.619 -9.082 0.735 1155 HD2 PRO 149 HD3 PRO 149 23.687 -10.662 1.744 1156 HD3 PRO 149 HD2 PRO 149 24.886 -9.866 2.785 1157 H ALA 150 H ALA 150 21.558 -9.034 0.844 1158 HA ALA 150 HA ALA 150 20.198 -6.994 -0.660 1159 HB1 ALA 150 HB1 ALA 150 20.265 -9.947 -0.640 1160 HB2 ALA 150 HB2 ALA 150 20.335 -8.816 -1.992 1161 HB3 ALA 150 HB3 ALA 150 18.786 -9.193 -1.236 1162 H LEU 151 H LEU 151 19.650 -8.664 2.313 1163 HA LEU 151 HA LEU 151 16.802 -8.136 2.316 1164 HB2 LEU 151 HB3 LEU 151 18.695 -9.456 4.223 1165 HB3 LEU 151 HB2 LEU 151 17.099 -8.977 4.764 1166 HG LEU 151 HG LEU 151 17.842 -11.068 2.742 1167 HD11 LEU 151 HD11 LEU 151 17.348 -11.262 5.376 1168 HD12 LEU 151 HD12 LEU 151 16.987 -12.542 4.217 1169 HD13 LEU 151 HD13 LEU 151 15.711 -11.442 4.743 1170 HD21 LEU 151 HD21 LEU 151 15.360 -11.261 2.317 1171 HD22 LEU 151 HD22 LEU 151 16.163 -9.878 1.573 1172 HD23 LEU 151 HD23 LEU 151 15.200 -9.658 3.034 1173 H THR 152 H THR 152 19.206 -6.068 2.552 1174 HA THR 152 HA THR 152 18.522 -4.717 5.007 1175 HB THR 152 HB THR 152 20.164 -3.653 2.703 1176 HG1 THR 152 HG1 THR 152 20.889 -5.326 4.861 1177 HG21 THR 152 HG21 THR 152 19.835 -2.852 5.553 1178 HG22 THR 152 HG22 THR 152 19.899 -1.853 4.102 1179 HG23 THR 152 HG23 THR 152 21.373 -2.587 4.733 1180 H HIS 153 H HIS 153 16.822 -3.422 5.240 1181 HA HIS 153 HA HIS 153 15.742 -2.089 2.841 1182 HB2 HIS 153 HB3 HIS 153 13.966 -2.666 5.169 1183 HB3 HIS 153 HB2 HIS 153 13.571 -2.554 3.458 1184 HD1 HIS 153 HD1 HIS 153 13.049 -4.940 5.685 1185 HD2 HIS 153 HD2 HIS 153 15.580 -4.947 2.391 1186 HE1 HIS 153 HE1 HIS 153 13.394 -7.362 5.108 1187 HE2 HIS 153 HE2 HIS 153 14.848 -7.339 3.051 1188 H THR 154 H THR 154 14.482 -0.110 3.314 1189 HA THR 154 HA THR 154 15.417 1.294 5.719 1190 HB THR 154 HB THR 154 15.320 2.586 2.993 1191 HG1 THR 154 HG1 THR 154 17.063 1.464 2.653 1192 HG21 THR 154 HG21 THR 154 16.276 4.436 3.903 1193 HG22 THR 154 HG22 THR 154 17.030 3.539 5.221 1194 HG23 THR 154 HG23 THR 154 15.303 3.895 5.271 1195 H TYR 155 H TYR 155 13.754 2.064 6.827 1196 HA TYR 155 HA TYR 155 11.161 2.355 5.525 1197 HB2 TYR 155 HB3 TYR 155 12.113 1.932 8.287 1198 HB3 TYR 155 HB2 TYR 155 10.713 2.989 8.138 1199 HD1 TYR 155 HD1 TYR 155 8.706 2.090 6.795 1200 HD2 TYR 155 HD2 TYR 155 11.843 -0.384 8.258 1201 HE1 TYR 155 HE1 TYR 155 7.239 0.126 6.602 1202 HE2 TYR 155 HE2 TYR 155 10.385 -2.355 8.068 1203 HH TYR 155 HH TYR 155 7.085 -2.172 7.688 1204 H GLU 156 H GLU 156 10.485 4.262 4.801 1205 HA GLU 156 HA GLU 156 11.554 6.696 6.072 1206 HB2 GLU 156 HB3 GLU 156 10.834 6.429 3.153 1207 HB3 GLU 156 HB2 GLU 156 11.624 7.790 3.937 1208 HG2 GLU 156 HG3 GLU 156 13.379 5.872 4.547 1209 HG3 GLU 156 HG2 GLU 156 12.733 5.203 3.050 1210 H VAL 157 H VAL 157 10.162 8.303 6.546 1211 HA VAL 157 HA VAL 157 7.319 7.825 5.954 1212 HB VAL 157 HB VAL 157 8.319 9.529 8.228 1213 HG11 VAL 157 HG11 VAL 157 5.872 8.263 8.802 1214 HG12 VAL 157 HG12 VAL 157 5.744 8.856 7.147 1215 HG13 VAL 157 HG13 VAL 157 6.149 9.968 8.454 1216 HG21 VAL 157 HG21 VAL 157 7.580 6.607 8.374 1217 HG22 VAL 157 HG22 VAL 157 8.063 7.643 9.717 1218 HG23 VAL 157 HG23 VAL 157 9.226 7.237 8.455 1219 H TRP 158 H TRP 158 6.037 9.551 5.373 1220 HA TRP 158 HA TRP 158 7.347 12.102 4.768 1221 HB2 TRP 158 HB3 TRP 158 5.844 10.498 2.698 1222 HB3 TRP 158 HB2 TRP 158 6.425 12.143 2.476 1223 HD1 TRP 158 HD1 TRP 158 7.955 8.669 3.319 1224 HE1 TRP 158 HE1 TRP 158 10.244 8.517 2.152 1225 HE3 TRP 158 HE3 TRP 158 8.130 13.345 1.261 1226 HZ2 TRP 158 HZ2 TRP 158 11.904 10.162 0.569 1227 HZ3 TRP 158 HZ3 TRP 158 10.103 13.977 -0.066 1228 HH2 TRP 158 HH2 TRP 158 11.951 12.417 -0.403 1229 H GLN 159 H GLN 159 6.102 13.844 5.019 1230 HA GLN 159 HA GLN 159 3.192 13.528 5.146 1231 HB2 GLN 159 HB3 GLN 159 4.953 14.091 7.391 1232 HB3 GLN 159 HB2 GLN 159 3.767 15.368 7.162 1233 HG2 GLN 159 HG3 GLN 159 2.452 12.856 6.928 1234 HG3 GLN 159 HG2 GLN 159 3.429 12.852 8.395 1235 HE21 GLN 159 HE21 GLN 159 2.759 13.984 10.122 1236 HE22 GLN 159 HE22 GLN 159 1.337 14.964 10.163 1237 H LYS 160 H LYS 160 2.129 15.151 4.139 1238 HA LYS 160 HA LYS 160 3.475 17.014 2.572 1239 HB2 LYS 160 HB3 LYS 160 1.030 16.149 2.447 1240 HB3 LYS 160 HB2 LYS 160 0.669 17.485 3.531 1241 HG2 LYS 160 HG3 LYS 160 2.253 18.183 1.154 1242 HG3 LYS 160 HG2 LYS 160 0.599 17.651 0.845 1243 HD2 LYS 160 HD3 LYS 160 0.936 19.586 3.045 1244 HD3 LYS 160 HD2 LYS 160 1.280 20.198 1.426 1245 HE2 LYS 160 HE3 LYS 160 -1.039 18.819 1.024 1246 HE3 LYS 160 HE2 LYS 160 -1.269 19.438 2.658 1247 HZ1 LYS 160 HZ1 LYS 160 -0.296 21.580 1.310 1248 HZ2 LYS 160 HZ2 LYS 160 -1.929 21.296 1.650 1249 HZ3 LYS 160 HZ3 LYS 160 -1.286 20.840 0.154 1250 H LYS 161 H LYS 161 4.107 19.080 2.830 1251 HA LYS 161 HA LYS 161 4.266 20.101 5.527 1252 HB2 LYS 161 HB3 LYS 161 5.467 20.790 2.897 1253 HB3 LYS 161 HB2 LYS 161 5.344 22.081 4.084 1254 HG2 LYS 161 HG3 LYS 161 6.764 21.004 5.583 1255 HG3 LYS 161 HG2 LYS 161 6.561 19.439 4.793 1256 HD2 LYS 161 HD3 LYS 161 8.742 20.302 4.257 1257 HD3 LYS 161 HD2 LYS 161 7.740 20.350 2.805 1258 HE2 LYS 161 HE3 LYS 161 7.215 22.783 3.618 1259 HE3 LYS 161 HE2 LYS 161 8.721 22.591 4.515 1260 HZ1 LYS 161 HZ1 LYS 161 8.788 21.831 1.708 1261 HZ2 LYS 161 HZ2 LYS 161 9.947 22.637 2.640 1262 HZ3 LYS 161 HZ3 LYS 161 8.619 23.485 2.024 1263 H ALA 162 H ALA 162 3.267 21.891 6.353 1264 HA ALA 162 HA ALA 162 1.650 23.467 6.636 1265 HB1 ALA 162 HB1 ALA 162 1.201 24.984 4.798 1266 HB2 ALA 162 HB2 ALA 162 1.920 23.848 3.656 1267 HB3 ALA 162 HB3 ALA 162 2.925 24.623 4.880 1268 H51A NDP 170 H51A NDP 170 -4.380 -1.718 -11.374 1269 H52A NDP 170 H52A NDP 170 -4.823 -0.395 -10.279 1270 H4B NDP 170 H4B NDP 170 -6.733 -2.468 -11.440 1271 H3B NDP 170 H3B NDP 170 -6.341 0.466 -12.055 1272 HO3A NDP 170 HO3A NDP 170 -6.857 -1.919 -13.550 1273 H2B NDP 170 H2B NDP 170 -8.708 0.579 -12.436 1274 H1B NDP 170 H1B NDP 170 -9.419 -0.843 -10.180 1275 H8A NDP 170 H8A NDP 170 -6.335 1.349 -9.700 1276 H61A NDP 170 H61A NDP 170 -10.352 5.661 -7.762 1277 H62A NDP 170 H62A NDP 170 -8.661 5.264 -7.962 1278 H2A NDP 170 H2A NDP 170 -12.702 2.187 -9.354 1279 H51N NDP 170 H51N NDP 170 -1.236 -4.250 -7.101 1280 H52N NDP 170 H52N NDP 170 -0.421 -3.299 -8.355 1281 H4D NDP 170 H4D NDP 170 0.911 -5.345 -8.967 1282 H3D NDP 170 H3D NDP 170 -0.524 -6.577 -6.604 1283 HO3N NDP 170 HO3N NDP 170 0.275 -7.358 -9.236 1284 H2D NDP 170 H2D NDP 170 1.522 -7.743 -6.122 1285 HO2N NDP 170 HO2N NDP 170 3.040 -6.773 -8.198 1286 H1D NDP 170 H1D NDP 170 3.171 -5.555 -6.483 1287 H2N NDP 170 H2N NDP 170 3.730 -5.231 -4.183 1288 H71N NDP 170 H71N NDP 170 5.566 -4.496 -1.636 1289 H72N NDP 170 H72N NDP 170 5.129 -5.153 -3.191 1290 H41N NDP 170 H41N NDP 170 0.679 -4.065 -1.896 1291 H42N NDP 170 H42N NDP 170 0.771 -5.834 -1.590 1292 H5N NDP 170 H5N NDP 170 -1.119 -5.261 -3.115 1293 H6N NDP 170 H6N NDP 170 -0.417 -5.663 -5.480 Start of MODEL 7 1 H1 THR 1 HT1 THR 1 -4.785 10.527 5.333 2 H2 THR 1 HT2 THR 1 -5.057 9.060 6.181 3 H3 THR 1 HT3 THR 1 -6.298 9.730 5.203 4 HA THR 1 HA THR 1 -5.299 7.901 4.107 5 HB THR 1 HB THR 1 -4.202 10.291 2.690 6 HG1 THR 1 HG1 THR 1 -5.977 11.366 2.861 7 HG21 THR 1 HG21 THR 1 -4.570 9.077 0.886 8 HG22 THR 1 HG22 THR 1 -6.272 8.892 1.312 9 HG23 THR 1 HG23 THR 1 -5.080 7.743 1.920 10 H ALA 2 H ALA 2 -3.600 6.592 4.139 11 HA ALA 2 HA ALA 2 -0.902 7.760 4.237 12 HB1 ALA 2 HB1 ALA 2 -1.299 7.090 6.477 13 HB2 ALA 2 HB2 ALA 2 -0.257 5.861 5.759 14 HB3 ALA 2 HB3 ALA 2 -1.980 5.545 5.967 15 H PHE 3 H PHE 3 0.774 6.407 3.396 16 HA PHE 3 HA PHE 3 -0.214 4.336 1.542 17 HB2 PHE 3 HB3 PHE 3 1.632 6.614 1.167 18 HB3 PHE 3 HB2 PHE 3 2.147 5.098 0.438 19 HD1 PHE 3 HD1 PHE 3 -1.264 6.534 0.819 20 HD2 PHE 3 HD2 PHE 3 1.848 5.360 -1.834 21 HE1 PHE 3 HE1 PHE 3 -2.741 6.965 -1.101 22 HE2 PHE 3 HE2 PHE 3 0.378 5.788 -3.758 23 HZ PHE 3 HZ PHE 3 -1.918 6.592 -3.394 24 H LEU 4 H LEU 4 0.652 2.345 1.754 25 HA LEU 4 HA LEU 4 3.279 2.052 2.983 26 HB2 LEU 4 HB3 LEU 4 1.851 1.881 4.886 27 HB3 LEU 4 HB2 LEU 4 0.751 0.810 4.039 28 HG LEU 4 HG LEU 4 2.642 -0.873 3.951 29 HD11 LEU 4 HD11 LEU 4 4.258 -0.431 5.957 30 HD12 LEU 4 HD12 LEU 4 3.892 1.260 5.617 31 HD13 LEU 4 HD13 LEU 4 4.607 0.244 4.365 32 HD21 LEU 4 HD21 LEU 4 2.080 -0.360 6.806 33 HD22 LEU 4 HD22 LEU 4 1.862 -1.826 5.848 34 HD23 LEU 4 HD23 LEU 4 0.687 -0.515 5.735 35 H TRP 5 H TRP 5 4.409 0.881 1.575 36 HA TRP 5 HA TRP 5 3.391 -1.670 0.699 37 HB2 TRP 5 HB3 TRP 5 3.271 -1.307 -1.604 38 HB3 TRP 5 HB2 TRP 5 2.522 0.136 -0.933 39 HD1 TRP 5 HD1 TRP 5 5.608 -1.026 -2.848 40 HE1 TRP 5 HE1 TRP 5 6.824 1.034 -3.794 41 HE3 TRP 5 HE3 TRP 5 2.935 2.645 -0.498 42 HZ2 TRP 5 HZ2 TRP 5 6.672 3.844 -3.574 43 HZ3 TRP 5 HZ3 TRP 5 3.537 4.994 -0.922 44 HH2 TRP 5 HH2 TRP 5 5.366 5.579 -2.428 45 H ALA 6 H ALA 6 5.007 -2.940 -0.476 46 HA ALA 6 HA ALA 6 7.709 -2.214 0.414 47 HB1 ALA 6 HB1 ALA 6 6.670 -4.891 -0.514 48 HB2 ALA 6 HB2 ALA 6 6.797 -4.377 1.168 49 HB3 ALA 6 HB3 ALA 6 8.253 -4.565 0.192 50 H GLN 7 H GLN 7 9.438 -2.098 -0.992 51 HA GLN 7 HA GLN 7 9.044 -2.748 -3.793 52 HB2 GLN 7 HB3 GLN 7 9.689 -0.500 -4.569 53 HB3 GLN 7 HB2 GLN 7 8.168 -0.486 -3.686 54 HG2 GLN 7 HG3 GLN 7 10.263 -0.036 -1.829 55 HG3 GLN 7 HG2 GLN 7 10.511 1.032 -3.209 56 HE21 GLN 7 HE21 GLN 7 8.048 -0.047 -0.911 57 HE22 GLN 7 HE22 GLN 7 7.196 1.455 -0.850 58 H ASP 8 H ASP 8 10.999 -2.695 -5.049 59 HA ASP 8 HA ASP 8 13.300 -3.442 -3.489 60 HB2 ASP 8 HB3 ASP 8 12.595 -3.464 -6.403 61 HB3 ASP 8 HB2 ASP 8 14.265 -3.684 -5.899 62 H ARG 9 H ARG 9 15.479 -2.645 -4.722 63 HA ARG 9 HA ARG 9 15.823 0.011 -3.892 64 HB2 ARG 9 HB3 ARG 9 17.473 -2.103 -4.798 65 HB3 ARG 9 HB2 ARG 9 17.854 -0.698 -5.784 66 HG2 ARG 9 HG3 ARG 9 17.925 -0.855 -2.778 67 HG3 ARG 9 HG2 ARG 9 19.310 -0.778 -3.868 68 HD2 ARG 9 HD3 ARG 9 17.269 1.378 -4.033 69 HD3 ARG 9 HD2 ARG 9 18.364 1.375 -2.652 70 HE ARG 9 HE ARG 9 20.019 1.091 -4.784 71 HH11 ARG 9 HH11 ARG 9 17.527 3.389 -3.953 72 HH12 ARG 9 HH12 ARG 9 18.274 4.697 -4.808 73 HH21 ARG 9 HH21 ARG 9 21.003 2.811 -5.908 74 HH22 ARG 9 HH22 ARG 9 20.246 4.369 -5.918 75 H ASP 10 H ASP 10 14.809 -1.295 -6.939 76 HA ASP 10 HA ASP 10 15.345 1.193 -8.350 77 HB2 ASP 10 HB3 ASP 10 15.396 -1.306 -9.266 78 HB3 ASP 10 HB2 ASP 10 13.688 -0.983 -9.548 79 H GLY 11 H GLY 11 12.671 -0.651 -7.062 80 HA2 GLY 11 HA3 GLY 11 10.939 1.030 -6.132 81 HA3 GLY 11 HA2 GLY 11 10.809 1.500 -7.819 82 H LEU 12 H LEU 12 11.414 -1.783 -7.715 83 HA LEU 12 HA LEU 12 9.029 -2.592 -8.821 84 HB2 LEU 12 HB3 LEU 12 11.317 -3.849 -8.315 85 HB3 LEU 12 HB2 LEU 12 10.405 -4.468 -6.954 86 HG LEU 12 HG LEU 12 8.752 -5.458 -8.469 87 HD11 LEU 12 HD11 LEU 12 10.467 -4.244 -10.635 88 HD12 LEU 12 HD12 LEU 12 8.782 -3.871 -10.275 89 HD13 LEU 12 HD13 LEU 12 9.218 -5.457 -10.910 90 HD21 LEU 12 HD21 LEU 12 11.650 -6.083 -8.761 91 HD22 LEU 12 HD22 LEU 12 10.485 -6.935 -9.774 92 HD23 LEU 12 HD23 LEU 12 10.359 -7.025 -8.017 93 H ILE 13 H ILE 13 7.559 -4.319 -7.699 94 HA ILE 13 HA ILE 13 7.000 -3.828 -4.933 95 HB ILE 13 HB ILE 13 4.751 -3.048 -5.122 96 HG12 ILE 13 HG13 ILE 13 4.911 -2.629 -8.076 97 HG13 ILE 13 HG12 ILE 13 4.503 -4.233 -7.484 98 HG21 ILE 13 HG21 ILE 13 6.471 -1.355 -6.923 99 HG22 ILE 13 HG22 ILE 13 6.560 -1.377 -5.161 100 HG23 ILE 13 HG23 ILE 13 5.091 -0.818 -5.963 101 HD11 ILE 13 HD11 ILE 13 2.578 -3.404 -6.348 102 HD12 ILE 13 HD12 ILE 13 2.547 -2.806 -8.008 103 HD13 ILE 13 HD13 ILE 13 3.035 -1.736 -6.695 104 H GLY 14 H GLY 14 6.113 -5.298 -7.985 105 HA2 GLY 14 HA3 GLY 14 5.737 -7.843 -6.651 106 HA3 GLY 14 HA2 GLY 14 4.315 -7.196 -7.457 107 H LYS 15 H LYS 15 4.956 -9.485 -8.404 108 HA LYS 15 HA LYS 15 6.276 -8.927 -10.961 109 HB2 LYS 15 HB3 LYS 15 7.335 -11.111 -10.959 110 HB3 LYS 15 HB2 LYS 15 7.832 -10.213 -9.532 111 HG2 LYS 15 HG3 LYS 15 7.009 -11.754 -8.160 112 HG3 LYS 15 HG2 LYS 15 5.478 -11.828 -9.031 113 HD2 LYS 15 HD3 LYS 15 7.245 -13.070 -10.747 114 HD3 LYS 15 HD2 LYS 15 7.789 -13.599 -9.154 115 HE2 LYS 15 HE3 LYS 15 4.932 -13.754 -10.101 116 HE3 LYS 15 HE2 LYS 15 6.083 -15.084 -10.223 117 HZ1 LYS 15 HZ1 LYS 15 4.459 -14.599 -8.112 118 HZ2 LYS 15 HZ2 LYS 15 5.929 -13.948 -7.588 119 HZ3 LYS 15 HZ3 LYS 15 5.848 -15.566 -8.074 120 H ASP 16 H ASP 16 3.763 -8.590 -11.075 121 HA ASP 16 HA ASP 16 1.938 -9.219 -12.304 122 HB2 ASP 16 HB3 ASP 16 3.774 -10.968 -13.268 123 HB3 ASP 16 HB2 ASP 16 2.635 -12.085 -12.521 124 H GLY 17 H GLY 17 2.196 -9.352 -9.430 125 HA2 GLY 17 HA3 GLY 17 -0.275 -10.513 -8.776 126 HA3 GLY 17 HA2 GLY 17 0.995 -11.640 -8.324 127 H HIS 18 H HIS 18 2.899 -10.405 -7.146 128 HA HIS 18 HA HIS 18 2.299 -8.143 -5.573 129 HB2 HIS 18 HB3 HIS 18 1.927 -9.164 -3.398 130 HB3 HIS 18 HB2 HIS 18 0.691 -9.713 -4.523 131 HD1 HIS 18 HD1 HIS 18 2.456 -11.038 -1.885 132 HD2 HIS 18 HD2 HIS 18 1.937 -12.321 -5.803 133 HE1 HIS 18 HE1 HIS 18 2.936 -13.506 -1.854 134 HE2 HIS 18 HE2 HIS 18 2.708 -14.242 -4.252 135 H LEU 19 H LEU 19 3.787 -8.561 -3.320 136 HA LEU 19 HA LEU 19 6.424 -8.437 -4.314 137 HB2 LEU 19 HB3 LEU 19 7.075 -8.448 -1.900 138 HB3 LEU 19 HB2 LEU 19 5.916 -7.213 -2.349 139 HG LEU 19 HG LEU 19 4.232 -9.168 -1.527 140 HD11 LEU 19 HD11 LEU 19 5.371 -10.783 -0.495 141 HD12 LEU 19 HD12 LEU 19 5.639 -9.612 0.796 142 HD13 LEU 19 HD13 LEU 19 6.856 -9.833 -0.462 143 HD21 LEU 19 HD21 LEU 19 4.192 -6.836 -0.823 144 HD22 LEU 19 HD22 LEU 19 5.591 -7.114 0.215 145 HD23 LEU 19 HD23 LEU 19 4.058 -7.913 0.568 146 HA PRO 20 HA PRO 20 7.003 -12.911 -4.215 147 HB2 PRO 20 HB3 PRO 20 9.032 -13.037 -5.937 148 HB3 PRO 20 HB2 PRO 20 7.394 -12.659 -6.485 149 HG2 PRO 20 HG3 PRO 20 9.707 -10.823 -6.014 150 HG3 PRO 20 HG2 PRO 20 8.514 -10.806 -7.324 151 HD2 PRO 20 HD3 PRO 20 8.424 -9.196 -5.069 152 HD3 PRO 20 HD2 PRO 20 7.034 -9.578 -6.102 153 H TRP 21 H TRP 21 8.743 -10.544 -2.729 154 HA TRP 21 HA TRP 21 11.053 -12.220 -2.111 155 HB2 TRP 21 HB3 TRP 21 11.802 -10.152 -0.832 156 HB3 TRP 21 HB2 TRP 21 11.684 -9.985 -2.581 157 HD1 TRP 21 HD1 TRP 21 9.390 -9.280 0.478 158 HE1 TRP 21 HE1 TRP 21 8.132 -7.080 0.027 159 HE3 TRP 21 HE3 TRP 21 11.183 -8.264 -4.200 160 HZ2 TRP 21 HZ2 TRP 21 7.924 -5.169 -2.040 161 HZ3 TRP 21 HZ3 TRP 21 10.400 -6.232 -5.347 162 HH2 TRP 21 HH2 TRP 21 8.805 -4.718 -4.288 163 H HIS 22 H HIS 22 11.509 -13.003 -0.086 164 HA HIS 22 HA HIS 22 9.241 -13.287 1.686 165 HB2 HIS 22 HB3 HIS 22 11.081 -15.058 1.007 166 HB3 HIS 22 HB2 HIS 22 11.953 -14.348 2.361 167 HD1 HIS 22 HD1 HIS 22 10.538 -14.367 4.703 168 HD2 HIS 22 HD2 HIS 22 9.315 -16.990 1.721 169 HE1 HIS 22 HE1 HIS 22 9.125 -16.093 5.864 170 HE2 HIS 22 HE2 HIS 22 8.463 -17.715 4.053 171 H LEU 23 H LEU 23 8.951 -11.246 2.574 172 HA LEU 23 HA LEU 23 11.127 -10.278 4.307 173 HB2 LEU 23 HB3 LEU 23 9.329 -8.940 2.478 174 HB3 LEU 23 HB2 LEU 23 9.193 -8.265 4.090 175 HG LEU 23 HG LEU 23 11.820 -8.202 3.953 176 HD11 LEU 23 HD11 LEU 23 11.588 -9.382 1.645 177 HD12 LEU 23 HD12 LEU 23 12.776 -8.097 1.863 178 HD13 LEU 23 HD13 LEU 23 11.243 -7.754 1.061 179 HD21 LEU 23 HD21 LEU 23 10.614 -6.209 4.280 180 HD22 LEU 23 HD22 LEU 23 9.877 -6.296 2.681 181 HD23 LEU 23 HD23 LEU 23 11.594 -5.927 2.841 182 HA PRO 24 HA PRO 24 8.031 -11.893 7.295 183 HB2 PRO 24 HB3 PRO 24 9.852 -12.121 9.327 184 HB3 PRO 24 HB2 PRO 24 9.557 -13.381 8.124 185 HG2 PRO 24 HG3 PRO 24 11.734 -11.333 8.230 186 HG3 PRO 24 HG2 PRO 24 11.831 -13.050 7.796 187 HD2 PRO 24 HD3 PRO 24 11.809 -11.106 5.933 188 HD3 PRO 24 HD2 PRO 24 11.042 -12.683 5.654 189 H ASP 25 H ASP 25 10.592 -9.511 7.952 190 HA ASP 25 HA ASP 25 9.347 -8.279 10.138 191 HB2 ASP 25 HB3 ASP 25 10.874 -6.342 9.498 192 HB3 ASP 25 HB2 ASP 25 11.656 -7.876 9.844 193 H ASP 26 H ASP 26 8.879 -7.955 6.707 194 HA ASP 26 HA ASP 26 7.535 -5.430 6.823 195 HB2 ASP 26 HB3 ASP 26 8.708 -6.483 4.796 196 HB3 ASP 26 HB2 ASP 26 7.248 -7.450 4.607 197 H LEU 27 H LEU 27 6.355 -8.735 6.144 198 HA LEU 27 HA LEU 27 3.644 -8.139 6.199 199 HB2 LEU 27 HB3 LEU 27 3.459 -10.620 6.879 200 HB3 LEU 27 HB2 LEU 27 4.127 -10.213 5.315 201 HG LEU 27 HG LEU 27 6.338 -10.328 7.025 202 HD11 LEU 27 HD11 LEU 27 5.059 -12.943 7.424 203 HD12 LEU 27 HD12 LEU 27 4.423 -11.622 8.405 204 HD13 LEU 27 HD13 LEU 27 6.138 -12.027 8.476 205 HD21 LEU 27 HD21 LEU 27 6.918 -12.302 5.708 206 HD22 LEU 27 HD22 LEU 27 6.266 -11.021 4.686 207 HD23 LEU 27 HD23 LEU 27 5.258 -12.402 5.120 208 H HIS 28 H HIS 28 5.807 -9.135 8.827 209 HA HIS 28 HA HIS 28 3.866 -9.385 10.835 210 HB2 HIS 28 HB3 HIS 28 6.799 -9.104 10.723 211 HB3 HIS 28 HB2 HIS 28 6.063 -8.545 12.221 212 HD1 HIS 28 HD1 HIS 28 4.370 -11.381 10.571 213 HD2 HIS 28 HD2 HIS 28 7.289 -10.806 13.472 214 HE1 HIS 28 HE1 HIS 28 4.612 -13.599 11.730 215 HE2 HIS 28 HE2 HIS 28 6.319 -13.203 13.541 216 H TYR 29 H TYR 29 5.716 -6.599 9.708 217 HA TYR 29 HA TYR 29 4.599 -4.823 11.680 218 HB2 TYR 29 HB3 TYR 29 6.858 -4.456 10.785 219 HB3 TYR 29 HB2 TYR 29 6.188 -4.230 9.173 220 HD1 TYR 29 HD1 TYR 29 5.974 -2.828 12.624 221 HD2 TYR 29 HD2 TYR 29 5.683 -2.086 8.445 222 HE1 TYR 29 HE1 TYR 29 5.727 -0.423 13.074 223 HE2 TYR 29 HE2 TYR 29 5.436 0.321 8.884 224 HH TYR 29 HH TYR 29 6.010 1.696 11.974 225 H PHE 30 H PHE 30 3.806 -5.865 8.472 226 HA PHE 30 HA PHE 30 2.177 -3.695 7.692 227 HB2 PHE 30 HB3 PHE 30 3.093 -5.942 6.457 228 HB3 PHE 30 HB2 PHE 30 1.405 -6.369 6.711 229 HD1 PHE 30 HD2 PHE 30 3.714 -4.111 4.998 230 HD2 PHE 30 HD1 PHE 30 -0.362 -5.191 5.570 231 HE1 PHE 30 HE2 PHE 30 3.090 -2.789 3.019 232 HE2 PHE 30 HE1 PHE 30 -0.993 -3.872 3.591 233 HZ PHE 30 HZ PHE 30 0.734 -2.668 2.313 234 H ARG 31 H ARG 31 1.399 -6.806 9.225 235 HA ARG 31 HA ARG 31 -1.382 -6.076 9.525 236 HB2 ARG 31 HB3 ARG 31 -0.357 -8.445 9.132 237 HB3 ARG 31 HB2 ARG 31 -0.117 -8.432 10.874 238 HG2 ARG 31 HG3 ARG 31 -2.717 -7.649 10.673 239 HG3 ARG 31 HG2 ARG 31 -2.566 -8.761 9.312 240 HD2 ARG 31 HD3 ARG 31 -1.592 -9.479 12.060 241 HD3 ARG 31 HD2 ARG 31 -3.267 -9.728 11.576 242 HE ARG 31 HE ARG 31 -2.558 -11.352 10.025 243 HH11 ARG 31 HH11 ARG 31 0.098 -10.076 11.911 244 HH12 ARG 31 HH12 ARG 31 1.159 -11.384 11.518 245 HH21 ARG 31 HH21 ARG 31 -1.156 -13.065 9.516 246 HH22 ARG 31 HH22 ARG 31 0.451 -13.077 10.162 247 H ALA 32 H ALA 32 1.517 -6.042 11.444 248 HA ALA 32 HA ALA 32 0.286 -5.879 13.994 249 HB1 ALA 32 HB1 ALA 32 2.529 -6.549 13.990 250 HB2 ALA 32 HB2 ALA 32 2.554 -4.917 14.659 251 HB3 ALA 32 HB3 ALA 32 3.026 -5.190 12.981 252 H GLN 33 H GLN 33 0.917 -3.537 11.504 253 HA GLN 33 HA GLN 33 0.353 -1.325 13.334 254 HB2 GLN 33 HB3 GLN 33 1.830 -1.618 10.846 255 HB3 GLN 33 HB2 GLN 33 0.728 -0.249 10.798 256 HG2 GLN 33 HG3 GLN 33 2.232 -0.405 13.281 257 HG3 GLN 33 HG2 GLN 33 3.259 -0.259 11.856 258 HE21 GLN 33 HE21 GLN 33 2.355 1.421 10.239 259 HE22 GLN 33 HE22 GLN 33 1.903 2.937 10.934 260 H THR 34 H THR 34 -1.111 -3.177 10.797 261 HA THR 34 HA THR 34 -3.216 -1.227 10.356 262 HB THR 34 HB THR 34 -4.115 -2.978 8.798 263 HG1 THR 34 HG1 THR 34 -2.505 -4.661 8.325 264 HG21 THR 34 HG21 THR 34 -1.417 -1.788 8.496 265 HG22 THR 34 HG22 THR 34 -2.886 -1.525 7.557 266 HG23 THR 34 HG23 THR 34 -1.939 -2.993 7.319 267 H VAL 35 H VAL 35 -2.876 -2.518 13.013 268 HA VAL 35 HA VAL 35 -5.187 -4.255 13.253 269 HB VAL 35 HB VAL 35 -3.455 -3.177 15.476 270 HG11 VAL 35 HG11 VAL 35 -5.831 -4.429 15.684 271 HG12 VAL 35 HG12 VAL 35 -4.541 -4.572 16.878 272 HG13 VAL 35 HG13 VAL 35 -4.747 -5.821 15.650 273 HG21 VAL 35 HG21 VAL 35 -1.944 -4.293 14.054 274 HG22 VAL 35 HG22 VAL 35 -3.095 -5.584 13.711 275 HG23 VAL 35 HG23 VAL 35 -2.356 -5.463 15.307 276 H GLY 36 H GLY 36 -7.053 -3.128 12.987 277 HA2 GLY 36 HA3 GLY 36 -8.831 -2.012 14.086 278 HA3 GLY 36 HA2 GLY 36 -7.653 -1.137 15.050 279 H LYS 37 H LYS 37 -7.348 -1.421 11.577 280 HA LYS 37 HA LYS 37 -8.343 1.322 11.258 281 HB2 LYS 37 HB3 LYS 37 -6.396 1.872 9.836 282 HB3 LYS 37 HB2 LYS 37 -5.943 1.537 11.501 283 HG2 LYS 37 HG3 LYS 37 -4.811 -0.347 10.964 284 HG3 LYS 37 HG2 LYS 37 -5.865 -0.729 9.601 285 HD2 LYS 37 HD3 LYS 37 -3.919 -0.122 8.521 286 HD3 LYS 37 HD2 LYS 37 -4.798 1.408 8.547 287 HE2 LYS 37 HE3 LYS 37 -3.161 0.954 10.924 288 HE3 LYS 37 HE2 LYS 37 -2.229 1.021 9.429 289 HZ1 LYS 37 HZ1 LYS 37 -2.603 3.199 9.209 290 HZ2 LYS 37 HZ2 LYS 37 -3.019 3.167 10.848 291 HZ3 LYS 37 HZ3 LYS 37 -4.228 3.087 9.668 292 H ILE 38 H ILE 38 -7.924 1.769 8.652 293 HA ILE 38 HA ILE 38 -9.107 -0.531 7.247 294 HB ILE 38 HB ILE 38 -10.105 1.755 5.955 295 HG12 ILE 38 HG13 ILE 38 -11.124 1.969 8.738 296 HG13 ILE 38 HG12 ILE 38 -9.558 2.705 8.407 297 HG21 ILE 38 HG21 ILE 38 -11.701 0.091 7.861 298 HG22 ILE 38 HG22 ILE 38 -11.066 -0.582 6.359 299 HG23 ILE 38 HG23 ILE 38 -12.187 0.779 6.314 300 HD11 ILE 38 HD11 ILE 38 -11.903 3.279 6.652 301 HD12 ILE 38 HD12 ILE 38 -10.448 4.237 6.924 302 HD13 ILE 38 HD13 ILE 38 -11.682 4.132 8.180 303 H MET 39 H MET 39 -8.067 -1.077 5.450 304 HA MET 39 HA MET 39 -6.311 0.936 4.196 305 HB2 MET 39 HB3 MET 39 -4.836 -0.897 3.517 306 HB3 MET 39 HB2 MET 39 -5.018 -0.843 5.265 307 HG2 MET 39 HG3 MET 39 -5.207 -3.081 4.876 308 HG3 MET 39 HG2 MET 39 -6.901 -2.596 4.831 309 HE1 MET 39 HE1 MET 39 -5.355 -5.425 2.314 310 HE2 MET 39 HE2 MET 39 -7.002 -5.375 2.942 311 HE3 MET 39 HE3 MET 39 -5.637 -5.097 4.024 312 H VAL 40 H VAL 40 -6.350 1.162 1.996 313 HA VAL 40 HA VAL 40 -8.605 -0.106 0.630 314 HB VAL 40 HB VAL 40 -6.874 2.147 -0.385 315 HG11 VAL 40 HG11 VAL 40 -8.432 0.679 -1.889 316 HG12 VAL 40 HG12 VAL 40 -8.411 2.433 -2.073 317 HG13 VAL 40 HG13 VAL 40 -9.711 1.657 -1.168 318 HG21 VAL 40 HG21 VAL 40 -9.566 2.463 0.917 319 HG22 VAL 40 HG22 VAL 40 -8.394 3.713 0.502 320 HG23 VAL 40 HG23 VAL 40 -8.058 2.594 1.823 321 H VAL 41 H VAL 41 -8.394 -1.501 -1.027 322 HA VAL 41 HA VAL 41 -5.682 -1.987 -2.065 323 HB VAL 41 HB VAL 41 -6.800 -3.736 -0.433 324 HG11 VAL 41 HG11 VAL 41 -7.718 -5.027 -2.941 325 HG12 VAL 41 HG12 VAL 41 -8.768 -3.817 -2.205 326 HG13 VAL 41 HG13 VAL 41 -8.281 -5.239 -1.283 327 HG21 VAL 41 HG21 VAL 41 -4.766 -4.446 -1.070 328 HG22 VAL 41 HG22 VAL 41 -5.028 -4.021 -2.761 329 HG23 VAL 41 HG23 VAL 41 -5.689 -5.524 -2.117 330 H GLY 42 H GLY 42 -5.540 -2.777 -4.236 331 HA2 GLY 42 HA3 GLY 42 -7.586 -1.653 -5.947 332 HA3 GLY 42 HA2 GLY 42 -6.057 -2.348 -6.463 333 H ARG 43 H ARG 43 -8.340 -2.868 -7.892 334 HA ARG 43 HA ARG 43 -9.833 -5.091 -7.180 335 HB2 ARG 43 HB3 ARG 43 -10.369 -3.711 -9.115 336 HB3 ARG 43 HB2 ARG 43 -8.911 -4.257 -9.932 337 HG2 ARG 43 HG3 ARG 43 -9.989 -6.630 -9.546 338 HG3 ARG 43 HG2 ARG 43 -11.475 -5.682 -9.466 339 HD2 ARG 43 HD3 ARG 43 -9.481 -5.535 -11.720 340 HD3 ARG 43 HD2 ARG 43 -10.935 -6.533 -11.737 341 HE ARG 43 HE ARG 43 -11.114 -3.623 -11.369 342 HH11 ARG 43 HH11 ARG 43 -11.908 -6.500 -13.198 343 HH12 ARG 43 HH12 ARG 43 -13.106 -5.702 -14.157 344 HH21 ARG 43 HH21 ARG 43 -12.685 -2.591 -12.631 345 HH22 ARG 43 HH22 ARG 43 -13.547 -3.484 -13.839 346 H ARG 44 H ARG 44 -7.003 -5.097 -9.347 347 HA ARG 44 HA ARG 44 -6.708 -7.858 -9.516 348 HB2 ARG 44 HB3 ARG 44 -5.036 -5.500 -10.080 349 HB3 ARG 44 HB2 ARG 44 -4.139 -6.981 -9.775 350 HG2 ARG 44 HG3 ARG 44 -4.501 -6.777 -12.126 351 HG3 ARG 44 HG2 ARG 44 -5.496 -8.103 -11.521 352 HD2 ARG 44 HD3 ARG 44 -6.901 -5.569 -11.435 353 HD3 ARG 44 HD2 ARG 44 -6.342 -5.954 -13.062 354 HE ARG 44 HE ARG 44 -8.444 -7.237 -11.622 355 HH11 ARG 44 HH11 ARG 44 -5.961 -7.760 -14.017 356 HH12 ARG 44 HH12 ARG 44 -6.792 -9.078 -14.772 357 HH21 ARG 44 HH21 ARG 44 -9.539 -8.970 -12.614 358 HH22 ARG 44 HH22 ARG 44 -8.824 -9.765 -13.976 359 H THR 45 H THR 45 -5.964 -5.728 -6.917 360 HA THR 45 HA THR 45 -3.998 -7.411 -5.688 361 HB THR 45 HB THR 45 -5.538 -5.335 -4.183 362 HG1 THR 45 HG1 THR 45 -5.112 -4.195 -5.985 363 HG21 THR 45 HG21 THR 45 -2.740 -6.377 -4.151 364 HG22 THR 45 HG22 THR 45 -3.891 -6.221 -2.825 365 HG23 THR 45 HG23 THR 45 -3.120 -4.784 -3.497 366 H TYR 46 H TYR 46 -7.424 -6.654 -4.922 367 HA TYR 46 HA TYR 46 -7.673 -8.260 -2.692 368 HB2 TYR 46 HB3 TYR 46 -10.036 -8.219 -2.997 369 HB3 TYR 46 HB2 TYR 46 -9.426 -6.686 -3.600 370 HD1 TYR 46 HD2 TYR 46 -10.135 -10.115 -4.951 371 HD2 TYR 46 HD1 TYR 46 -10.411 -5.907 -5.536 372 HE1 TYR 46 HE2 TYR 46 -11.288 -10.491 -7.074 373 HE2 TYR 46 HE1 TYR 46 -11.583 -6.281 -7.657 374 HH TYR 46 HH TYR 46 -12.867 -7.971 -8.785 375 H GLU 47 H GLU 47 -7.840 -9.191 -6.088 376 HA GLU 47 HA GLU 47 -8.445 -11.946 -5.451 377 HB2 GLU 47 HB3 GLU 47 -8.535 -10.283 -7.779 378 HB3 GLU 47 HB2 GLU 47 -7.554 -11.697 -8.136 379 HG2 GLU 47 HG3 GLU 47 -10.154 -12.104 -6.772 380 HG3 GLU 47 HG2 GLU 47 -10.162 -11.685 -8.484 381 H SER 48 H SER 48 -5.670 -9.985 -5.921 382 HA SER 48 HA SER 48 -3.948 -12.364 -6.120 383 HB2 SER 48 HB3 SER 48 -2.290 -11.041 -7.136 384 HB3 SER 48 HB2 SER 48 -3.794 -10.454 -7.844 385 HG SER 48 HG SER 48 -2.247 -9.264 -5.793 386 H PHE 49 H PHE 49 -5.223 -11.302 -3.654 387 HA PHE 49 HA PHE 49 -2.915 -10.345 -2.138 388 HB2 PHE 49 HB3 PHE 49 -5.552 -9.648 -2.008 389 HB3 PHE 49 HB2 PHE 49 -5.440 -10.819 -0.699 390 HD1 PHE 49 HD1 PHE 49 -3.210 -8.105 -1.985 391 HD2 PHE 49 HD2 PHE 49 -5.252 -9.810 1.339 392 HE1 PHE 49 HE1 PHE 49 -2.258 -6.377 -0.517 393 HE2 PHE 49 HE2 PHE 49 -4.302 -8.084 2.811 394 HZ PHE 49 HZ PHE 49 -2.803 -6.365 1.884 395 HA PRO 50 HA PRO 50 -2.090 -14.369 -0.506 396 HB2 PRO 50 HB3 PRO 50 -0.646 -13.726 1.673 397 HB3 PRO 50 HB2 PRO 50 -0.028 -13.495 0.033 398 HG2 PRO 50 HG3 PRO 50 -1.232 -11.492 1.904 399 HG3 PRO 50 HG2 PRO 50 0.192 -11.332 0.860 400 HD2 PRO 50 HD3 PRO 50 -2.267 -10.342 0.211 401 HD3 PRO 50 HD2 PRO 50 -1.071 -10.853 -0.996 402 H LYS 51 H LYS 51 -3.833 -12.014 1.381 403 HA LYS 51 HA LYS 51 -5.361 -14.082 2.649 404 HB2 LYS 51 HB3 LYS 51 -3.058 -13.304 3.995 405 HB3 LYS 51 HB2 LYS 51 -4.332 -12.379 4.778 406 HG2 LYS 51 HG3 LYS 51 -4.732 -15.295 4.322 407 HG3 LYS 51 HG2 LYS 51 -3.684 -14.757 5.636 408 HD2 LYS 51 HD3 LYS 51 -5.605 -13.266 6.363 409 HD3 LYS 51 HD2 LYS 51 -6.606 -14.171 5.227 410 HE2 LYS 51 HE3 LYS 51 -4.963 -15.603 7.277 411 HE3 LYS 51 HE2 LYS 51 -6.520 -14.902 7.714 412 HZ1 LYS 51 HZ1 LYS 51 -6.081 -16.873 5.536 413 HZ2 LYS 51 HZ2 LYS 51 -7.573 -16.230 6.008 414 HZ3 LYS 51 HZ3 LYS 51 -6.712 -17.231 7.065 415 H ARG 52 H ARG 52 -7.008 -12.955 1.533 416 HA ARG 52 HA ARG 52 -7.785 -10.427 2.823 417 HB2 ARG 52 HB3 ARG 52 -9.058 -10.057 0.582 418 HB3 ARG 52 HB2 ARG 52 -7.337 -9.715 0.670 419 HG2 ARG 52 HG3 ARG 52 -7.325 -10.899 -1.247 420 HG3 ARG 52 HG2 ARG 52 -7.214 -12.259 -0.136 421 HD2 ARG 52 HD3 ARG 52 -9.875 -11.994 -0.232 422 HD3 ARG 52 HD2 ARG 52 -9.470 -11.365 -1.827 423 HE ARG 52 HE ARG 52 -8.092 -13.622 -1.847 424 HH11 ARG 52 HH11 ARG 52 -11.361 -13.039 -0.756 425 HH12 ARG 52 HH12 ARG 52 -11.900 -14.641 -1.131 426 HH21 ARG 52 HH21 ARG 52 -8.806 -15.723 -2.340 427 HH22 ARG 52 HH22 ARG 52 -10.452 -16.163 -2.030 428 HA PRO 53 HA PRO 53 -9.209 -9.332 3.512 429 HB2 PRO 53 HB3 PRO 53 -10.861 -8.989 5.592 430 HB3 PRO 53 HB2 PRO 53 -11.423 -8.809 3.927 431 HG2 PRO 53 HG3 PRO 53 -11.812 -11.072 5.826 432 HG3 PRO 53 HG2 PRO 53 -12.926 -10.415 4.614 433 HD2 PRO 53 HD3 PRO 53 -11.345 -12.693 4.306 434 HD3 PRO 53 HD2 PRO 53 -12.115 -11.784 2.992 435 H LEU 54 H LEU 54 -7.909 -8.616 5.225 436 HA LEU 54 HA LEU 54 -6.489 -10.633 6.620 437 HB2 LEU 54 HB3 LEU 54 -6.444 -7.640 6.654 438 HB3 LEU 54 HB2 LEU 54 -5.508 -8.552 7.821 439 HG LEU 54 HG LEU 54 -5.177 -9.246 4.948 440 HD11 LEU 54 HD11 LEU 54 -5.169 -6.767 5.013 441 HD12 LEU 54 HD12 LEU 54 -3.613 -7.464 4.561 442 HD13 LEU 54 HD13 LEU 54 -3.859 -6.838 6.191 443 HD21 LEU 54 HD21 LEU 54 -3.081 -8.883 7.060 444 HD22 LEU 54 HD22 LEU 54 -3.033 -9.887 5.610 445 HD23 LEU 54 HD23 LEU 54 -4.057 -10.349 6.971 446 HA PRO 55 HA PRO 55 -8.936 -10.940 10.288 447 HB2 PRO 55 HB3 PRO 55 -6.590 -11.788 11.788 448 HB3 PRO 55 HB2 PRO 55 -7.978 -12.741 11.263 449 HG2 PRO 55 HG3 PRO 55 -5.489 -13.055 10.224 450 HG3 PRO 55 HG2 PRO 55 -6.971 -13.369 9.302 451 HD2 PRO 55 HD3 PRO 55 -5.173 -10.974 9.244 452 HD3 PRO 55 HD2 PRO 55 -5.968 -11.822 7.900 453 H GLU 56 H GLU 56 -9.372 -9.931 12.211 454 HA GLU 56 HA GLU 56 -9.422 -8.229 13.709 455 HB2 GLU 56 HB3 GLU 56 -6.621 -9.185 13.704 456 HB3 GLU 56 HB2 GLU 56 -6.916 -7.641 14.491 457 HG2 GLU 56 HG3 GLU 56 -7.653 -8.679 16.292 458 HG3 GLU 56 HG2 GLU 56 -8.918 -9.461 15.345 459 H ARG 57 H ARG 57 -9.188 -7.491 10.850 460 HA ARG 57 HA ARG 57 -8.548 -4.703 11.317 461 HB2 ARG 57 HB3 ARG 57 -6.955 -4.431 9.598 462 HB3 ARG 57 HB2 ARG 57 -6.423 -5.829 10.518 463 HG2 ARG 57 HG3 ARG 57 -6.126 -6.593 8.393 464 HG3 ARG 57 HG2 ARG 57 -7.768 -7.152 8.703 465 HD2 ARG 57 HD3 ARG 57 -7.256 -5.965 6.470 466 HD3 ARG 57 HD2 ARG 57 -8.716 -5.522 7.350 467 HE ARG 57 HE ARG 57 -7.870 -3.417 7.581 468 HH11 ARG 57 HH11 ARG 57 -5.230 -5.584 6.877 469 HH12 ARG 57 HH12 ARG 57 -4.067 -4.313 6.712 470 HH21 ARG 57 HH21 ARG 57 -6.347 -1.744 7.360 471 HH22 ARG 57 HH22 ARG 57 -4.701 -2.131 6.986 472 H THR 58 H THR 58 -8.988 -3.417 9.195 473 HA THR 58 HA THR 58 -11.463 -4.506 8.024 474 HB THR 58 HB THR 58 -10.760 -1.584 8.276 475 HG1 THR 58 HG1 THR 58 -11.803 -1.539 10.187 476 HG21 THR 58 HG21 THR 58 -12.554 -2.139 6.691 477 HG22 THR 58 HG22 THR 58 -13.122 -1.194 8.068 478 HG23 THR 58 HG23 THR 58 -13.435 -2.929 7.998 479 H ASN 59 H ASN 59 -11.383 -4.946 5.922 480 HA ASN 59 HA ASN 59 -9.218 -3.771 4.328 481 HB2 ASN 59 HB3 ASN 59 -10.951 -6.164 3.688 482 HB3 ASN 59 HB2 ASN 59 -9.530 -5.630 2.795 483 HD21 ASN 59 HD21 ASN 59 -10.589 -6.745 5.971 484 HD22 ASN 59 HD22 ASN 59 -9.112 -7.540 6.383 485 H VAL 60 H VAL 60 -9.622 -3.079 2.170 486 HA VAL 60 HA VAL 60 -12.406 -2.440 1.519 487 HB VAL 60 HB VAL 60 -10.141 -0.453 1.670 488 HG11 VAL 60 HG11 VAL 60 -12.481 -0.480 -0.102 489 HG12 VAL 60 HG12 VAL 60 -10.969 0.420 -0.227 490 HG13 VAL 60 HG13 VAL 60 -12.263 1.012 0.814 491 HG21 VAL 60 HG21 VAL 60 -12.608 -0.977 3.176 492 HG22 VAL 60 HG22 VAL 60 -12.303 0.717 2.796 493 HG23 VAL 60 HG23 VAL 60 -11.102 -0.217 3.689 494 H VAL 61 H VAL 61 -12.880 -2.779 -0.567 495 HA VAL 61 HA VAL 61 -10.659 -3.415 -2.380 496 HB VAL 61 HB VAL 61 -13.550 -4.280 -2.424 497 HG11 VAL 61 HG11 VAL 61 -12.176 -5.779 -4.312 498 HG12 VAL 61 HG12 VAL 61 -11.634 -4.124 -4.590 499 HG13 VAL 61 HG13 VAL 61 -13.356 -4.507 -4.630 500 HG21 VAL 61 HG21 VAL 61 -11.751 -6.450 -2.521 501 HG22 VAL 61 HG22 VAL 61 -12.825 -5.984 -1.202 502 HG23 VAL 61 HG23 VAL 61 -11.176 -5.361 -1.258 503 H LEU 62 H LEU 62 -10.366 -2.353 -4.247 504 HA LEU 62 HA LEU 62 -12.345 -0.298 -4.980 505 HB2 LEU 62 HB3 LEU 62 -10.109 0.500 -4.035 506 HB3 LEU 62 HB2 LEU 62 -9.390 -0.100 -5.518 507 HG LEU 62 HG LEU 62 -11.171 1.433 -6.675 508 HD11 LEU 62 HD11 LEU 62 -12.368 2.782 -5.389 509 HD12 LEU 62 HD12 LEU 62 -10.906 3.418 -4.634 510 HD13 LEU 62 HD13 LEU 62 -11.694 1.988 -3.966 511 HD21 LEU 62 HD21 LEU 62 -8.617 1.622 -6.559 512 HD22 LEU 62 HD22 LEU 62 -8.899 2.830 -5.304 513 HD23 LEU 62 HD23 LEU 62 -9.538 3.080 -6.929 514 H THR 63 H THR 63 -13.418 -1.369 -6.573 515 HA THR 63 HA THR 63 -11.844 -2.091 -8.945 516 HB THR 63 HB THR 63 -12.529 -4.148 -7.745 517 HG1 THR 63 HG1 THR 63 -13.401 -5.141 -9.546 518 HG21 THR 63 HG21 THR 63 -15.177 -2.857 -7.827 519 HG22 THR 63 HG22 THR 63 -14.494 -3.992 -6.664 520 HG23 THR 63 HG23 THR 63 -15.132 -4.580 -8.199 521 H HIS 64 H HIS 64 -12.793 -1.580 -10.931 522 HA HIS 64 HA HIS 64 -14.610 0.580 -10.936 523 HB2 HIS 64 HB3 HIS 64 -13.766 -1.211 -13.222 524 HB3 HIS 64 HB2 HIS 64 -14.634 0.308 -13.397 525 HD1 HIS 64 HD1 HIS 64 -13.297 2.499 -12.859 526 HD2 HIS 64 HD2 HIS 64 -11.036 -0.985 -12.849 527 HE1 HIS 64 HE1 HIS 64 -10.900 3.253 -12.948 528 HE2 HIS 64 HE2 HIS 64 -9.556 1.125 -13.056 529 H GLN 65 H GLN 65 -15.053 -2.875 -11.271 530 HA GLN 65 HA GLN 65 -17.512 -3.069 -12.462 531 HB2 GLN 65 HB3 GLN 65 -16.154 -4.663 -10.328 532 HB3 GLN 65 HB2 GLN 65 -17.826 -5.029 -10.730 533 HG2 GLN 65 HG3 GLN 65 -17.305 -5.803 -12.816 534 HG3 GLN 65 HG2 GLN 65 -15.849 -4.817 -12.938 535 HE21 GLN 65 HE21 GLN 65 -14.079 -5.430 -11.413 536 HE22 GLN 65 HE22 GLN 65 -13.807 -7.116 -11.150 537 H GLU 66 H GLU 66 -19.531 -2.497 -11.985 538 HA GLU 66 HA GLU 66 -20.028 -1.021 -9.550 539 HB2 GLU 66 HB3 GLU 66 -22.235 -0.565 -10.537 540 HB3 GLU 66 HB2 GLU 66 -20.931 -0.177 -11.651 541 HG2 GLU 66 HG3 GLU 66 -21.478 -2.747 -12.340 542 HG3 GLU 66 HG2 GLU 66 -23.071 -2.159 -11.867 543 H ASP 67 H ASP 67 -20.913 -4.094 -10.979 544 HA ASP 67 HA ASP 67 -22.661 -4.720 -8.731 545 HB2 ASP 67 HB3 ASP 67 -22.664 -5.413 -11.456 546 HB3 ASP 67 HB2 ASP 67 -22.318 -6.903 -10.585 547 H TYR 68 H TYR 68 -19.589 -4.585 -8.633 548 HA TYR 68 HA TYR 68 -18.781 -7.297 -8.146 549 HB2 TYR 68 HB3 TYR 68 -17.160 -5.590 -8.870 550 HB3 TYR 68 HB2 TYR 68 -17.425 -4.703 -7.372 551 HD1 TYR 68 HD1 TYR 68 -16.346 -8.052 -8.612 552 HD2 TYR 68 HD2 TYR 68 -16.046 -5.116 -5.547 553 HE1 TYR 68 HE1 TYR 68 -14.576 -9.372 -7.529 554 HE2 TYR 68 HE2 TYR 68 -14.275 -6.428 -4.457 555 HH TYR 68 HH TYR 68 -12.666 -8.124 -4.955 556 H GLN 69 H GLN 69 -18.872 -8.428 -6.296 557 HA GLN 69 HA GLN 69 -19.789 -7.007 -3.883 558 HB2 GLN 69 HB3 GLN 69 -20.301 -9.884 -4.656 559 HB3 GLN 69 HB2 GLN 69 -20.888 -9.087 -3.204 560 HG2 GLN 69 HG3 GLN 69 -21.657 -8.481 -6.047 561 HG3 GLN 69 HG2 GLN 69 -22.665 -9.207 -4.795 562 HE21 GLN 69 HE21 GLN 69 -22.740 -6.652 -6.462 563 HE22 GLN 69 HE22 GLN 69 -23.070 -5.418 -5.300 564 H ALA 70 H ALA 70 -18.180 -6.776 -2.492 565 HA ALA 70 HA ALA 70 -16.216 -8.952 -2.213 566 HB1 ALA 70 HB1 ALA 70 -15.497 -6.562 -2.873 567 HB2 ALA 70 HB2 ALA 70 -14.591 -7.401 -1.613 568 HB3 ALA 70 HB3 ALA 70 -15.781 -6.175 -1.176 569 H GLN 71 H GLN 71 -17.199 -10.238 -0.715 570 HA GLN 71 HA GLN 71 -18.506 -9.234 1.606 571 HB2 GLN 71 HB3 GLN 71 -17.726 -11.927 0.590 572 HB3 GLN 71 HB2 GLN 71 -18.122 -11.766 2.295 573 HG2 GLN 71 HG3 GLN 71 -20.260 -11.942 1.778 574 HG3 GLN 71 HG2 GLN 71 -20.146 -10.422 0.894 575 HE21 GLN 71 HE21 GLN 71 -20.731 -10.499 -1.146 576 HE22 GLN 71 HE22 GLN 71 -20.726 -11.899 -2.159 577 H GLY 72 H GLY 72 -17.658 -8.599 3.467 578 HA2 GLY 72 HA3 GLY 72 -16.212 -8.955 5.342 579 HA3 GLY 72 HA2 GLY 72 -15.023 -9.643 4.247 580 H ALA 73 H ALA 73 -15.497 -7.352 2.310 581 HA ALA 73 HA ALA 73 -14.124 -5.251 3.854 582 HB1 ALA 73 HB1 ALA 73 -12.664 -4.838 1.955 583 HB2 ALA 73 HB2 ALA 73 -13.444 -6.139 1.054 584 HB3 ALA 73 HB3 ALA 73 -12.510 -6.507 2.504 585 H VAL 74 H VAL 74 -14.094 -3.128 2.602 586 HA VAL 74 HA VAL 74 -16.816 -2.520 1.827 587 HB VAL 74 HB VAL 74 -14.539 -0.556 1.747 588 HG11 VAL 74 HG11 VAL 74 -17.339 -0.026 2.653 589 HG12 VAL 74 HG12 VAL 74 -16.964 -0.125 0.933 590 HG13 VAL 74 HG13 VAL 74 -16.163 1.079 1.942 591 HG21 VAL 74 HG21 VAL 74 -16.070 -1.452 4.189 592 HG22 VAL 74 HG22 VAL 74 -15.027 -0.031 4.116 593 HG23 VAL 74 HG23 VAL 74 -14.341 -1.641 3.898 594 H VAL 75 H VAL 75 -17.547 -2.088 -0.184 595 HA VAL 75 HA VAL 75 -15.605 -2.354 -2.377 596 HB VAL 75 HB VAL 75 -18.588 -2.797 -2.486 597 HG11 VAL 75 HG11 VAL 75 -17.679 -2.149 -4.633 598 HG12 VAL 75 HG12 VAL 75 -18.083 -3.866 -4.651 599 HG13 VAL 75 HG13 VAL 75 -16.402 -3.357 -4.487 600 HG21 VAL 75 HG21 VAL 75 -16.872 -5.113 -2.872 601 HG22 VAL 75 HG22 VAL 75 -18.299 -4.918 -1.854 602 HG23 VAL 75 HG23 VAL 75 -16.717 -4.410 -1.262 603 H VAL 76 H VAL 76 -15.410 -0.870 -3.925 604 HA VAL 76 HA VAL 76 -17.359 1.229 -4.309 605 HB VAL 76 HB VAL 76 -15.767 3.074 -4.005 606 HG11 VAL 76 HG11 VAL 76 -16.007 3.268 -1.698 607 HG12 VAL 76 HG12 VAL 76 -15.794 1.537 -1.433 608 HG13 VAL 76 HG13 VAL 76 -17.287 2.143 -2.150 609 HG21 VAL 76 HG21 VAL 76 -13.924 1.064 -2.725 610 HG22 VAL 76 HG22 VAL 76 -13.626 2.780 -2.999 611 HG23 VAL 76 HG23 VAL 76 -13.728 1.676 -4.369 612 H HIS 77 H HIS 77 -16.385 2.819 -6.075 613 HA HIS 77 HA HIS 77 -14.696 1.281 -7.918 614 HB2 HIS 77 HB3 HIS 77 -17.042 2.714 -9.073 615 HB3 HIS 77 HB2 HIS 77 -16.190 1.292 -9.667 616 HD1 HIS 77 HD1 HIS 77 -16.490 -0.706 -7.488 617 HD2 HIS 77 HD2 HIS 77 -19.556 1.903 -8.513 618 HE1 HIS 77 HE1 HIS 77 -18.599 -1.792 -6.659 619 HE2 HIS 77 HE2 HIS 77 -20.451 -0.236 -7.366 620 H ASP 78 H ASP 78 -15.472 4.299 -6.542 621 HA ASP 78 HA ASP 78 -13.708 5.619 -8.497 622 HB2 ASP 78 HB3 ASP 78 -16.142 6.775 -7.127 623 HB3 ASP 78 HB2 ASP 78 -14.997 7.715 -8.078 624 H VAL 79 H VAL 79 -12.530 7.488 -7.663 625 HA VAL 79 HA VAL 79 -11.303 6.912 -5.179 626 HB VAL 79 HB VAL 79 -10.246 9.236 -5.595 627 HG11 VAL 79 HG11 VAL 79 -9.708 7.198 -7.722 628 HG12 VAL 79 HG12 VAL 79 -9.289 6.915 -6.033 629 HG13 VAL 79 HG13 VAL 79 -8.568 8.268 -6.906 630 HG21 VAL 79 HG21 VAL 79 -12.078 9.827 -7.267 631 HG22 VAL 79 HG22 VAL 79 -11.220 8.773 -8.391 632 HG23 VAL 79 HG23 VAL 79 -10.415 10.193 -7.725 633 H ALA 80 H ALA 80 -13.649 9.297 -6.260 634 HA ALA 80 HA ALA 80 -13.684 10.822 -3.874 635 HB1 ALA 80 HB1 ALA 80 -15.331 10.644 -6.317 636 HB2 ALA 80 HB2 ALA 80 -14.660 12.056 -5.500 637 HB3 ALA 80 HB3 ALA 80 -16.128 11.295 -4.885 638 H ALA 81 H ALA 81 -15.638 8.125 -5.054 639 HA ALA 81 HA ALA 81 -17.560 7.998 -3.071 640 HB1 ALA 81 HB1 ALA 81 -18.086 5.932 -3.886 641 HB2 ALA 81 HB2 ALA 81 -16.399 5.436 -4.031 642 HB3 ALA 81 HB3 ALA 81 -17.103 6.528 -5.224 643 H VAL 82 H VAL 82 -14.567 6.048 -3.143 644 HA VAL 82 HA VAL 82 -14.727 4.986 -0.615 645 HB VAL 82 HB VAL 82 -13.029 4.553 -2.535 646 HG11 VAL 82 HG11 VAL 82 -11.058 5.689 -2.610 647 HG12 VAL 82 HG12 VAL 82 -11.123 6.139 -0.905 648 HG13 VAL 82 HG13 VAL 82 -12.121 6.992 -2.082 649 HG21 VAL 82 HG21 VAL 82 -11.645 3.324 -1.065 650 HG22 VAL 82 HG22 VAL 82 -13.245 3.364 -0.323 651 HG23 VAL 82 HG23 VAL 82 -11.970 4.426 0.274 652 H PHE 83 H PHE 83 -13.587 8.198 -1.546 653 HA PHE 83 HA PHE 83 -12.332 8.840 0.878 654 HB2 PHE 83 HB3 PHE 83 -13.543 10.474 -1.335 655 HB3 PHE 83 HB2 PHE 83 -12.910 11.246 0.108 656 HD1 PHE 83 HD2 PHE 83 -10.559 9.437 0.605 657 HD2 PHE 83 HD1 PHE 83 -12.041 11.233 -2.958 658 HE1 PHE 83 HE2 PHE 83 -8.302 9.363 -0.367 659 HE2 PHE 83 HE1 PHE 83 -9.786 11.161 -3.936 660 HZ PHE 83 HZ PHE 83 -7.913 10.223 -2.641 661 H ALA 84 H ALA 84 -15.689 9.152 -0.188 662 HA ALA 84 HA ALA 84 -16.620 10.587 2.054 663 HB1 ALA 84 HB1 ALA 84 -17.846 9.010 -0.122 664 HB2 ALA 84 HB2 ALA 84 -18.262 10.611 0.491 665 HB3 ALA 84 HB3 ALA 84 -18.805 9.169 1.349 666 H TYR 85 H TYR 85 -16.243 7.166 1.377 667 HA TYR 85 HA TYR 85 -17.449 6.170 3.712 668 HB2 TYR 85 HB3 TYR 85 -16.960 4.212 2.736 669 HB3 TYR 85 HB2 TYR 85 -16.051 5.078 1.508 670 HD1 TYR 85 HD1 TYR 85 -15.605 3.774 4.991 671 HD2 TYR 85 HD2 TYR 85 -13.858 4.494 1.185 672 HE1 TYR 85 HE1 TYR 85 -13.540 2.666 5.737 673 HE2 TYR 85 HE2 TYR 85 -11.786 3.389 1.917 674 HH TYR 85 HH TYR 85 -11.584 1.480 4.636 675 H ALA 86 H ALA 86 -13.944 6.587 3.057 676 HA ALA 86 HA ALA 86 -12.929 6.128 5.526 677 HB1 ALA 86 HB1 ALA 86 -12.117 7.867 3.283 678 HB2 ALA 86 HB2 ALA 86 -11.239 6.567 4.089 679 HB3 ALA 86 HB3 ALA 86 -11.331 8.163 4.834 680 H LYS 87 H LYS 87 -14.774 8.934 4.552 681 HA LYS 87 HA LYS 87 -14.102 10.528 6.830 682 HB2 LYS 87 HB3 LYS 87 -15.384 11.017 4.459 683 HB3 LYS 87 HB2 LYS 87 -16.733 10.988 5.586 684 HG2 LYS 87 HG3 LYS 87 -16.190 13.194 5.678 685 HG3 LYS 87 HG2 LYS 87 -15.165 12.582 6.979 686 HD2 LYS 87 HD3 LYS 87 -13.467 12.265 4.955 687 HD3 LYS 87 HD2 LYS 87 -14.430 13.581 4.282 688 HE2 LYS 87 HE3 LYS 87 -13.249 13.680 7.046 689 HE3 LYS 87 HE2 LYS 87 -12.375 14.239 5.621 690 HZ1 LYS 87 HZ1 LYS 87 -14.768 15.374 6.895 691 HZ2 LYS 87 HZ2 LYS 87 -14.528 15.612 5.238 692 HZ3 LYS 87 HZ3 LYS 87 -13.371 16.156 6.345 693 H GLN 88 H GLN 88 -16.791 8.433 5.947 694 HA GLN 88 HA GLN 88 -18.356 8.758 8.240 695 HB2 GLN 88 HB3 GLN 88 -18.833 7.519 5.986 696 HB3 GLN 88 HB2 GLN 88 -18.204 6.115 6.837 697 HG2 GLN 88 HG3 GLN 88 -20.600 6.152 6.995 698 HG3 GLN 88 HG2 GLN 88 -19.900 6.443 8.587 699 HE21 GLN 88 HE21 GLN 88 -21.281 8.068 5.776 700 HE22 GLN 88 HE22 GLN 88 -21.938 9.407 6.648 701 H HIS 89 H HIS 89 -15.366 7.124 7.833 702 HA HIS 89 HA HIS 89 -15.738 5.684 10.370 703 HB2 HIS 89 HB3 HIS 89 -14.197 5.133 7.909 704 HB3 HIS 89 HB2 HIS 89 -13.381 4.735 9.417 705 HD1 HIS 89 HD1 HIS 89 -15.543 3.525 11.087 706 HD2 HIS 89 HD2 HIS 89 -15.212 2.800 7.009 707 HE1 HIS 89 HE1 HIS 89 -16.745 1.352 10.691 708 HE2 HIS 89 HE2 HIS 89 -16.456 0.890 8.232 709 HA PRO 90 HA PRO 90 -12.908 9.237 11.374 710 HB2 PRO 90 HB3 PRO 90 -14.150 10.003 13.640 711 HB3 PRO 90 HB2 PRO 90 -14.689 10.541 12.045 712 HG2 PRO 90 HG3 PRO 90 -15.776 8.343 13.767 713 HG3 PRO 90 HG2 PRO 90 -16.654 9.584 12.852 714 HD2 PRO 90 HD3 PRO 90 -16.326 7.045 11.947 715 HD3 PRO 90 HD2 PRO 90 -16.444 8.446 10.865 716 H ASP 91 H ASP 91 -13.813 6.285 12.782 717 HA ASP 91 HA ASP 91 -11.915 6.552 14.993 718 HB2 ASP 91 HB3 ASP 91 -14.378 5.175 14.669 719 HB3 ASP 91 HB2 ASP 91 -13.126 3.960 14.906 720 H GLN 92 H GLN 92 -11.639 5.853 11.858 721 HA GLN 92 HA GLN 92 -9.376 4.066 12.329 722 HB2 GLN 92 HB3 GLN 92 -11.302 3.545 10.070 723 HB3 GLN 92 HB2 GLN 92 -9.982 2.524 10.625 724 HG2 GLN 92 HG3 GLN 92 -11.357 2.501 12.856 725 HG3 GLN 92 HG2 GLN 92 -12.691 2.922 11.784 726 HE21 GLN 92 HE21 GLN 92 -13.841 1.185 11.366 727 HE22 GLN 92 HE22 GLN 92 -13.223 -0.385 10.996 728 H GLU 93 H GLU 93 -7.785 4.106 10.653 729 HA GLU 93 HA GLU 93 -7.865 6.599 9.102 730 HB2 GLU 93 HB3 GLU 93 -6.011 6.185 10.783 731 HB3 GLU 93 HB2 GLU 93 -5.435 4.917 9.710 732 HG2 GLU 93 HG3 GLU 93 -5.091 6.537 7.939 733 HG3 GLU 93 HG2 GLU 93 -5.731 7.818 8.967 734 H LEU 94 H LEU 94 -6.830 6.575 6.962 735 HA LEU 94 HA LEU 94 -7.509 4.102 5.537 736 HB2 LEU 94 HB3 LEU 94 -8.282 6.639 5.019 737 HB3 LEU 94 HB2 LEU 94 -6.844 6.550 4.019 738 HG LEU 94 HG LEU 94 -7.762 4.626 2.827 739 HD11 LEU 94 HD11 LEU 94 -9.427 4.405 5.082 740 HD12 LEU 94 HD12 LEU 94 -9.393 3.373 3.653 741 HD13 LEU 94 HD13 LEU 94 -10.481 4.759 3.712 742 HD21 LEU 94 HD21 LEU 94 -8.369 6.423 1.598 743 HD22 LEU 94 HD22 LEU 94 -9.156 7.225 2.957 744 HD23 LEU 94 HD23 LEU 94 -9.988 5.929 2.097 745 H VAL 95 H VAL 95 -5.986 2.873 4.628 746 HA VAL 95 HA VAL 95 -3.330 4.033 4.146 747 HB VAL 95 HB VAL 95 -3.737 1.302 5.362 748 HG11 VAL 95 HG11 VAL 95 -1.708 1.341 4.162 749 HG12 VAL 95 HG12 VAL 95 -1.265 1.608 5.848 750 HG13 VAL 95 HG13 VAL 95 -1.316 2.966 4.723 751 HG21 VAL 95 HG21 VAL 95 -2.998 2.218 7.466 752 HG22 VAL 95 HG22 VAL 95 -4.412 3.114 6.912 753 HG23 VAL 95 HG23 VAL 95 -2.803 3.815 6.744 754 H ILE 96 H ILE 96 -2.720 3.719 2.115 755 HA ILE 96 HA ILE 96 -4.104 1.769 0.467 756 HB ILE 96 HB ILE 96 -1.904 3.639 -0.401 757 HG12 ILE 96 HG13 ILE 96 -3.628 5.001 0.614 758 HG13 ILE 96 HG12 ILE 96 -3.740 5.157 -1.136 759 HG21 ILE 96 HG21 ILE 96 -4.167 2.567 -2.053 760 HG22 ILE 96 HG22 ILE 96 -2.669 1.663 -1.833 761 HG23 ILE 96 HG23 ILE 96 -2.635 3.256 -2.589 762 HD11 ILE 96 HD11 ILE 96 -5.617 3.625 -1.171 763 HD12 ILE 96 HD12 ILE 96 -5.933 4.977 -0.084 764 HD13 ILE 96 HD13 ILE 96 -5.486 3.402 0.573 765 H ALA 97 H ALA 97 -3.346 -0.193 0.029 766 HA ALA 97 HA ALA 97 -0.495 -0.733 0.540 767 HB1 ALA 97 HB1 ALA 97 -2.558 -2.893 0.495 768 HB2 ALA 97 HB2 ALA 97 -2.374 -1.876 1.923 769 HB3 ALA 97 HB3 ALA 97 -1.012 -2.834 1.342 770 H GLY 98 H GLY 98 -2.920 -0.649 -1.866 771 HA2 GLY 98 HA3 GLY 98 -1.340 -0.979 -4.046 772 HA3 GLY 98 HA2 GLY 98 -1.721 -2.633 -3.589 773 H GLY 99 H GLY 99 -4.230 -1.820 -6.067 774 HA2 GLY 99 HA3 GLY 99 -1.456 -2.467 -5.677 775 HA3 GLY 99 HA2 GLY 99 -2.366 -2.592 -7.172 776 H ALA 100 H ALA 100 -0.656 -1.721 -8.360 777 HA ALA 100 HA ALA 100 0.655 0.691 -7.807 778 HB1 ALA 100 HB1 ALA 100 0.221 -0.809 -10.374 779 HB2 ALA 100 HB2 ALA 100 1.655 -0.788 -9.348 780 HB3 ALA 100 HB3 ALA 100 1.208 0.648 -10.269 781 H GLN 101 H GLN 101 -2.129 0.060 -9.948 782 HA GLN 101 HA GLN 101 -2.446 2.707 -10.834 783 HB2 GLN 101 HB3 GLN 101 -3.903 0.218 -11.013 784 HB3 GLN 101 HB2 GLN 101 -5.008 1.562 -10.774 785 HG2 GLN 101 HG3 GLN 101 -3.289 2.516 -12.691 786 HG3 GLN 101 HG2 GLN 101 -3.452 0.811 -13.112 787 HE21 GLN 101 HE21 GLN 101 -5.727 3.152 -11.730 788 HE22 GLN 101 HE22 GLN 101 -6.929 2.970 -12.957 789 H ILE 102 H ILE 102 -3.358 1.128 -7.893 790 HA ILE 102 HA ILE 102 -5.239 3.160 -7.100 791 HB ILE 102 HB ILE 102 -4.020 0.884 -5.525 792 HG12 ILE 102 HG13 ILE 102 -6.314 -0.095 -5.789 793 HG13 ILE 102 HG12 ILE 102 -6.698 1.219 -6.895 794 HG21 ILE 102 HG21 ILE 102 -6.337 2.677 -4.816 795 HG22 ILE 102 HG22 ILE 102 -4.737 2.730 -4.077 796 HG23 ILE 102 HG23 ILE 102 -5.755 1.304 -3.875 797 HD11 ILE 102 HD11 ILE 102 -5.278 0.411 -8.538 798 HD12 ILE 102 HD12 ILE 102 -5.995 -1.048 -7.863 799 HD13 ILE 102 HD13 ILE 102 -4.361 -0.573 -7.403 800 H PHE 103 H PHE 103 -1.846 2.500 -6.708 801 HA PHE 103 HA PHE 103 -1.395 4.231 -4.497 802 HB2 PHE 103 HB3 PHE 103 0.383 2.994 -6.585 803 HB3 PHE 103 HB2 PHE 103 1.020 4.174 -5.445 804 HD1 PHE 103 HD2 PHE 103 -0.388 3.465 -2.978 805 HD2 PHE 103 HD1 PHE 103 1.325 0.976 -5.974 806 HE1 PHE 103 HE2 PHE 103 -0.074 1.682 -1.312 807 HE2 PHE 103 HE1 PHE 103 1.642 -0.812 -4.314 808 HZ PHE 103 HZ PHE 103 0.943 -0.459 -1.980 809 H THR 104 H THR 104 -1.562 4.645 -7.959 810 HA THR 104 HA THR 104 -0.440 7.268 -8.017 811 HB THR 104 HB THR 104 -2.178 5.824 -10.027 812 HG1 THR 104 HG1 THR 104 -0.397 4.950 -10.710 813 HG21 THR 104 HG21 THR 104 -1.560 8.511 -10.045 814 HG22 THR 104 HG22 THR 104 -2.052 7.533 -11.428 815 HG23 THR 104 HG23 THR 104 -0.339 7.784 -11.090 816 H ALA 105 H ALA 105 -3.750 5.984 -7.989 817 HA ALA 105 HA ALA 105 -5.148 8.343 -8.385 818 HB1 ALA 105 HB1 ALA 105 -5.805 5.731 -7.778 819 HB2 ALA 105 HB2 ALA 105 -6.936 7.057 -8.051 820 HB3 ALA 105 HB3 ALA 105 -6.434 6.650 -6.410 821 H PHE 106 H PHE 106 -4.412 6.911 -5.159 822 HA PHE 106 HA PHE 106 -5.216 9.312 -3.852 823 HB2 PHE 106 HB3 PHE 106 -3.727 6.895 -2.815 824 HB3 PHE 106 HB2 PHE 106 -4.368 8.190 -1.810 825 HD1 PHE 106 HD2 PHE 106 -5.307 5.473 -4.129 826 HD2 PHE 106 HD1 PHE 106 -6.627 8.211 -1.153 827 HE1 PHE 106 HE2 PHE 106 -7.458 4.290 -4.004 828 HE2 PHE 106 HE1 PHE 106 -8.783 7.031 -1.021 829 HZ PHE 106 HZ PHE 106 -9.200 5.068 -2.448 830 H LYS 107 H LYS 107 -2.339 8.369 -5.410 831 HA LYS 107 HA LYS 107 -0.282 9.384 -3.933 832 HB2 LYS 107 HB3 LYS 107 0.941 9.293 -5.842 833 HB3 LYS 107 HB2 LYS 107 -0.492 8.493 -6.469 834 HG2 LYS 107 HG3 LYS 107 -1.272 10.632 -7.388 835 HG3 LYS 107 HG2 LYS 107 0.188 11.412 -6.779 836 HD2 LYS 107 HD3 LYS 107 1.311 9.413 -8.155 837 HD3 LYS 107 HD2 LYS 107 -0.177 9.594 -9.085 838 HE2 LYS 107 HE3 LYS 107 1.323 12.057 -8.386 839 HE3 LYS 107 HE2 LYS 107 2.016 11.001 -9.616 840 HZ1 LYS 107 HZ1 LYS 107 0.237 12.903 -10.143 841 HZ2 LYS 107 HZ2 LYS 107 -0.812 11.597 -9.905 842 HZ3 LYS 107 HZ3 LYS 107 0.401 11.503 -11.080 843 H ASP 108 H ASP 108 -2.732 11.166 -5.675 844 HA ASP 108 HA ASP 108 -1.496 13.730 -5.083 845 HB2 ASP 108 HB3 ASP 108 -2.716 13.190 -7.259 846 HB3 ASP 108 HB2 ASP 108 -4.207 13.281 -6.326 847 H ASP 109 H ASP 109 -4.362 11.863 -4.191 848 HA ASP 109 HA ASP 109 -5.225 13.893 -2.302 849 HB2 ASP 109 HB3 ASP 109 -6.388 11.515 -3.547 850 HB3 ASP 109 HB2 ASP 109 -6.817 11.693 -1.848 851 H VAL 110 H VAL 110 -2.759 11.879 -2.067 852 HA VAL 110 HA VAL 110 -3.353 10.643 0.483 853 HB VAL 110 HB VAL 110 -1.953 9.454 -1.140 854 HG11 VAL 110 HG11 VAL 110 0.433 11.096 -0.669 855 HG12 VAL 110 HG12 VAL 110 -0.807 11.859 -1.665 856 HG13 VAL 110 HG13 VAL 110 -0.129 10.301 -2.140 857 HG21 VAL 110 HG21 VAL 110 -1.698 9.078 1.307 858 HG22 VAL 110 HG22 VAL 110 -0.345 10.210 1.296 859 HG23 VAL 110 HG23 VAL 110 -0.247 8.709 0.375 860 H ASP 111 H ASP 111 -2.018 10.967 2.382 861 HA ASP 111 HA ASP 111 -0.993 13.722 2.587 862 HB2 ASP 111 HB3 ASP 111 -3.175 12.680 3.922 863 HB3 ASP 111 HB2 ASP 111 -1.881 12.528 5.106 864 H THR 112 H THR 112 -0.668 10.386 3.742 865 HA THR 112 HA THR 112 2.050 11.066 4.647 866 HB THR 112 HB THR 112 0.265 8.835 5.632 867 HG1 THR 112 HG1 THR 112 -0.492 10.556 6.645 868 HG21 THR 112 HG21 THR 112 3.018 9.675 6.512 869 HG22 THR 112 HG22 THR 112 2.524 8.113 5.859 870 HG23 THR 112 HG23 THR 112 1.951 8.625 7.446 871 H LEU 113 H LEU 113 3.714 9.476 4.323 872 HA LEU 113 HA LEU 113 3.138 7.465 2.273 873 HB2 LEU 113 HB3 LEU 113 4.311 9.871 1.687 874 HB3 LEU 113 HB2 LEU 113 5.702 8.838 1.940 875 HG LEU 113 HG LEU 113 4.972 7.335 0.195 876 HD11 LEU 113 HD11 LEU 113 2.824 8.843 -0.948 877 HD12 LEU 113 HD12 LEU 113 2.426 8.420 0.717 878 HD13 LEU 113 HD13 LEU 113 2.852 7.156 -0.436 879 HD21 LEU 113 HD21 LEU 113 5.323 10.216 -0.273 880 HD22 LEU 113 HD22 LEU 113 4.684 9.295 -1.636 881 HD23 LEU 113 HD23 LEU 113 6.226 8.842 -0.910 882 H LEU 114 H LEU 114 3.869 5.563 2.886 883 HA LEU 114 HA LEU 114 6.325 5.403 4.500 884 HB2 LEU 114 HB3 LEU 114 3.884 3.653 4.832 885 HB3 LEU 114 HB2 LEU 114 5.374 3.537 5.747 886 HG LEU 114 HG LEU 114 3.784 6.074 5.805 887 HD11 LEU 114 HD11 LEU 114 2.036 4.883 6.572 888 HD12 LEU 114 HD12 LEU 114 2.978 4.838 8.063 889 HD13 LEU 114 HD13 LEU 114 3.026 3.472 6.949 890 HD21 LEU 114 HD21 LEU 114 4.785 5.732 8.261 891 HD22 LEU 114 HD22 LEU 114 5.687 6.500 6.954 892 HD23 LEU 114 HD23 LEU 114 5.967 4.803 7.339 893 H VAL 115 H VAL 115 7.816 4.487 3.224 894 HA VAL 115 HA VAL 115 6.954 2.221 1.544 895 HB VAL 115 HB VAL 115 8.454 2.912 -0.209 896 HG11 VAL 115 HG11 VAL 115 7.275 4.802 -1.014 897 HG12 VAL 115 HG12 VAL 115 6.896 5.348 0.620 898 HG13 VAL 115 HG13 VAL 115 6.136 3.891 -0.022 899 HG21 VAL 115 HG21 VAL 115 9.353 5.404 0.199 900 HG22 VAL 115 HG22 VAL 115 10.299 3.964 0.577 901 HG23 VAL 115 HG23 VAL 115 9.412 4.797 1.854 902 H THR 116 H THR 116 8.286 0.501 1.325 903 HA THR 116 HA THR 116 10.665 0.435 3.062 904 HB THR 116 HB THR 116 8.783 -1.775 2.207 905 HG1 THR 116 HG1 THR 116 8.331 -1.882 4.393 906 HG21 THR 116 HG21 THR 116 10.074 -3.294 3.586 907 HG22 THR 116 HG22 THR 116 11.262 -2.027 3.893 908 HG23 THR 116 HG23 THR 116 11.051 -2.663 2.261 909 H ARG 117 H ARG 117 12.278 0.993 1.658 910 HA ARG 117 HA ARG 117 12.352 -0.159 -1.003 911 HB2 ARG 117 HB3 ARG 117 12.968 2.250 -0.417 912 HB3 ARG 117 HB2 ARG 117 14.459 1.593 0.243 913 HG2 ARG 117 HG3 ARG 117 14.586 0.451 -2.138 914 HG3 ARG 117 HG2 ARG 117 13.567 1.825 -2.575 915 HD2 ARG 117 HD3 ARG 117 16.334 1.858 -1.396 916 HD3 ARG 117 HD2 ARG 117 15.804 2.506 -2.947 917 HE ARG 117 HE ARG 117 14.349 3.925 -1.171 918 HH11 ARG 117 HH11 ARG 117 17.762 3.250 -1.440 919 HH12 ARG 117 HH12 ARG 117 18.243 4.742 -0.706 920 HH21 ARG 117 HH21 ARG 117 14.979 5.889 -0.206 921 HH22 ARG 117 HH22 ARG 117 16.663 6.241 -0.005 922 H LEU 118 H LEU 118 13.002 -2.209 -1.120 923 HA LEU 118 HA LEU 118 14.828 -3.420 0.685 924 HB2 LEU 118 HB3 LEU 118 13.276 -4.203 -1.666 925 HB3 LEU 118 HB2 LEU 118 14.829 -5.013 -1.573 926 HG LEU 118 HG LEU 118 14.199 -5.673 0.796 927 HD11 LEU 118 HD11 LEU 118 11.772 -4.236 -0.039 928 HD12 LEU 118 HD12 LEU 118 12.436 -4.509 1.571 929 HD13 LEU 118 HD13 LEU 118 11.508 -5.779 0.772 930 HD21 LEU 118 HD21 LEU 118 13.838 -6.928 -1.565 931 HD22 LEU 118 HD22 LEU 118 12.185 -6.920 -0.949 932 HD23 LEU 118 HD23 LEU 118 13.477 -7.651 0.003 933 H ALA 119 H ALA 119 16.946 -4.220 0.231 934 HA ALA 119 HA ALA 119 18.535 -2.354 -1.285 935 HB1 ALA 119 HB1 ALA 119 19.850 -2.862 0.452 936 HB2 ALA 119 HB2 ALA 119 20.270 -4.309 -0.466 937 HB3 ALA 119 HB3 ALA 119 19.007 -4.380 0.763 938 H GLY 120 H GLY 120 17.669 -5.776 -1.513 939 HA2 GLY 120 HA3 GLY 120 19.346 -6.410 -3.691 940 HA3 GLY 120 HA2 GLY 120 17.909 -7.299 -3.214 941 H SER 121 H SER 121 18.980 -6.560 -5.881 942 HA SER 121 HA SER 121 16.820 -4.848 -6.885 943 HB2 SER 121 HB3 SER 121 18.172 -4.299 -8.681 944 HB3 SER 121 HB2 SER 121 19.388 -4.583 -7.437 945 HG SER 121 HG SER 121 18.760 -6.080 -9.692 946 H PHE 122 H PHE 122 15.236 -5.610 -8.171 947 HA PHE 122 HA PHE 122 15.471 -8.349 -9.207 948 HB2 PHE 122 HB3 PHE 122 12.993 -7.249 -7.869 949 HB3 PHE 122 HB2 PHE 122 13.201 -8.868 -8.525 950 HD1 PHE 122 HD2 PHE 122 14.854 -6.590 -6.072 951 HD2 PHE 122 HD1 PHE 122 13.653 -10.555 -7.046 952 HE1 PHE 122 HE2 PHE 122 15.666 -7.369 -3.883 953 HE2 PHE 122 HE1 PHE 122 14.462 -11.341 -4.859 954 HZ PHE 122 HZ PHE 122 15.470 -9.748 -3.275 955 H GLU 123 H GLU 123 13.815 -8.834 -10.880 956 HA GLU 123 HA GLU 123 13.063 -6.415 -12.387 957 HB2 GLU 123 HB3 GLU 123 13.608 -7.557 -14.465 958 HB3 GLU 123 HB2 GLU 123 15.017 -7.509 -13.414 959 HG2 GLU 123 HG3 GLU 123 13.763 -9.901 -12.779 960 HG3 GLU 123 HG2 GLU 123 13.620 -9.773 -14.532 961 H GLY 124 H GLY 124 11.039 -6.343 -13.185 962 HA2 GLY 124 HA3 GLY 124 9.468 -8.771 -13.469 963 HA3 GLY 124 HA2 GLY 124 8.923 -7.666 -12.216 964 H ASP 125 H ASP 125 7.048 -6.925 -13.059 965 HA ASP 125 HA ASP 125 7.260 -5.257 -15.445 966 HB2 ASP 125 HB3 ASP 125 6.402 -7.642 -15.989 967 HB3 ASP 125 HB2 ASP 125 4.919 -7.125 -15.191 968 H THR 126 H THR 126 6.899 -4.885 -12.499 969 HA THR 126 HA THR 126 4.676 -3.018 -12.694 970 HB THR 126 HB THR 126 4.808 -4.968 -10.393 971 HG1 THR 126 HG1 THR 126 3.015 -5.967 -11.404 972 HG21 THR 126 HG21 THR 126 2.968 -4.010 -9.545 973 HG22 THR 126 HG22 THR 126 2.292 -3.646 -11.132 974 HG23 THR 126 HG23 THR 126 3.537 -2.603 -10.444 975 H LYS 127 H LYS 127 5.792 -1.207 -12.302 976 HA LYS 127 HA LYS 127 7.552 -1.146 -9.939 977 HB2 LYS 127 HB3 LYS 127 7.667 0.361 -12.544 978 HB3 LYS 127 HB2 LYS 127 8.534 0.913 -11.117 979 HG2 LYS 127 HG3 LYS 127 9.103 -1.845 -11.484 980 HG3 LYS 127 HG2 LYS 127 9.320 -1.022 -13.029 981 HD2 LYS 127 HD3 LYS 127 10.575 0.738 -11.497 982 HD3 LYS 127 HD2 LYS 127 10.784 -0.677 -10.463 983 HE2 LYS 127 HE3 LYS 127 11.406 -0.899 -13.370 984 HE3 LYS 127 HE2 LYS 127 12.553 -0.079 -12.311 985 HZ1 LYS 127 HZ1 LYS 127 12.828 -2.576 -12.685 986 HZ2 LYS 127 HZ2 LYS 127 11.511 -2.759 -11.640 987 HZ3 LYS 127 HZ3 LYS 127 12.923 -2.005 -11.095 988 H MET 128 H MET 128 7.694 1.040 -8.892 989 HA MET 128 HA MET 128 5.125 1.867 -8.072 990 HB2 MET 128 HB3 MET 128 7.229 2.008 -6.706 991 HB3 MET 128 HB2 MET 128 7.713 3.379 -7.696 992 HG2 MET 128 HG3 MET 128 6.724 4.050 -5.553 993 HG3 MET 128 HG2 MET 128 5.823 4.657 -6.940 994 HE1 MET 128 HE1 MET 128 4.499 5.124 -4.628 995 HE2 MET 128 HE2 MET 128 3.084 4.135 -4.264 996 HE3 MET 128 HE3 MET 128 3.209 4.958 -5.819 997 H ILE 129 H ILE 129 4.345 4.129 -8.127 998 HA ILE 129 HA ILE 129 4.680 5.244 -10.825 999 HB ILE 129 HB ILE 129 2.495 6.341 -10.458 1000 HG12 ILE 129 HG13 ILE 129 1.210 5.125 -8.453 1001 HG13 ILE 129 HG12 ILE 129 2.832 5.099 -7.773 1002 HG21 ILE 129 HG21 ILE 129 1.279 3.949 -10.109 1003 HG22 ILE 129 HG22 ILE 129 2.914 3.434 -10.527 1004 HG23 ILE 129 HG23 ILE 129 2.012 4.481 -11.623 1005 HD11 ILE 129 HD11 ILE 129 1.565 7.604 -8.817 1006 HD12 ILE 129 HD12 ILE 129 2.979 7.438 -7.778 1007 HD13 ILE 129 HD13 ILE 129 1.376 7.056 -7.151 1008 HA PRO 130 HA PRO 130 6.546 8.986 -9.432 1009 HB2 PRO 130 HB3 PRO 130 5.066 10.867 -10.821 1010 HB3 PRO 130 HB2 PRO 130 6.423 9.955 -11.487 1011 HG2 PRO 130 HG3 PRO 130 3.488 9.455 -11.754 1012 HG3 PRO 130 HG2 PRO 130 4.769 9.298 -12.970 1013 HD2 PRO 130 HD3 PRO 130 3.740 7.150 -11.747 1014 HD3 PRO 130 HD2 PRO 130 5.467 7.241 -12.150 1015 H LEU 131 H LEU 131 6.257 10.798 -8.068 1016 HA LEU 131 HA LEU 131 3.577 11.327 -7.042 1017 HB2 LEU 131 HB3 LEU 131 5.640 10.980 -4.948 1018 HB3 LEU 131 HB2 LEU 131 3.918 10.663 -4.890 1019 HG LEU 131 HG LEU 131 5.611 8.837 -6.528 1020 HD11 LEU 131 HD11 LEU 131 6.212 7.510 -4.604 1021 HD12 LEU 131 HD12 LEU 131 5.438 8.671 -3.525 1022 HD13 LEU 131 HD13 LEU 131 6.875 9.136 -4.436 1023 HD21 LEU 131 HD21 LEU 131 3.377 8.192 -4.629 1024 HD22 LEU 131 HD22 LEU 131 3.959 7.257 -6.006 1025 HD23 LEU 131 HD23 LEU 131 3.073 8.759 -6.271 1026 H ASN 132 H ASN 132 3.425 13.285 -5.799 1027 HA ASN 132 HA ASN 132 5.277 15.307 -6.700 1028 HB2 ASN 132 HB3 ASN 132 2.576 15.232 -5.694 1029 HB3 ASN 132 HB2 ASN 132 3.514 16.419 -4.792 1030 HD21 ASN 132 HD21 ASN 132 4.104 18.290 -5.752 1031 HD22 ASN 132 HD22 ASN 132 3.654 18.736 -7.359 1032 H TRP 133 H TRP 133 7.132 14.378 -5.605 1033 HA TRP 133 HA TRP 133 7.385 14.024 -2.871 1034 HB2 TRP 133 HB3 TRP 133 9.504 14.877 -4.849 1035 HB3 TRP 133 HB2 TRP 133 9.814 14.224 -3.242 1036 HD1 TRP 133 HD1 TRP 133 8.468 13.159 -6.684 1037 HE1 TRP 133 HE1 TRP 133 8.625 10.596 -6.862 1038 HE3 TRP 133 HE3 TRP 133 9.950 12.102 -1.908 1039 HZ2 TRP 133 HZ2 TRP 133 9.297 8.416 -5.200 1040 HZ3 TRP 133 HZ3 TRP 133 10.330 9.753 -1.283 1041 HH2 TRP 133 HH2 TRP 133 10.009 7.949 -2.896 1042 H ASP 134 H ASP 134 7.801 17.029 -4.751 1043 HA ASP 134 HA ASP 134 8.964 18.580 -2.765 1044 HB2 ASP 134 HB3 ASP 134 8.270 19.039 -5.313 1045 HB3 ASP 134 HB2 ASP 134 6.941 19.874 -4.513 1046 H ASP 135 H ASP 135 5.533 17.954 -3.405 1047 HA ASP 135 HA ASP 135 4.597 19.699 -1.357 1048 HB2 ASP 135 HB3 ASP 135 3.380 17.682 -3.172 1049 HB3 ASP 135 HB2 ASP 135 2.477 18.116 -1.724 1050 H PHE 136 H PHE 136 6.197 16.805 -1.104 1051 HA PHE 136 HA PHE 136 4.952 16.270 1.513 1052 HB2 PHE 136 HB3 PHE 136 6.090 14.264 -0.446 1053 HB3 PHE 136 HB2 PHE 136 5.586 13.877 1.196 1054 HD1 PHE 136 HD1 PHE 136 3.104 14.863 1.716 1055 HD2 PHE 136 HD2 PHE 136 4.610 13.696 -2.089 1056 HE1 PHE 136 HE1 PHE 136 0.804 14.494 0.924 1057 HE2 PHE 136 HE2 PHE 136 2.313 13.324 -2.889 1058 HZ PHE 136 HZ PHE 136 0.407 13.724 -1.381 1059 H THR 137 H THR 137 6.261 16.176 3.221 1060 HA THR 137 HA THR 137 9.164 16.372 2.732 1061 HB THR 137 HB THR 137 7.478 17.524 4.959 1062 HG1 THR 137 HG1 THR 137 8.937 18.640 2.814 1063 HG21 THR 137 HG21 THR 137 10.466 17.620 4.633 1064 HG22 THR 137 HG22 THR 137 9.567 16.855 5.944 1065 HG23 THR 137 HG23 THR 137 9.532 18.609 5.756 1066 H LYS 138 H LYS 138 10.468 14.875 3.576 1067 HA LYS 138 HA LYS 138 9.441 12.545 4.771 1068 HB2 LYS 138 HB3 LYS 138 11.820 13.247 3.587 1069 HB3 LYS 138 HB2 LYS 138 12.287 13.056 5.271 1070 HG2 LYS 138 HG3 LYS 138 10.768 10.835 4.873 1071 HG3 LYS 138 HG2 LYS 138 11.512 11.047 3.292 1072 HD2 LYS 138 HD3 LYS 138 12.948 10.865 5.935 1073 HD3 LYS 138 HD2 LYS 138 12.877 9.613 4.691 1074 HE2 LYS 138 HE3 LYS 138 13.993 11.181 3.123 1075 HE3 LYS 138 HE2 LYS 138 14.157 12.334 4.446 1076 HZ1 LYS 138 HZ1 LYS 138 15.912 11.250 5.240 1077 HZ2 LYS 138 HZ2 LYS 138 15.950 10.397 3.780 1078 HZ3 LYS 138 HZ3 LYS 138 15.160 9.739 5.122 1079 H VAL 139 H VAL 139 8.552 12.510 6.718 1080 HA VAL 139 HA VAL 139 9.465 14.300 8.802 1081 HB VAL 139 HB VAL 139 7.635 13.373 10.151 1082 HG11 VAL 139 HG11 VAL 139 7.396 15.158 8.251 1083 HG12 VAL 139 HG12 VAL 139 5.967 14.524 9.069 1084 HG13 VAL 139 HG13 VAL 139 6.420 13.907 7.481 1085 HG21 VAL 139 HG21 VAL 139 7.183 11.210 9.699 1086 HG22 VAL 139 HG22 VAL 139 7.622 11.362 7.998 1087 HG23 VAL 139 HG23 VAL 139 6.038 11.903 8.551 1088 H SER 140 H SER 140 9.776 10.925 7.933 1089 HA SER 140 HA SER 140 11.728 10.620 10.068 1090 HB2 SER 140 HB3 SER 140 9.897 8.322 9.990 1091 HB3 SER 140 HB2 SER 140 10.626 9.140 11.370 1092 HG SER 140 HG SER 140 8.150 9.416 10.339 1093 H SER 141 H SER 141 13.084 8.765 9.841 1094 HA SER 141 HA SER 141 12.849 7.118 7.483 1095 HB2 SER 141 HB3 SER 141 15.496 8.184 7.327 1096 HB3 SER 141 HB2 SER 141 14.209 8.268 6.124 1097 HG SER 141 HG SER 141 15.206 10.292 7.242 1098 H ARG 142 H ARG 142 13.551 5.155 7.986 1099 HA ARG 142 HA ARG 142 15.779 4.849 9.862 1100 HB2 ARG 142 HB3 ARG 142 13.633 4.645 11.124 1101 HB3 ARG 142 HB2 ARG 142 13.200 3.288 10.094 1102 HG2 ARG 142 HG3 ARG 142 15.184 2.075 10.895 1103 HG3 ARG 142 HG2 ARG 142 15.549 3.425 11.972 1104 HD2 ARG 142 HD3 ARG 142 12.820 2.296 12.130 1105 HD3 ARG 142 HD2 ARG 142 14.130 1.280 12.729 1106 HE ARG 142 HE ARG 142 13.033 3.540 14.019 1107 HH11 ARG 142 HH11 ARG 142 16.089 1.964 13.420 1108 HH12 ARG 142 HH12 ARG 142 16.828 2.572 14.863 1109 HH21 ARG 142 HH21 ARG 142 14.004 4.341 15.917 1110 HH22 ARG 142 HH22 ARG 142 15.644 3.921 16.281 1111 H THR 143 H THR 143 17.264 3.597 8.958 1112 HA THR 143 HA THR 143 16.512 1.845 6.752 1113 HB THR 143 HB THR 143 19.289 2.451 7.769 1114 HG1 THR 143 HG1 THR 143 18.584 4.403 7.171 1115 HG21 THR 143 HG21 THR 143 18.459 0.652 5.845 1116 HG22 THR 143 HG22 THR 143 20.085 1.302 6.053 1117 HG23 THR 143 HG23 THR 143 18.966 2.069 4.926 1118 H VAL 144 H VAL 144 15.900 -0.143 7.280 1119 HA VAL 144 HA VAL 144 17.154 -1.478 9.571 1120 HB VAL 144 HB VAL 144 14.754 -2.403 7.988 1121 HG11 VAL 144 HG11 VAL 144 14.420 -3.515 10.366 1122 HG12 VAL 144 HG12 VAL 144 16.177 -3.360 10.413 1123 HG13 VAL 144 HG13 VAL 144 15.406 -4.274 9.117 1124 HG21 VAL 144 HG21 VAL 144 13.872 -0.494 8.881 1125 HG22 VAL 144 HG22 VAL 144 14.999 -0.475 10.237 1126 HG23 VAL 144 HG23 VAL 144 13.633 -1.590 10.242 1127 H GLU 145 H GLU 145 18.586 -3.073 9.292 1128 HA GLU 145 HA GLU 145 18.772 -4.316 6.628 1129 HB2 GLU 145 HB3 GLU 145 21.261 -4.600 7.269 1130 HB3 GLU 145 HB2 GLU 145 20.708 -3.025 6.719 1131 HG2 GLU 145 HG3 GLU 145 20.928 -2.069 8.776 1132 HG3 GLU 145 HG2 GLU 145 20.686 -3.592 9.632 1133 H ASP 146 H ASP 146 19.214 -6.490 6.514 1134 HA ASP 146 HA ASP 146 18.998 -7.966 9.055 1135 HB2 ASP 146 HB3 ASP 146 17.753 -8.373 6.378 1136 HB3 ASP 146 HB2 ASP 146 18.185 -9.809 7.301 1137 H THR 147 H THR 147 19.693 -10.457 8.368 1138 HA THR 147 HA THR 147 22.485 -10.390 8.258 1139 HB THR 147 HB THR 147 21.371 -12.282 9.236 1140 HG1 THR 147 HG1 THR 147 22.415 -13.975 8.085 1141 HG21 THR 147 HG21 THR 147 20.477 -13.477 6.704 1142 HG22 THR 147 HG22 THR 147 19.508 -12.135 7.312 1143 HG23 THR 147 HG23 THR 147 19.771 -13.559 8.318 1144 H ASN 148 H ASN 148 20.095 -11.059 5.735 1145 HA ASN 148 HA ASN 148 22.088 -11.485 3.712 1146 HB2 ASN 148 HB3 ASN 148 19.125 -11.478 3.842 1147 HB3 ASN 148 HB2 ASN 148 19.839 -11.098 2.278 1148 HD21 ASN 148 HD21 ASN 148 18.593 -13.151 1.856 1149 HD22 ASN 148 HD22 ASN 148 19.464 -14.634 2.029 1150 HA PRO 149 HA PRO 149 22.896 -7.185 2.845 1151 HB2 PRO 149 HB3 PRO 149 23.560 -8.188 0.133 1152 HB3 PRO 149 HB2 PRO 149 24.547 -7.249 1.258 1153 HG2 PRO 149 HG3 PRO 149 25.038 -9.836 0.835 1154 HG3 PRO 149 HG2 PRO 149 25.205 -9.120 2.447 1155 HD2 PRO 149 HD3 PRO 149 23.008 -10.823 1.352 1156 HD3 PRO 149 HD2 PRO 149 23.742 -10.829 2.969 1157 H ALA 150 H ALA 150 21.045 -9.241 0.691 1158 HA ALA 150 HA ALA 150 19.832 -7.013 -0.696 1159 HB1 ALA 150 HB1 ALA 150 19.128 -8.518 -2.216 1160 HB2 ALA 150 HB2 ALA 150 18.635 -9.686 -0.990 1161 HB3 ALA 150 HB3 ALA 150 20.333 -9.552 -1.448 1162 H LEU 151 H LEU 151 19.229 -8.716 2.192 1163 HA LEU 151 HA LEU 151 16.366 -8.249 2.149 1164 HB2 LEU 151 HB3 LEU 151 18.230 -9.499 4.148 1165 HB3 LEU 151 HB2 LEU 151 16.553 -9.164 4.532 1166 HG LEU 151 HG LEU 151 17.651 -11.124 2.535 1167 HD11 LEU 151 HD11 LEU 151 15.698 -12.375 3.902 1168 HD12 LEU 151 HD12 LEU 151 16.241 -11.218 5.118 1169 HD13 LEU 151 HD13 LEU 151 17.389 -12.352 4.404 1170 HD21 LEU 151 HD21 LEU 151 15.015 -11.453 2.237 1171 HD22 LEU 151 HD22 LEU 151 15.976 -10.415 1.183 1172 HD23 LEU 151 HD23 LEU 151 15.052 -9.711 2.510 1173 H THR 152 H THR 152 18.721 -6.153 2.422 1174 HA THR 152 HA THR 152 17.999 -4.834 4.888 1175 HB THR 152 HB THR 152 19.727 -3.833 2.616 1176 HG1 THR 152 HG1 THR 152 21.380 -4.805 3.570 1177 HG21 THR 152 HG21 THR 152 19.233 -2.842 5.383 1178 HG22 THR 152 HG22 THR 152 19.367 -1.943 3.871 1179 HG23 THR 152 HG23 THR 152 20.811 -2.614 4.630 1180 H HIS 153 H HIS 153 16.304 -3.534 5.102 1181 HA HIS 153 HA HIS 153 15.233 -2.224 2.687 1182 HB2 HIS 153 HB3 HIS 153 13.487 -2.575 5.068 1183 HB3 HIS 153 HB2 HIS 153 13.080 -2.627 3.357 1184 HD1 HIS 153 HD1 HIS 153 12.582 -4.755 5.870 1185 HD2 HIS 153 HD2 HIS 153 14.941 -5.175 2.477 1186 HE1 HIS 153 HE1 HIS 153 12.829 -7.232 5.526 1187 HE2 HIS 153 HE2 HIS 153 14.325 -7.463 3.513 1188 H THR 154 H THR 154 14.021 -0.190 3.139 1189 HA THR 154 HA THR 154 15.125 1.290 5.424 1190 HB THR 154 HB THR 154 14.918 2.423 2.631 1191 HG1 THR 154 HG1 THR 154 17.209 2.254 2.653 1192 HG21 THR 154 HG21 THR 154 15.805 4.359 3.386 1193 HG22 THR 154 HG22 THR 154 16.695 3.575 4.691 1194 HG23 THR 154 HG23 THR 154 14.963 3.867 4.855 1195 H TYR 155 H TYR 155 13.515 2.052 6.608 1196 HA TYR 155 HA TYR 155 10.879 2.409 5.415 1197 HB2 TYR 155 HB3 TYR 155 11.929 2.144 8.200 1198 HB3 TYR 155 HB2 TYR 155 10.395 2.974 7.959 1199 HD1 TYR 155 HD1 TYR 155 8.725 1.644 6.335 1200 HD2 TYR 155 HD2 TYR 155 11.851 -0.118 8.621 1201 HE1 TYR 155 HE1 TYR 155 7.565 -0.522 6.241 1202 HE2 TYR 155 HE2 TYR 155 10.700 -2.289 8.532 1203 HH TYR 155 HH TYR 155 9.044 -3.439 7.102 1204 H GLU 156 H GLU 156 10.166 4.332 4.774 1205 HA GLU 156 HA GLU 156 11.346 6.739 5.994 1206 HB2 GLU 156 HB3 GLU 156 10.761 6.178 3.092 1207 HB3 GLU 156 HB2 GLU 156 10.967 7.812 3.708 1208 HG2 GLU 156 HG3 GLU 156 13.192 7.606 3.887 1209 HG3 GLU 156 HG2 GLU 156 13.099 5.935 4.443 1210 H VAL 157 H VAL 157 9.985 8.343 6.561 1211 HA VAL 157 HA VAL 157 7.122 7.898 6.052 1212 HB VAL 157 HB VAL 157 8.234 9.508 8.344 1213 HG11 VAL 157 HG11 VAL 157 6.002 9.259 9.263 1214 HG12 VAL 157 HG12 VAL 157 5.523 8.252 7.896 1215 HG13 VAL 157 HG13 VAL 157 5.906 9.954 7.645 1216 HG21 VAL 157 HG21 VAL 157 9.034 7.220 8.571 1217 HG22 VAL 157 HG22 VAL 157 7.398 6.608 8.327 1218 HG23 VAL 157 HG23 VAL 157 7.779 7.554 9.765 1219 H TRP 158 H TRP 158 5.828 9.635 5.606 1220 HA TRP 158 HA TRP 158 7.077 12.216 5.039 1221 HB2 TRP 158 HB3 TRP 158 5.657 10.605 2.918 1222 HB3 TRP 158 HB2 TRP 158 6.085 12.302 2.749 1223 HD1 TRP 158 HD1 TRP 158 7.955 8.969 3.493 1224 HE1 TRP 158 HE1 TRP 158 10.235 9.065 2.304 1225 HE3 TRP 158 HE3 TRP 158 7.635 13.666 1.499 1226 HZ2 TRP 158 HZ2 TRP 158 11.696 10.882 0.719 1227 HZ3 TRP 158 HZ3 TRP 158 9.519 14.505 0.155 1228 HH2 TRP 158 HH2 TRP 158 11.506 13.142 -0.226 1229 H GLN 159 H GLN 159 5.764 13.931 5.272 1230 HA GLN 159 HA GLN 159 2.875 13.479 5.508 1231 HB2 GLN 159 HB3 GLN 159 4.582 14.961 7.518 1232 HB3 GLN 159 HB2 GLN 159 2.824 14.954 7.511 1233 HG2 GLN 159 HG3 GLN 159 3.919 12.274 7.469 1234 HG3 GLN 159 HG2 GLN 159 4.483 13.203 8.857 1235 HE21 GLN 159 HE21 GLN 159 2.901 14.121 10.269 1236 HE22 GLN 159 HE22 GLN 159 1.340 13.395 10.417 1237 H LYS 160 H LYS 160 1.759 14.925 4.344 1238 HA LYS 160 HA LYS 160 2.978 16.876 2.778 1239 HB2 LYS 160 HB3 LYS 160 0.743 15.849 2.358 1240 HB3 LYS 160 HB2 LYS 160 0.088 16.828 3.663 1241 HG2 LYS 160 HG3 LYS 160 1.529 18.433 1.730 1242 HG3 LYS 160 HG2 LYS 160 0.221 17.510 0.987 1243 HD2 LYS 160 HD3 LYS 160 -0.479 18.801 3.529 1244 HD3 LYS 160 HD2 LYS 160 -0.081 19.918 2.221 1245 HE2 LYS 160 HE3 LYS 160 -1.693 18.621 0.781 1246 HE3 LYS 160 HE2 LYS 160 -2.201 17.780 2.245 1247 HZ1 LYS 160 HZ1 LYS 160 -3.357 19.996 1.368 1248 HZ2 LYS 160 HZ2 LYS 160 -2.183 20.686 2.372 1249 HZ3 LYS 160 HZ3 LYS 160 -3.294 19.581 3.008 1250 H LYS 161 H LYS 161 3.346 19.023 2.986 1251 HA LYS 161 HA LYS 161 3.586 20.109 5.591 1252 HB2 LYS 161 HB3 LYS 161 3.634 21.643 2.991 1253 HB3 LYS 161 HB2 LYS 161 4.379 22.104 4.515 1254 HG2 LYS 161 HG3 LYS 161 5.894 20.168 4.326 1255 HG3 LYS 161 HG2 LYS 161 5.181 19.798 2.754 1256 HD2 LYS 161 HD3 LYS 161 6.869 21.069 1.970 1257 HD3 LYS 161 HD2 LYS 161 5.810 22.408 2.418 1258 HE2 LYS 161 HE3 LYS 161 7.085 22.999 4.195 1259 HE3 LYS 161 HE2 LYS 161 7.542 21.335 4.556 1260 HZ1 LYS 161 HZ1 LYS 161 8.605 22.450 2.090 1261 HZ2 LYS 161 HZ2 LYS 161 9.346 21.449 3.235 1262 HZ3 LYS 161 HZ3 LYS 161 9.215 23.111 3.524 1263 H ALA 162 H ALA 162 2.356 21.566 6.696 1264 HA ALA 162 HA ALA 162 0.493 22.687 7.369 1265 HB1 ALA 162 HB1 ALA 162 0.729 23.343 4.497 1266 HB2 ALA 162 HB2 ALA 162 0.660 24.404 5.904 1267 HB3 ALA 162 HB3 ALA 162 -0.821 23.694 5.263 1268 H51A NDP 170 H51A NDP 170 -4.860 -1.238 -10.011 1269 H52A NDP 170 H52A NDP 170 -5.436 -2.472 -8.884 1270 H4B NDP 170 H4B NDP 170 -7.092 -3.125 -10.781 1271 H3B NDP 170 H3B NDP 170 -6.191 -0.431 -11.824 1272 HO3A NDP 170 HO3A NDP 170 -5.545 -2.182 -13.063 1273 H2B NDP 170 H2B NDP 170 -8.466 -0.013 -12.425 1274 H1B NDP 170 H1B NDP 170 -9.587 -1.014 -10.091 1275 H8A NDP 170 H8A NDP 170 -6.350 0.866 -9.470 1276 H61A NDP 170 H61A NDP 170 -9.977 5.846 -8.740 1277 H62A NDP 170 H62A NDP 170 -8.388 5.182 -8.448 1278 H2A NDP 170 H2A NDP 170 -12.538 2.468 -10.196 1279 H51N NDP 170 H51N NDP 170 -1.333 -4.353 -8.123 1280 H52N NDP 170 H52N NDP 170 -0.489 -3.419 -9.369 1281 H4D NDP 170 H4D NDP 170 0.971 -5.420 -9.810 1282 H3D NDP 170 H3D NDP 170 -0.569 -6.640 -7.508 1283 HO3N NDP 170 HO3N NDP 170 0.558 -7.622 -9.954 1284 H2D NDP 170 H2D NDP 170 1.477 -7.704 -6.854 1285 HO2N NDP 170 HO2N NDP 170 2.935 -8.250 -8.250 1286 H1D NDP 170 H1D NDP 170 3.068 -5.464 -7.185 1287 H2N NDP 170 H2N NDP 170 3.479 -5.279 -4.828 1288 H71N NDP 170 H71N NDP 170 5.155 -4.782 -2.112 1289 H72N NDP 170 H72N NDP 170 4.791 -5.393 -3.706 1290 H41N NDP 170 H41N NDP 170 0.346 -3.913 -2.774 1291 H42N NDP 170 H42N NDP 170 0.295 -5.684 -2.472 1292 H5N NDP 170 H5N NDP 170 -1.431 -4.993 -4.133 1293 H6N NDP 170 H6N NDP 170 -0.576 -5.432 -6.441 Start of MODEL 8 1 H1 THR 1 HT1 THR 1 -4.602 8.996 5.655 2 H2 THR 1 HT2 THR 1 -5.197 7.529 4.993 3 H3 THR 1 HT3 THR 1 -6.121 8.968 4.862 4 HA THR 1 HA THR 1 -4.958 8.284 2.827 5 HB THR 1 HB THR 1 -4.057 10.637 2.473 6 HG1 THR 1 HG1 THR 1 -4.492 12.082 4.204 7 HG21 THR 1 HG21 THR 1 -6.114 11.363 2.056 8 HG22 THR 1 HG22 THR 1 -6.615 11.186 3.737 9 HG23 THR 1 HG23 THR 1 -6.653 9.795 2.654 10 H ALA 2 H ALA 2 -3.413 6.672 4.227 11 HA ALA 2 HA ALA 2 -0.672 7.714 3.925 12 HB1 ALA 2 HB1 ALA 2 0.054 6.352 5.682 13 HB2 ALA 2 HB2 ALA 2 -1.392 5.345 5.620 14 HB3 ALA 2 HB3 ALA 2 -1.491 6.993 6.241 15 H PHE 3 H PHE 3 0.832 6.516 2.806 16 HA PHE 3 HA PHE 3 -0.255 4.292 1.212 17 HB2 PHE 3 HB3 PHE 3 1.830 6.376 0.670 18 HB3 PHE 3 HB2 PHE 3 1.882 4.845 -0.192 19 HD1 PHE 3 HD1 PHE 3 -1.138 6.750 0.813 20 HD2 PHE 3 HD2 PHE 3 1.400 5.504 -2.367 21 HE1 PHE 3 HE1 PHE 3 -2.763 7.616 -0.819 22 HE2 PHE 3 HE2 PHE 3 -0.218 6.368 -4.004 23 HZ PHE 3 HZ PHE 3 -2.301 7.427 -3.232 24 H LEU 4 H LEU 4 0.385 2.324 1.844 25 HA LEU 4 HA LEU 4 3.112 2.046 2.927 26 HB2 LEU 4 HB3 LEU 4 1.448 1.789 4.702 27 HB3 LEU 4 HB2 LEU 4 0.633 0.546 3.773 28 HG LEU 4 HG LEU 4 2.539 -0.938 4.003 29 HD11 LEU 4 HD11 LEU 4 3.811 1.478 5.217 30 HD12 LEU 4 HD12 LEU 4 4.446 0.366 4.004 31 HD13 LEU 4 HD13 LEU 4 4.336 -0.137 5.691 32 HD21 LEU 4 HD21 LEU 4 1.989 -1.612 6.085 33 HD22 LEU 4 HD22 LEU 4 0.764 -0.352 5.935 34 HD23 LEU 4 HD23 LEU 4 2.270 -0.021 6.791 35 H TRP 5 H TRP 5 4.332 0.969 1.512 36 HA TRP 5 HA TRP 5 3.412 -1.566 0.490 37 HB2 TRP 5 HB3 TRP 5 3.368 -1.112 -1.791 38 HB3 TRP 5 HB2 TRP 5 2.597 0.310 -1.103 39 HD1 TRP 5 HD1 TRP 5 5.762 -0.798 -2.922 40 HE1 TRP 5 HE1 TRP 5 7.014 1.290 -3.755 41 HE3 TRP 5 HE3 TRP 5 2.987 2.795 -0.580 42 HZ2 TRP 5 HZ2 TRP 5 6.847 4.091 -3.459 43 HZ3 TRP 5 HZ3 TRP 5 3.600 5.159 -0.910 44 HH2 TRP 5 HH2 TRP 5 5.489 5.790 -2.319 45 H ALA 6 H ALA 6 5.090 -2.794 -0.584 46 HA ALA 6 HA ALA 6 7.749 -2.027 0.395 47 HB1 ALA 6 HB1 ALA 6 6.909 -4.733 -0.624 48 HB2 ALA 6 HB2 ALA 6 6.721 -4.232 1.056 49 HB3 ALA 6 HB3 ALA 6 8.330 -4.328 0.339 50 H GLN 7 H GLN 7 9.565 -2.049 -0.952 51 HA GLN 7 HA GLN 7 9.194 -2.577 -3.789 52 HB2 GLN 7 HB3 GLN 7 10.211 -0.327 -4.352 53 HB3 GLN 7 HB2 GLN 7 8.550 -0.297 -3.776 54 HG2 GLN 7 HG3 GLN 7 10.275 -0.059 -1.532 55 HG3 GLN 7 HG2 GLN 7 10.799 1.088 -2.765 56 HE21 GLN 7 HE21 GLN 7 8.104 0.061 -0.774 57 HE22 GLN 7 HE22 GLN 7 7.227 1.546 -0.862 58 H ASP 8 H ASP 8 11.203 -2.628 -4.995 59 HA ASP 8 HA ASP 8 13.393 -3.551 -3.327 60 HB2 ASP 8 HB3 ASP 8 14.382 -4.400 -5.370 61 HB3 ASP 8 HB2 ASP 8 12.685 -4.862 -5.314 62 H ARG 9 H ARG 9 15.642 -2.980 -4.674 63 HA ARG 9 HA ARG 9 16.218 -0.369 -3.858 64 HB2 ARG 9 HB3 ARG 9 18.378 -0.693 -5.080 65 HB3 ARG 9 HB2 ARG 9 17.979 -1.972 -3.942 66 HG2 ARG 9 HG3 ARG 9 17.602 -3.515 -5.593 67 HG3 ARG 9 HG2 ARG 9 17.202 -2.290 -6.798 68 HD2 ARG 9 HD3 ARG 9 19.955 -2.795 -5.673 69 HD3 ARG 9 HD2 ARG 9 19.372 -3.378 -7.231 70 HE ARG 9 HE ARG 9 19.157 -0.531 -6.912 71 HH11 ARG 9 HH11 ARG 9 21.261 -3.150 -7.858 72 HH12 ARG 9 HH12 ARG 9 22.255 -2.153 -8.866 73 HH21 ARG 9 HH21 ARG 9 20.463 0.781 -8.238 74 HH22 ARG 9 HH22 ARG 9 21.803 0.079 -9.081 75 H ASP 10 H ASP 10 14.880 -1.469 -6.838 76 HA ASP 10 HA ASP 10 15.651 0.976 -8.232 77 HB2 ASP 10 HB3 ASP 10 14.155 -1.500 -9.096 78 HB3 ASP 10 HB2 ASP 10 14.318 -0.081 -10.126 79 H GLY 11 H GLY 11 12.847 -0.594 -6.868 80 HA2 GLY 11 HA3 GLY 11 11.291 1.205 -5.881 81 HA3 GLY 11 HA2 GLY 11 11.193 1.752 -7.547 82 H LEU 12 H LEU 12 11.479 -1.521 -7.701 83 HA LEU 12 HA LEU 12 9.021 -2.089 -8.760 84 HB2 LEU 12 HB3 LEU 12 11.252 -3.504 -8.391 85 HB3 LEU 12 HB2 LEU 12 10.311 -4.182 -7.079 86 HG LEU 12 HG LEU 12 8.654 -5.031 -8.601 87 HD11 LEU 12 HD11 LEU 12 9.714 -3.002 -10.354 88 HD12 LEU 12 HD12 LEU 12 8.202 -3.903 -10.461 89 HD13 LEU 12 HD13 LEU 12 9.676 -4.571 -11.159 90 HD21 LEU 12 HD21 LEU 12 10.990 -6.127 -8.324 91 HD22 LEU 12 HD22 LEU 12 11.219 -5.645 -10.004 92 HD23 LEU 12 HD23 LEU 12 9.891 -6.720 -9.569 93 H ILE 13 H ILE 13 7.583 -3.937 -7.646 94 HA ILE 13 HA ILE 13 7.078 -3.489 -4.863 95 HB ILE 13 HB ILE 13 4.764 -2.801 -5.046 96 HG12 ILE 13 HG13 ILE 13 4.961 -2.048 -7.907 97 HG13 ILE 13 HG12 ILE 13 4.749 -3.760 -7.572 98 HG21 ILE 13 HG21 ILE 13 6.428 -0.897 -6.674 99 HG22 ILE 13 HG22 ILE 13 6.626 -1.125 -4.937 100 HG23 ILE 13 HG23 ILE 13 5.101 -0.514 -5.578 101 HD11 ILE 13 HD11 ILE 13 2.950 -1.544 -6.633 102 HD12 ILE 13 HD12 ILE 13 2.741 -3.258 -6.276 103 HD13 ILE 13 HD13 ILE 13 2.618 -2.681 -7.938 104 H GLY 14 H GLY 14 6.169 -4.959 -7.917 105 HA2 GLY 14 HA3 GLY 14 5.790 -7.497 -6.562 106 HA3 GLY 14 HA2 GLY 14 4.375 -6.854 -7.380 107 H LYS 15 H LYS 15 4.996 -9.154 -8.307 108 HA LYS 15 HA LYS 15 6.367 -8.634 -10.851 109 HB2 LYS 15 HB3 LYS 15 7.316 -10.897 -10.805 110 HB3 LYS 15 HB2 LYS 15 7.887 -9.940 -9.444 111 HG2 LYS 15 HG3 LYS 15 6.946 -11.293 -7.935 112 HG3 LYS 15 HG2 LYS 15 5.472 -11.491 -8.883 113 HD2 LYS 15 HD3 LYS 15 7.394 -12.829 -10.360 114 HD3 LYS 15 HD2 LYS 15 7.805 -13.213 -8.688 115 HE2 LYS 15 HE3 LYS 15 6.158 -14.700 -8.637 116 HE3 LYS 15 HE2 LYS 15 4.993 -13.410 -8.934 117 HZ1 LYS 15 HZ1 LYS 15 4.614 -14.814 -10.691 118 HZ2 LYS 15 HZ2 LYS 15 6.237 -15.264 -10.848 119 HZ3 LYS 15 HZ3 LYS 15 5.727 -13.743 -11.384 120 H ASP 16 H ASP 16 3.879 -8.239 -11.053 121 HA ASP 16 HA ASP 16 2.035 -8.838 -12.259 122 HB2 ASP 16 HB3 ASP 16 3.126 -11.642 -12.494 123 HB3 ASP 16 HB2 ASP 16 1.982 -10.827 -13.555 124 H GLY 17 H GLY 17 2.353 -9.110 -9.371 125 HA2 GLY 17 HA3 GLY 17 -0.139 -10.252 -8.743 126 HA3 GLY 17 HA2 GLY 17 1.122 -11.412 -8.349 127 H HIS 18 H HIS 18 3.077 -10.169 -7.190 128 HA HIS 18 HA HIS 18 2.469 -8.000 -5.496 129 HB2 HIS 18 HB3 HIS 18 2.210 -9.147 -3.357 130 HB3 HIS 18 HB2 HIS 18 0.937 -9.642 -4.467 131 HD1 HIS 18 HD1 HIS 18 0.987 -11.652 -2.531 132 HD2 HIS 18 HD2 HIS 18 3.990 -11.602 -5.402 133 HE1 HIS 18 HE1 HIS 18 1.954 -13.974 -2.533 134 HE2 HIS 18 HE2 HIS 18 3.708 -13.944 -4.342 135 H LEU 19 H LEU 19 4.035 -8.466 -3.314 136 HA LEU 19 HA LEU 19 6.641 -8.234 -4.374 137 HB2 LEU 19 HB3 LEU 19 7.361 -8.275 -1.994 138 HB3 LEU 19 HB2 LEU 19 6.110 -7.099 -2.346 139 HG LEU 19 HG LEU 19 4.588 -9.192 -1.550 140 HD11 LEU 19 HD11 LEU 19 7.283 -9.734 -0.618 141 HD12 LEU 19 HD12 LEU 19 5.851 -10.763 -0.606 142 HD13 LEU 19 HD13 LEU 19 6.123 -9.616 0.705 143 HD21 LEU 19 HD21 LEU 19 4.688 -6.761 -0.780 144 HD22 LEU 19 HD22 LEU 19 5.821 -7.323 0.449 145 HD23 LEU 19 HD23 LEU 19 4.178 -7.964 0.404 146 HA PRO 20 HA PRO 20 7.356 -12.685 -4.506 147 HB2 PRO 20 HB3 PRO 20 9.555 -12.638 -6.034 148 HB3 PRO 20 HB2 PRO 20 7.952 -12.317 -6.704 149 HG2 PRO 20 HG3 PRO 20 10.112 -10.394 -5.951 150 HG3 PRO 20 HG2 PRO 20 9.032 -10.371 -7.356 151 HD2 PRO 20 HD3 PRO 20 8.666 -8.862 -5.075 152 HD3 PRO 20 HD2 PRO 20 7.372 -9.310 -6.202 153 H TRP 21 H TRP 21 9.043 -10.355 -2.808 154 HA TRP 21 HA TRP 21 11.242 -12.128 -2.071 155 HB2 TRP 21 HB3 TRP 21 11.957 -10.126 -0.672 156 HB3 TRP 21 HB2 TRP 21 11.972 -9.903 -2.418 157 HD1 TRP 21 HD1 TRP 21 9.470 -9.224 0.481 158 HE1 TRP 21 HE1 TRP 21 8.318 -6.972 0.011 159 HE3 TRP 21 HE3 TRP 21 11.664 -8.116 -3.999 160 HZ2 TRP 21 HZ2 TRP 21 8.335 -4.988 -2.001 161 HZ3 TRP 21 HZ3 TRP 21 11.041 -6.024 -5.133 162 HH2 TRP 21 HH2 TRP 21 9.410 -4.494 -4.154 163 H HIS 22 H HIS 22 11.503 -13.039 -0.085 164 HA HIS 22 HA HIS 22 9.124 -13.231 1.557 165 HB2 HIS 22 HB3 HIS 22 11.292 -14.940 0.939 166 HB3 HIS 22 HB2 HIS 22 11.370 -14.636 2.671 167 HD1 HIS 22 HD1 HIS 22 9.596 -16.597 0.152 168 HD2 HIS 22 HD2 HIS 22 8.926 -15.377 4.067 169 HE1 HIS 22 HE1 HIS 22 7.752 -18.076 1.011 170 HE2 HIS 22 HE2 HIS 22 7.308 -17.265 3.354 171 H LEU 23 H LEU 23 8.976 -11.224 2.554 172 HA LEU 23 HA LEU 23 11.157 -10.535 4.407 173 HB2 LEU 23 HB3 LEU 23 9.526 -8.966 2.624 174 HB3 LEU 23 HB2 LEU 23 9.322 -8.404 4.273 175 HG LEU 23 HG LEU 23 11.924 -8.406 4.335 176 HD11 LEU 23 HD11 LEU 23 12.879 -7.856 2.100 177 HD12 LEU 23 HD12 LEU 23 11.363 -8.394 1.377 178 HD13 LEU 23 HD13 LEU 23 12.365 -9.533 2.276 179 HD21 LEU 23 HD21 LEU 23 10.154 -6.420 2.949 180 HD22 LEU 23 HD22 LEU 23 11.875 -6.116 3.182 181 HD23 LEU 23 HD23 LEU 23 10.826 -6.360 4.578 182 HA PRO 24 HA PRO 24 7.941 -12.158 7.248 183 HB2 PRO 24 HB3 PRO 24 9.694 -12.479 9.331 184 HB3 PRO 24 HB2 PRO 24 9.410 -13.697 8.083 185 HG2 PRO 24 HG3 PRO 24 11.622 -11.696 8.310 186 HG3 PRO 24 HG2 PRO 24 11.698 -13.402 7.829 187 HD2 PRO 24 HD3 PRO 24 11.771 -11.413 6.021 188 HD3 PRO 24 HD2 PRO 24 10.966 -12.958 5.679 189 H ASP 25 H ASP 25 10.477 -9.783 7.986 190 HA ASP 25 HA ASP 25 9.176 -8.623 10.199 191 HB2 ASP 25 HB3 ASP 25 10.749 -6.682 9.667 192 HB3 ASP 25 HB2 ASP 25 11.493 -8.231 10.027 193 H ASP 26 H ASP 26 8.915 -8.138 6.754 194 HA ASP 26 HA ASP 26 7.516 -5.637 6.952 195 HB2 ASP 26 HB3 ASP 26 8.897 -6.579 4.954 196 HB3 ASP 26 HB2 ASP 26 7.408 -7.421 4.540 197 H LEU 27 H LEU 27 6.561 -8.963 6.106 198 HA LEU 27 HA LEU 27 3.822 -8.486 5.831 199 HB2 LEU 27 HB3 LEU 27 4.998 -11.040 6.906 200 HB3 LEU 27 HB2 LEU 27 3.521 -10.841 5.982 201 HG LEU 27 HG LEU 27 5.976 -9.968 4.603 202 HD11 LEU 27 HD11 LEU 27 5.546 -12.900 4.626 203 HD12 LEU 27 HD12 LEU 27 6.396 -12.184 5.996 204 HD13 LEU 27 HD13 LEU 27 7.021 -11.970 4.360 205 HD21 LEU 27 HD21 LEU 27 4.775 -11.533 2.877 206 HD22 LEU 27 HD22 LEU 27 4.144 -9.925 3.229 207 HD23 LEU 27 HD23 LEU 27 3.411 -11.343 3.977 208 H HIS 28 H HIS 28 5.564 -9.807 8.648 209 HA HIS 28 HA HIS 28 3.419 -9.917 10.407 210 HB2 HIS 28 HB3 HIS 28 6.377 -9.716 10.726 211 HB3 HIS 28 HB2 HIS 28 5.375 -9.448 12.148 212 HD1 HIS 28 HD1 HIS 28 6.169 -11.617 13.278 213 HD2 HIS 28 HD2 HIS 28 4.345 -12.211 9.592 214 HE1 HIS 28 HE1 HIS 28 5.749 -14.092 13.127 215 HE2 HIS 28 HE2 HIS 28 4.568 -14.416 10.925 216 H TYR 29 H TYR 29 5.552 -7.222 9.617 217 HA TYR 29 HA TYR 29 4.470 -5.472 11.606 218 HB2 TYR 29 HB3 TYR 29 6.768 -5.252 10.634 219 HB3 TYR 29 HB2 TYR 29 6.029 -4.733 9.123 220 HD1 TYR 29 HD1 TYR 29 6.095 -3.868 12.754 221 HD2 TYR 29 HD2 TYR 29 5.693 -2.469 8.756 222 HE1 TYR 29 HE1 TYR 29 6.070 -1.550 13.574 223 HE2 TYR 29 HE2 TYR 29 5.668 -0.147 9.565 224 HH TYR 29 HH TYR 29 6.486 0.686 12.790 225 H PHE 30 H PHE 30 3.841 -6.110 8.209 226 HA PHE 30 HA PHE 30 2.273 -3.904 7.571 227 HB2 PHE 30 HB3 PHE 30 3.079 -6.068 6.197 228 HB3 PHE 30 HB2 PHE 30 1.411 -6.539 6.504 229 HD1 PHE 30 HD1 PHE 30 3.605 -4.183 4.779 230 HD2 PHE 30 HD2 PHE 30 -0.428 -5.330 5.508 231 HE1 PHE 30 HE1 PHE 30 2.871 -2.787 2.891 232 HE2 PHE 30 HE2 PHE 30 -1.170 -3.936 3.621 233 HZ PHE 30 HZ PHE 30 0.481 -2.663 2.309 234 H ARG 31 H ARG 31 1.252 -7.048 8.887 235 HA ARG 31 HA ARG 31 -1.473 -6.196 9.200 236 HB2 ARG 31 HB3 ARG 31 -0.947 -8.540 8.755 237 HB3 ARG 31 HB2 ARG 31 -0.029 -8.635 10.251 238 HG2 ARG 31 HG3 ARG 31 -2.619 -7.694 10.899 239 HG3 ARG 31 HG2 ARG 31 -2.802 -9.083 9.826 240 HD2 ARG 31 HD3 ARG 31 -0.760 -9.541 11.828 241 HD3 ARG 31 HD2 ARG 31 -2.309 -9.134 12.564 242 HE ARG 31 HE ARG 31 -1.645 -11.536 11.126 243 HH11 ARG 31 HH11 ARG 31 -4.235 -9.441 12.171 244 HH12 ARG 31 HH12 ARG 31 -5.437 -10.685 12.097 245 HH21 ARG 31 HH21 ARG 31 -3.226 -13.172 11.029 246 HH22 ARG 31 HH22 ARG 31 -4.865 -12.802 11.449 247 H ALA 32 H ALA 32 1.400 -6.149 11.131 248 HA ALA 32 HA ALA 32 0.087 -5.888 13.662 249 HB1 ALA 32 HB1 ALA 32 2.352 -6.777 13.502 250 HB2 ALA 32 HB2 ALA 32 2.310 -5.339 14.522 251 HB3 ALA 32 HB3 ALA 32 2.923 -5.233 12.872 252 H GLN 33 H GLN 33 1.334 -3.670 11.234 253 HA GLN 33 HA GLN 33 0.909 -1.344 12.886 254 HB2 GLN 33 HB3 GLN 33 2.288 -1.939 10.451 255 HB3 GLN 33 HB2 GLN 33 1.185 -0.602 10.159 256 HG2 GLN 33 HG3 GLN 33 3.085 -0.637 12.480 257 HG3 GLN 33 HG2 GLN 33 3.538 -0.023 10.891 258 HE21 GLN 33 HE21 GLN 33 1.840 1.553 9.980 259 HE22 GLN 33 HE22 GLN 33 1.297 2.772 11.077 260 H THR 34 H THR 34 -0.835 -3.119 10.445 261 HA THR 34 HA THR 34 -2.853 -1.029 10.203 262 HB THR 34 HB THR 34 -3.863 -2.508 8.506 263 HG1 THR 34 HG1 THR 34 -1.655 -4.216 8.985 264 HG21 THR 34 HG21 THR 34 -1.254 -2.771 7.413 265 HG22 THR 34 HG22 THR 34 -1.362 -1.237 8.277 266 HG23 THR 34 HG23 THR 34 -2.521 -1.616 7.002 267 H VAL 35 H VAL 35 -2.555 -2.290 12.766 268 HA VAL 35 HA VAL 35 -4.823 -4.095 13.015 269 HB VAL 35 HB VAL 35 -3.079 -3.000 15.223 270 HG11 VAL 35 HG11 VAL 35 -5.270 -4.978 15.061 271 HG12 VAL 35 HG12 VAL 35 -4.794 -3.915 16.386 272 HG13 VAL 35 HG13 VAL 35 -3.895 -5.402 16.081 273 HG21 VAL 35 HG21 VAL 35 -1.901 -4.292 13.342 274 HG22 VAL 35 HG22 VAL 35 -2.755 -5.703 13.964 275 HG23 VAL 35 HG23 VAL 35 -1.635 -4.822 15.003 276 H GLY 36 H GLY 36 -6.698 -2.986 12.759 277 HA2 GLY 36 HA3 GLY 36 -8.480 -1.873 13.862 278 HA3 GLY 36 HA2 GLY 36 -7.299 -0.976 14.806 279 H LYS 37 H LYS 37 -6.965 -1.326 11.359 280 HA LYS 37 HA LYS 37 -7.922 1.426 10.971 281 HB2 LYS 37 HB3 LYS 37 -5.306 0.248 10.038 282 HB3 LYS 37 HB2 LYS 37 -5.990 1.716 9.353 283 HG2 LYS 37 HG3 LYS 37 -5.974 2.704 11.643 284 HG3 LYS 37 HG2 LYS 37 -5.101 1.272 12.192 285 HD2 LYS 37 HD3 LYS 37 -3.455 1.833 10.275 286 HD3 LYS 37 HD2 LYS 37 -4.203 3.431 10.318 287 HE2 LYS 37 HE3 LYS 37 -3.635 3.636 12.685 288 HE3 LYS 37 HE2 LYS 37 -2.906 2.031 12.655 289 HZ1 LYS 37 HZ1 LYS 37 -1.910 3.916 10.681 290 HZ2 LYS 37 HZ2 LYS 37 -1.071 2.789 11.623 291 HZ3 LYS 37 HZ3 LYS 37 -1.531 4.273 12.291 292 H ILE 38 H ILE 38 -7.764 1.837 8.404 293 HA ILE 38 HA ILE 38 -9.096 -0.471 7.143 294 HB ILE 38 HB ILE 38 -9.683 2.092 5.878 295 HG12 ILE 38 HG13 ILE 38 -10.888 1.670 8.615 296 HG13 ILE 38 HG12 ILE 38 -9.517 2.739 8.341 297 HG21 ILE 38 HG21 ILE 38 -11.993 1.209 6.047 298 HG22 ILE 38 HG22 ILE 38 -11.367 -0.148 6.981 299 HG23 ILE 38 HG23 ILE 38 -10.860 0.077 5.309 300 HD11 ILE 38 HD11 ILE 38 -11.515 4.040 8.385 301 HD12 ILE 38 HD12 ILE 38 -12.276 3.000 7.182 302 HD13 ILE 38 HD13 ILE 38 -10.904 4.012 6.731 303 H MET 39 H MET 39 -8.151 -1.281 5.393 304 HA MET 39 HA MET 39 -6.043 0.310 4.095 305 HB2 MET 39 HB3 MET 39 -5.205 -1.726 5.096 306 HB3 MET 39 HB2 MET 39 -6.427 -2.681 4.271 307 HG2 MET 39 HG3 MET 39 -5.381 -1.893 2.105 308 HG3 MET 39 HG2 MET 39 -4.048 -1.287 3.087 309 HE1 MET 39 HE1 MET 39 -5.315 -5.693 2.775 310 HE2 MET 39 HE2 MET 39 -6.336 -4.278 2.522 311 HE3 MET 39 HE3 MET 39 -5.884 -4.757 4.157 312 H VAL 40 H VAL 40 -6.286 0.933 2.056 313 HA VAL 40 HA VAL 40 -8.601 -0.034 0.551 314 HB VAL 40 HB VAL 40 -6.745 2.246 -0.144 315 HG11 VAL 40 HG11 VAL 40 -9.554 2.099 -1.079 316 HG12 VAL 40 HG12 VAL 40 -8.391 1.003 -1.825 317 HG13 VAL 40 HG13 VAL 40 -8.123 2.745 -1.882 318 HG21 VAL 40 HG21 VAL 40 -9.467 2.777 0.886 319 HG22 VAL 40 HG22 VAL 40 -7.976 3.696 1.090 320 HG23 VAL 40 HG23 VAL 40 -8.263 2.253 2.062 321 H VAL 41 H VAL 41 -8.331 -1.615 -0.875 322 HA VAL 41 HA VAL 41 -5.701 -1.892 -2.170 323 HB VAL 41 HB VAL 41 -6.780 -3.738 -0.553 324 HG11 VAL 41 HG11 VAL 41 -7.697 -4.610 -3.288 325 HG12 VAL 41 HG12 VAL 41 -8.760 -4.043 -2.001 326 HG13 VAL 41 HG13 VAL 41 -7.826 -5.523 -1.785 327 HG21 VAL 41 HG21 VAL 41 -4.938 -3.879 -2.862 328 HG22 VAL 41 HG22 VAL 41 -5.467 -5.406 -2.157 329 HG23 VAL 41 HG23 VAL 41 -4.648 -4.208 -1.155 330 H GLY 42 H GLY 42 -5.720 -2.832 -4.356 331 HA2 GLY 42 HA3 GLY 42 -7.852 -1.623 -5.927 332 HA3 GLY 42 HA2 GLY 42 -6.342 -2.272 -6.547 333 H ARG 43 H ARG 43 -8.441 -2.886 -8.007 334 HA ARG 43 HA ARG 43 -9.970 -5.106 -7.246 335 HB2 ARG 43 HB3 ARG 43 -10.568 -3.711 -9.156 336 HB3 ARG 43 HB2 ARG 43 -9.122 -4.232 -10.011 337 HG2 ARG 43 HG3 ARG 43 -10.212 -6.624 -9.547 338 HG3 ARG 43 HG2 ARG 43 -11.679 -5.645 -9.568 339 HD2 ARG 43 HD3 ARG 43 -9.585 -5.698 -11.737 340 HD3 ARG 43 HD2 ARG 43 -11.120 -6.565 -11.781 341 HE ARG 43 HE ARG 43 -11.288 -3.694 -11.401 342 HH11 ARG 43 HH11 ARG 43 -11.382 -6.360 -13.660 343 HH12 ARG 43 HH12 ARG 43 -12.254 -5.470 -14.861 344 HH21 ARG 43 HH21 ARG 43 -12.430 -2.531 -12.982 345 HH22 ARG 43 HH22 ARG 43 -12.850 -3.297 -14.477 346 H ARG 44 H ARG 44 -7.184 -5.048 -9.474 347 HA ARG 44 HA ARG 44 -6.855 -7.806 -9.662 348 HB2 ARG 44 HB3 ARG 44 -4.778 -5.621 -9.872 349 HB3 ARG 44 HB2 ARG 44 -4.540 -7.283 -10.395 350 HG2 ARG 44 HG3 ARG 44 -6.738 -5.553 -11.484 351 HG3 ARG 44 HG2 ARG 44 -5.119 -5.589 -12.184 352 HD2 ARG 44 HD3 ARG 44 -5.900 -7.273 -13.433 353 HD3 ARG 44 HD2 ARG 44 -5.709 -8.248 -11.977 354 HE ARG 44 HE ARG 44 -8.182 -7.239 -11.674 355 HH11 ARG 44 HH11 ARG 44 -6.629 -8.860 -14.348 356 HH12 ARG 44 HH12 ARG 44 -8.100 -9.552 -14.944 357 HH21 ARG 44 HH21 ARG 44 -10.116 -8.149 -12.457 358 HH22 ARG 44 HH22 ARG 44 -10.079 -9.149 -13.871 359 H THR 45 H THR 45 -6.119 -5.670 -7.078 360 HA THR 45 HA THR 45 -4.080 -7.252 -5.859 361 HB THR 45 HB THR 45 -5.653 -5.475 -4.118 362 HG1 THR 45 HG1 THR 45 -4.483 -4.552 -6.512 363 HG21 THR 45 HG21 THR 45 -2.765 -5.853 -4.783 364 HG22 THR 45 HG22 THR 45 -3.589 -6.042 -3.236 365 HG23 THR 45 HG23 THR 45 -3.321 -4.431 -3.901 366 H TYR 46 H TYR 46 -7.501 -6.646 -4.937 367 HA TYR 46 HA TYR 46 -7.670 -8.373 -2.817 368 HB2 TYR 46 HB3 TYR 46 -10.042 -8.424 -3.109 369 HB3 TYR 46 HB2 TYR 46 -9.493 -6.836 -3.626 370 HD1 TYR 46 HD2 TYR 46 -10.110 -10.211 -5.147 371 HD2 TYR 46 HD1 TYR 46 -10.474 -5.986 -5.534 372 HE1 TYR 46 HE2 TYR 46 -11.253 -10.513 -7.290 373 HE2 TYR 46 HE1 TYR 46 -11.636 -6.285 -7.677 374 HH TYR 46 HH TYR 46 -11.547 -8.463 -9.537 375 H GLU 47 H GLU 47 -7.843 -9.172 -6.243 376 HA GLU 47 HA GLU 47 -8.379 -11.962 -5.733 377 HB2 GLU 47 HB3 GLU 47 -8.457 -10.204 -7.992 378 HB3 GLU 47 HB2 GLU 47 -7.437 -11.581 -8.387 379 HG2 GLU 47 HG3 GLU 47 -10.034 -12.145 -7.088 380 HG3 GLU 47 HG2 GLU 47 -10.063 -11.583 -8.759 381 H SER 48 H SER 48 -5.637 -9.918 -6.193 382 HA SER 48 HA SER 48 -3.851 -12.237 -6.427 383 HB2 SER 48 HB3 SER 48 -3.268 -9.292 -6.821 384 HB3 SER 48 HB2 SER 48 -2.112 -10.604 -7.053 385 HG SER 48 HG SER 48 -3.012 -10.051 -9.033 386 H PHE 49 H PHE 49 -5.226 -11.317 -3.932 387 HA PHE 49 HA PHE 49 -2.872 -10.634 -2.308 388 HB2 PHE 49 HB3 PHE 49 -5.286 -9.398 -2.328 389 HB3 PHE 49 HB2 PHE 49 -5.541 -10.577 -1.047 390 HD1 PHE 49 HD1 PHE 49 -3.508 -7.700 -2.115 391 HD2 PHE 49 HD2 PHE 49 -4.468 -10.367 1.060 392 HE1 PHE 49 HE1 PHE 49 -2.320 -6.239 -0.533 393 HE2 PHE 49 HE2 PHE 49 -3.282 -8.910 2.648 394 HZ PHE 49 HZ PHE 49 -2.206 -6.843 1.852 395 HA PRO 50 HA PRO 50 -3.019 -15.001 -1.181 396 HB2 PRO 50 HB3 PRO 50 -0.902 -14.142 0.701 397 HB3 PRO 50 HB2 PRO 50 -0.874 -15.417 -0.520 398 HG2 PRO 50 HG3 PRO 50 0.465 -13.135 -0.880 399 HG3 PRO 50 HG2 PRO 50 -0.345 -13.950 -2.231 400 HD2 PRO 50 HD3 PRO 50 -1.216 -11.551 -0.667 401 HD3 PRO 50 HD2 PRO 50 -1.332 -11.863 -2.412 402 H LYS 51 H LYS 51 -3.300 -12.242 0.942 403 HA LYS 51 HA LYS 51 -4.650 -13.970 2.911 404 HB2 LYS 51 HB3 LYS 51 -2.455 -13.108 3.719 405 HB3 LYS 51 HB2 LYS 51 -3.072 -11.471 3.537 406 HG2 LYS 51 HG3 LYS 51 -3.328 -11.951 5.803 407 HG3 LYS 51 HG2 LYS 51 -4.939 -12.179 5.120 408 HD2 LYS 51 HD3 LYS 51 -4.774 -14.515 5.222 409 HD3 LYS 51 HD2 LYS 51 -3.021 -14.470 5.412 410 HE2 LYS 51 HE3 LYS 51 -3.726 -13.095 7.595 411 HE3 LYS 51 HE2 LYS 51 -5.166 -14.096 7.418 412 HZ1 LYS 51 HZ1 LYS 51 -2.873 -15.694 7.075 413 HZ2 LYS 51 HZ2 LYS 51 -4.068 -15.803 8.266 414 HZ3 LYS 51 HZ3 LYS 51 -2.716 -14.818 8.514 415 H ARG 52 H ARG 52 -6.468 -13.332 1.378 416 HA ARG 52 HA ARG 52 -7.634 -10.787 2.293 417 HB2 ARG 52 HB3 ARG 52 -8.906 -10.789 0.122 418 HB3 ARG 52 HB2 ARG 52 -7.176 -10.526 -0.026 419 HG2 ARG 52 HG3 ARG 52 -7.085 -12.177 -1.494 420 HG3 ARG 52 HG2 ARG 52 -7.568 -13.301 -0.223 421 HD2 ARG 52 HD3 ARG 52 -9.919 -12.005 -1.039 422 HD3 ARG 52 HD2 ARG 52 -9.045 -12.396 -2.519 423 HE ARG 52 HE ARG 52 -10.301 -14.237 -0.709 424 HH11 ARG 52 HH11 ARG 52 -7.815 -13.859 -3.128 425 HH12 ARG 52 HH12 ARG 52 -7.795 -15.538 -3.550 426 HH21 ARG 52 HH21 ARG 52 -10.276 -16.447 -1.262 427 HH22 ARG 52 HH22 ARG 52 -9.192 -17.007 -2.491 428 HA PRO 53 HA PRO 53 -9.103 -9.897 3.060 429 HB2 PRO 53 HB3 PRO 53 -10.781 -9.971 5.350 430 HB3 PRO 53 HB2 PRO 53 -11.164 -9.295 3.768 431 HG2 PRO 53 HG3 PRO 53 -12.373 -11.527 4.916 432 HG3 PRO 53 HG2 PRO 53 -12.434 -11.084 3.202 433 HD2 PRO 53 HD3 PRO 53 -10.708 -13.089 4.586 434 HD3 PRO 53 HD2 PRO 53 -11.434 -13.146 2.964 435 H LEU 54 H LEU 54 -7.997 -8.816 4.776 436 HA LEU 54 HA LEU 54 -6.255 -10.531 6.267 437 HB2 LEU 54 HB3 LEU 54 -6.550 -7.581 5.929 438 HB3 LEU 54 HB2 LEU 54 -5.560 -8.198 7.237 439 HG LEU 54 HG LEU 54 -5.111 -9.047 4.389 440 HD11 LEU 54 HD11 LEU 54 -3.364 -6.972 5.540 441 HD12 LEU 54 HD12 LEU 54 -4.978 -6.449 5.059 442 HD13 LEU 54 HD13 LEU 54 -3.910 -7.210 3.880 443 HD21 LEU 54 HD21 LEU 54 -2.917 -8.801 6.335 444 HD22 LEU 54 HD22 LEU 54 -3.252 -10.064 5.151 445 HD23 LEU 54 HD23 LEU 54 -4.114 -10.046 6.690 446 HA PRO 55 HA PRO 55 -9.019 -10.866 9.770 447 HB2 PRO 55 HB3 PRO 55 -6.654 -11.956 11.151 448 HB3 PRO 55 HB2 PRO 55 -8.225 -12.703 10.847 449 HG2 PRO 55 HG3 PRO 55 -6.028 -13.481 9.528 450 HG3 PRO 55 HG2 PRO 55 -7.618 -13.438 8.744 451 HD2 PRO 55 HD3 PRO 55 -5.350 -11.493 8.540 452 HD3 PRO 55 HD2 PRO 55 -6.430 -12.106 7.269 453 H GLU 56 H GLU 56 -9.218 -10.134 11.912 454 HA GLU 56 HA GLU 56 -9.188 -8.494 13.478 455 HB2 GLU 56 HB3 GLU 56 -6.306 -9.288 13.238 456 HB3 GLU 56 HB2 GLU 56 -6.813 -8.065 14.395 457 HG2 GLU 56 HG3 GLU 56 -8.582 -10.015 14.956 458 HG3 GLU 56 HG2 GLU 56 -7.207 -10.978 14.418 459 H ARG 57 H ARG 57 -9.004 -7.525 10.655 460 HA ARG 57 HA ARG 57 -8.292 -4.806 11.352 461 HB2 ARG 57 HB3 ARG 57 -6.763 -4.452 9.552 462 HB3 ARG 57 HB2 ARG 57 -6.202 -5.848 10.458 463 HG2 ARG 57 HG3 ARG 57 -6.322 -7.159 8.682 464 HG3 ARG 57 HG2 ARG 57 -7.972 -6.653 8.335 465 HD2 ARG 57 HD3 ARG 57 -5.419 -5.712 7.209 466 HD3 ARG 57 HD2 ARG 57 -7.000 -5.874 6.456 467 HE ARG 57 HE ARG 57 -7.533 -3.786 7.853 468 HH11 ARG 57 HH11 ARG 57 -4.434 -4.469 6.385 469 HH12 ARG 57 HH12 ARG 57 -3.995 -2.801 6.255 470 HH21 ARG 57 HH21 ARG 57 -6.952 -1.599 7.675 471 HH22 ARG 57 HH22 ARG 57 -5.422 -1.173 6.985 472 H THR 58 H THR 58 -8.744 -3.341 9.352 473 HA THR 58 HA THR 58 -11.283 -4.254 8.178 474 HB THR 58 HB THR 58 -10.490 -1.373 8.221 475 HG1 THR 58 HG1 THR 58 -10.112 -2.062 10.343 476 HG21 THR 58 HG21 THR 58 -13.084 -2.864 8.420 477 HG22 THR 58 HG22 THR 58 -12.552 -1.748 7.162 478 HG23 THR 58 HG23 THR 58 -12.941 -1.142 8.772 479 H ASN 59 H ASN 59 -11.203 -4.770 6.094 480 HA ASN 59 HA ASN 59 -9.060 -3.632 4.440 481 HB2 ASN 59 HB3 ASN 59 -10.765 -6.091 4.006 482 HB3 ASN 59 HB2 ASN 59 -9.508 -5.528 2.910 483 HD21 ASN 59 HD21 ASN 59 -10.024 -6.454 6.286 484 HD22 ASN 59 HD22 ASN 59 -8.483 -7.204 6.497 485 H VAL 60 H VAL 60 -9.507 -3.005 2.265 486 HA VAL 60 HA VAL 60 -12.307 -2.404 1.645 487 HB VAL 60 HB VAL 60 -10.059 -0.390 1.645 488 HG11 VAL 60 HG11 VAL 60 -11.010 0.427 -0.215 489 HG12 VAL 60 HG12 VAL 60 -12.262 1.013 0.880 490 HG13 VAL 60 HG13 VAL 60 -12.490 -0.506 0.013 491 HG21 VAL 60 HG21 VAL 60 -11.034 0.556 3.428 492 HG22 VAL 60 HG22 VAL 60 -11.780 -1.027 3.639 493 HG23 VAL 60 HG23 VAL 60 -12.664 0.263 2.824 494 H VAL 61 H VAL 61 -12.818 -2.717 -0.445 495 HA VAL 61 HA VAL 61 -10.628 -3.424 -2.276 496 HB VAL 61 HB VAL 61 -13.529 -4.265 -2.285 497 HG11 VAL 61 HG11 VAL 61 -12.075 -5.821 -4.110 498 HG12 VAL 61 HG12 VAL 61 -11.653 -4.144 -4.456 499 HG13 VAL 61 HG13 VAL 61 -13.344 -4.648 -4.464 500 HG21 VAL 61 HG21 VAL 61 -11.485 -6.333 -2.271 501 HG22 VAL 61 HG22 VAL 61 -12.894 -6.126 -1.231 502 HG23 VAL 61 HG23 VAL 61 -11.394 -5.275 -0.863 503 H LEU 62 H LEU 62 -10.403 -2.429 -4.207 504 HA LEU 62 HA LEU 62 -12.383 -0.365 -4.910 505 HB2 LEU 62 HB3 LEU 62 -10.138 0.453 -4.020 506 HB3 LEU 62 HB2 LEU 62 -9.436 -0.182 -5.495 507 HG LEU 62 HG LEU 62 -10.964 1.333 -6.789 508 HD11 LEU 62 HD11 LEU 62 -12.227 2.986 -5.764 509 HD12 LEU 62 HD12 LEU 62 -11.380 2.818 -4.225 510 HD13 LEU 62 HD13 LEU 62 -12.517 1.575 -4.748 511 HD21 LEU 62 HD21 LEU 62 -9.701 3.466 -5.782 512 HD22 LEU 62 HD22 LEU 62 -8.900 2.258 -6.789 513 HD23 LEU 62 HD23 LEU 62 -8.746 2.186 -5.033 514 H THR 63 H THR 63 -13.489 -1.423 -6.482 515 HA THR 63 HA THR 63 -11.963 -2.191 -8.870 516 HB THR 63 HB THR 63 -12.683 -4.218 -7.618 517 HG1 THR 63 HG1 THR 63 -13.616 -3.639 -10.188 518 HG21 THR 63 HG21 THR 63 -14.672 -4.299 -6.666 519 HG22 THR 63 HG22 THR 63 -15.381 -4.406 -8.278 520 HG23 THR 63 HG23 THR 63 -15.194 -2.835 -7.498 521 H HIS 64 H HIS 64 -13.024 -1.822 -10.865 522 HA HIS 64 HA HIS 64 -14.817 0.397 -10.846 523 HB2 HIS 64 HB3 HIS 64 -13.923 -1.368 -13.134 524 HB3 HIS 64 HB2 HIS 64 -14.814 0.137 -13.311 525 HD1 HIS 64 HD1 HIS 64 -13.512 2.324 -13.053 526 HD2 HIS 64 HD2 HIS 64 -11.204 -1.073 -12.420 527 HE1 HIS 64 HE1 HIS 64 -11.129 3.126 -13.028 528 HE2 HIS 64 HE2 HIS 64 -9.747 1.041 -12.732 529 H GLN 65 H GLN 65 -15.192 -3.056 -11.162 530 HA GLN 65 HA GLN 65 -17.643 -3.297 -12.380 531 HB2 GLN 65 HB3 GLN 65 -16.248 -4.884 -10.264 532 HB3 GLN 65 HB2 GLN 65 -17.900 -5.299 -10.699 533 HG2 GLN 65 HG3 GLN 65 -17.274 -6.259 -12.606 534 HG3 GLN 65 HG2 GLN 65 -16.175 -4.941 -13.012 535 HE21 GLN 65 HE21 GLN 65 -14.073 -4.943 -11.959 536 HE22 GLN 65 HE22 GLN 65 -13.330 -6.453 -11.569 537 H GLU 66 H GLU 66 -19.684 -2.829 -11.888 538 HA GLU 66 HA GLU 66 -20.242 -1.394 -9.440 539 HB2 GLU 66 HB3 GLU 66 -22.339 -2.156 -11.444 540 HB3 GLU 66 HB2 GLU 66 -22.240 -0.718 -10.437 541 HG2 GLU 66 HG3 GLU 66 -20.138 -0.183 -11.858 542 HG3 GLU 66 HG2 GLU 66 -20.833 -1.337 -12.994 543 H ASP 67 H ASP 67 -20.922 -4.507 -10.870 544 HA ASP 67 HA ASP 67 -22.679 -5.244 -8.662 545 HB2 ASP 67 HB3 ASP 67 -22.835 -5.843 -11.291 546 HB3 ASP 67 HB2 ASP 67 -21.965 -7.259 -10.708 547 H TYR 68 H TYR 68 -19.646 -4.874 -8.466 548 HA TYR 68 HA TYR 68 -18.715 -7.548 -7.869 549 HB2 TYR 68 HB3 TYR 68 -17.178 -5.838 -8.790 550 HB3 TYR 68 HB2 TYR 68 -17.391 -4.880 -7.328 551 HD1 TYR 68 HD1 TYR 68 -15.882 -7.906 -8.750 552 HD2 TYR 68 HD2 TYR 68 -16.335 -5.531 -5.250 553 HE1 TYR 68 HE1 TYR 68 -14.033 -9.130 -7.688 554 HE2 TYR 68 HE2 TYR 68 -14.485 -6.748 -4.179 555 HH TYR 68 HH TYR 68 -13.460 -9.463 -4.810 556 H GLN 69 H GLN 69 -18.681 -8.510 -5.916 557 HA GLN 69 HA GLN 69 -19.473 -6.891 -3.591 558 HB2 GLN 69 HB3 GLN 69 -20.280 -9.420 -2.921 559 HB3 GLN 69 HB2 GLN 69 -21.329 -8.152 -3.529 560 HG2 GLN 69 HG3 GLN 69 -19.983 -9.759 -5.590 561 HG3 GLN 69 HG2 GLN 69 -21.132 -10.629 -4.581 562 HE21 GLN 69 HE21 GLN 69 -21.363 -7.234 -5.443 563 HE22 GLN 69 HE22 GLN 69 -22.786 -7.386 -6.408 564 H ALA 70 H ALA 70 -17.857 -6.727 -2.219 565 HA ALA 70 HA ALA 70 -15.951 -8.953 -1.972 566 HB1 ALA 70 HB1 ALA 70 -15.385 -6.368 -2.472 567 HB2 ALA 70 HB2 ALA 70 -14.285 -7.467 -1.640 568 HB3 ALA 70 HB3 ALA 70 -15.304 -6.368 -0.710 569 H GLN 71 H GLN 71 -16.849 -10.266 -0.467 570 HA GLN 71 HA GLN 71 -18.187 -9.323 1.861 571 HB2 GLN 71 HB3 GLN 71 -17.230 -12.010 0.926 572 HB3 GLN 71 HB2 GLN 71 -17.831 -11.803 2.565 573 HG2 GLN 71 HG3 GLN 71 -19.652 -12.565 1.295 574 HG3 GLN 71 HG2 GLN 71 -19.926 -10.841 1.546 575 HE21 GLN 71 HE21 GLN 71 -18.015 -12.750 -0.760 576 HE22 GLN 71 HE22 GLN 71 -18.674 -12.014 -2.177 577 H GLY 72 H GLY 72 -17.347 -8.642 3.710 578 HA2 GLY 72 HA3 GLY 72 -15.895 -8.955 5.588 579 HA3 GLY 72 HA2 GLY 72 -14.691 -9.623 4.499 580 H ALA 73 H ALA 73 -15.232 -7.329 2.557 581 HA ALA 73 HA ALA 73 -13.877 -5.214 4.094 582 HB1 ALA 73 HB1 ALA 73 -12.240 -6.383 2.728 583 HB2 ALA 73 HB2 ALA 73 -12.495 -4.747 2.121 584 HB3 ALA 73 HB3 ALA 73 -13.227 -6.120 1.291 585 H VAL 74 H VAL 74 -13.909 -3.082 2.840 586 HA VAL 74 HA VAL 74 -16.662 -2.520 2.142 587 HB VAL 74 HB VAL 74 -14.403 -0.534 2.016 588 HG11 VAL 74 HG11 VAL 74 -15.998 1.048 1.922 589 HG12 VAL 74 HG12 VAL 74 -17.050 0.203 3.058 590 HG13 VAL 74 HG13 VAL 74 -17.017 -0.278 1.361 591 HG21 VAL 74 HG21 VAL 74 -14.921 0.005 4.390 592 HG22 VAL 74 HG22 VAL 74 -14.173 -1.577 4.170 593 HG23 VAL 74 HG23 VAL 74 -15.908 -1.455 4.463 594 H VAL 75 H VAL 75 -17.440 -1.904 0.158 595 HA VAL 75 HA VAL 75 -15.570 -2.243 -2.095 596 HB VAL 75 HB VAL 75 -18.557 -2.670 -2.115 597 HG11 VAL 75 HG11 VAL 75 -16.480 -2.622 -4.198 598 HG12 VAL 75 HG12 VAL 75 -18.220 -2.357 -4.320 599 HG13 VAL 75 HG13 VAL 75 -17.580 -4.000 -4.260 600 HG21 VAL 75 HG21 VAL 75 -16.706 -4.931 -2.502 601 HG22 VAL 75 HG22 VAL 75 -18.258 -4.862 -1.665 602 HG23 VAL 75 HG23 VAL 75 -16.798 -4.278 -0.866 603 H VAL 76 H VAL 76 -15.392 -0.770 -3.639 604 HA VAL 76 HA VAL 76 -17.327 1.299 -4.100 605 HB VAL 76 HB VAL 76 -15.839 3.200 -3.699 606 HG11 VAL 76 HG11 VAL 76 -17.410 2.310 -1.931 607 HG12 VAL 76 HG12 VAL 76 -16.096 3.336 -1.356 608 HG13 VAL 76 HG13 VAL 76 -15.995 1.585 -1.168 609 HG21 VAL 76 HG21 VAL 76 -13.649 2.867 -3.574 610 HG22 VAL 76 HG22 VAL 76 -13.869 1.129 -3.368 611 HG23 VAL 76 HG23 VAL 76 -13.893 2.193 -1.962 612 H HIS 77 H HIS 77 -16.687 2.647 -6.000 613 HA HIS 77 HA HIS 77 -14.682 1.248 -7.650 614 HB2 HIS 77 HB3 HIS 77 -17.038 2.527 -8.957 615 HB3 HIS 77 HB2 HIS 77 -16.082 1.143 -9.473 616 HD1 HIS 77 HD1 HIS 77 -16.401 -0.747 -7.128 617 HD2 HIS 77 HD2 HIS 77 -19.530 1.515 -8.665 618 HE1 HIS 77 HE1 HIS 77 -18.501 -1.956 -6.453 619 HE2 HIS 77 HE2 HIS 77 -20.377 -0.610 -7.459 620 H ASP 78 H ASP 78 -15.641 4.243 -6.377 621 HA ASP 78 HA ASP 78 -13.882 5.609 -8.304 622 HB2 ASP 78 HB3 ASP 78 -16.434 6.665 -7.074 623 HB3 ASP 78 HB2 ASP 78 -15.300 7.641 -8.003 624 H VAL 79 H VAL 79 -12.903 7.614 -7.467 625 HA VAL 79 HA VAL 79 -11.709 7.165 -4.944 626 HB VAL 79 HB VAL 79 -10.801 9.531 -5.347 627 HG11 VAL 79 HG11 VAL 79 -10.139 7.568 -7.511 628 HG12 VAL 79 HG12 VAL 79 -9.691 7.293 -5.827 629 HG13 VAL 79 HG13 VAL 79 -9.068 8.701 -6.686 630 HG21 VAL 79 HG21 VAL 79 -12.643 10.084 -6.989 631 HG22 VAL 79 HG22 VAL 79 -11.791 9.054 -8.140 632 HG23 VAL 79 HG23 VAL 79 -11.003 10.491 -7.490 633 H ALA 80 H ALA 80 -14.187 9.367 -6.124 634 HA ALA 80 HA ALA 80 -14.434 10.875 -3.740 635 HB1 ALA 80 HB1 ALA 80 -15.404 11.169 -6.241 636 HB2 ALA 80 HB2 ALA 80 -16.035 12.031 -4.838 637 HB3 ALA 80 HB3 ALA 80 -16.842 10.572 -5.412 638 H ALA 81 H ALA 81 -16.127 8.042 -5.002 639 HA ALA 81 HA ALA 81 -18.092 7.758 -3.069 640 HB1 ALA 81 HB1 ALA 81 -18.447 5.659 -3.914 641 HB2 ALA 81 HB2 ALA 81 -16.725 5.308 -4.064 642 HB3 ALA 81 HB3 ALA 81 -17.516 6.365 -5.234 643 H VAL 82 H VAL 82 -15.003 5.966 -3.114 644 HA VAL 82 HA VAL 82 -15.134 4.905 -0.582 645 HB VAL 82 HB VAL 82 -13.413 4.525 -2.487 646 HG11 VAL 82 HG11 VAL 82 -11.509 5.764 -2.594 647 HG12 VAL 82 HG12 VAL 82 -11.576 6.218 -0.891 648 HG13 VAL 82 HG13 VAL 82 -12.626 7.018 -2.058 649 HG21 VAL 82 HG21 VAL 82 -12.363 4.498 0.330 650 HG22 VAL 82 HG22 VAL 82 -11.949 3.408 -0.993 651 HG23 VAL 82 HG23 VAL 82 -13.558 3.350 -0.271 652 H PHE 83 H PHE 83 -14.163 8.166 -1.526 653 HA PHE 83 HA PHE 83 -12.924 8.901 0.874 654 HB2 PHE 83 HB3 PHE 83 -14.327 10.470 -1.279 655 HB3 PHE 83 HB2 PHE 83 -13.628 11.252 0.124 656 HD1 PHE 83 HD2 PHE 83 -11.242 9.189 0.227 657 HD2 PHE 83 HD1 PHE 83 -12.903 11.681 -2.799 658 HE1 PHE 83 HE2 PHE 83 -9.065 9.252 -0.911 659 HE2 PHE 83 HE1 PHE 83 -10.726 11.746 -3.942 660 HZ PHE 83 HZ PHE 83 -8.804 10.531 -2.998 661 H ALA 84 H ALA 84 -16.311 9.067 -0.155 662 HA ALA 84 HA ALA 84 -17.300 10.425 2.098 663 HB1 ALA 84 HB1 ALA 84 -18.799 8.332 0.528 664 HB2 ALA 84 HB2 ALA 84 -18.548 9.980 -0.046 665 HB3 ALA 84 HB3 ALA 84 -19.469 9.691 1.430 666 H TYR 85 H TYR 85 -16.727 7.028 1.442 667 HA TYR 85 HA TYR 85 -17.858 5.990 3.801 668 HB2 TYR 85 HB3 TYR 85 -17.278 4.051 2.837 669 HB3 TYR 85 HB2 TYR 85 -16.434 4.951 1.588 670 HD1 TYR 85 HD1 TYR 85 -15.864 3.725 5.081 671 HD2 TYR 85 HD2 TYR 85 -14.225 4.465 1.231 672 HE1 TYR 85 HE1 TYR 85 -13.732 2.731 5.804 673 HE2 TYR 85 HE2 TYR 85 -12.088 3.473 1.941 674 HH TYR 85 HH TYR 85 -11.273 2.944 5.098 675 H ALA 86 H ALA 86 -14.397 6.589 3.083 676 HA ALA 86 HA ALA 86 -13.292 6.217 5.520 677 HB1 ALA 86 HB1 ALA 86 -12.352 7.185 3.218 678 HB2 ALA 86 HB2 ALA 86 -11.462 7.303 4.736 679 HB3 ALA 86 HB3 ALA 86 -12.394 8.681 4.151 680 H LYS 87 H LYS 87 -15.307 8.934 4.584 681 HA LYS 87 HA LYS 87 -14.711 10.554 6.855 682 HB2 LYS 87 HB3 LYS 87 -16.102 10.932 4.517 683 HB3 LYS 87 HB2 LYS 87 -17.401 10.838 5.698 684 HG2 LYS 87 HG3 LYS 87 -16.973 13.081 5.708 685 HG3 LYS 87 HG2 LYS 87 -15.915 12.545 7.015 686 HD2 LYS 87 HD3 LYS 87 -14.451 13.841 5.824 687 HD3 LYS 87 HD2 LYS 87 -14.183 12.282 5.042 688 HE2 LYS 87 HE3 LYS 87 -14.431 14.107 3.415 689 HE3 LYS 87 HE2 LYS 87 -15.693 12.887 3.247 690 HZ1 LYS 87 HZ1 LYS 87 -16.180 15.264 4.912 691 HZ2 LYS 87 HZ2 LYS 87 -17.288 14.297 4.076 692 HZ3 LYS 87 HZ3 LYS 87 -16.310 15.385 3.229 693 H GLN 88 H GLN 88 -17.272 8.280 6.046 694 HA GLN 88 HA GLN 88 -18.799 8.496 8.373 695 HB2 GLN 88 HB3 GLN 88 -19.469 7.301 6.278 696 HB3 GLN 88 HB2 GLN 88 -18.394 5.988 6.737 697 HG2 GLN 88 HG3 GLN 88 -20.134 5.087 7.770 698 HG3 GLN 88 HG2 GLN 88 -19.955 6.357 8.980 699 HE21 GLN 88 HE21 GLN 88 -21.162 6.335 5.644 700 HE22 GLN 88 HE22 GLN 88 -22.701 7.028 6.014 701 H HIS 89 H HIS 89 -15.706 7.090 7.899 702 HA HIS 89 HA HIS 89 -15.888 5.687 10.479 703 HB2 HIS 89 HB3 HIS 89 -14.417 5.165 7.964 704 HB3 HIS 89 HB2 HIS 89 -13.535 4.833 9.452 705 HD1 HIS 89 HD1 HIS 89 -15.772 3.646 11.169 706 HD2 HIS 89 HD2 HIS 89 -15.160 2.679 7.175 707 HE1 HIS 89 HE1 HIS 89 -16.836 1.389 10.854 708 HE2 HIS 89 HE2 HIS 89 -16.529 0.864 8.408 709 HA PRO 90 HA PRO 90 -13.182 9.393 11.237 710 HB2 PRO 90 HB3 PRO 90 -14.421 10.299 13.438 711 HB3 PRO 90 HB2 PRO 90 -15.021 10.669 11.817 712 HG2 PRO 90 HG3 PRO 90 -15.968 8.592 13.757 713 HG3 PRO 90 HG2 PRO 90 -16.922 9.703 12.756 714 HD2 PRO 90 HD3 PRO 90 -16.467 7.096 12.087 715 HD3 PRO 90 HD2 PRO 90 -16.736 8.380 10.893 716 H ASP 91 H ASP 91 -13.879 6.478 12.746 717 HA ASP 91 HA ASP 91 -12.039 6.969 14.976 718 HB2 ASP 91 HB3 ASP 91 -14.297 5.924 15.393 719 HB3 ASP 91 HB2 ASP 91 -13.733 4.517 14.497 720 H GLN 92 H GLN 92 -11.686 6.144 11.891 721 HA GLN 92 HA GLN 92 -9.384 4.435 12.477 722 HB2 GLN 92 HB3 GLN 92 -11.776 3.545 11.194 723 HB3 GLN 92 HB2 GLN 92 -10.478 3.546 10.009 724 HG2 GLN 92 HG3 GLN 92 -9.950 1.546 10.809 725 HG3 GLN 92 HG2 GLN 92 -9.292 2.406 12.200 726 HE21 GLN 92 HE21 GLN 92 -12.450 1.306 11.003 727 HE22 GLN 92 HE22 GLN 92 -12.998 0.685 12.519 728 H GLU 93 H GLU 93 -7.988 4.187 10.454 729 HA GLU 93 HA GLU 93 -7.981 6.722 8.949 730 HB2 GLU 93 HB3 GLU 93 -5.662 5.156 10.080 731 HB3 GLU 93 HB2 GLU 93 -5.466 6.425 8.879 732 HG2 GLU 93 HG3 GLU 93 -5.660 8.037 10.397 733 HG3 GLU 93 HG2 GLU 93 -7.060 7.277 11.151 734 H LEU 94 H LEU 94 -6.877 6.603 6.836 735 HA LEU 94 HA LEU 94 -7.472 4.039 5.545 736 HB2 LEU 94 HB3 LEU 94 -8.209 6.574 4.860 737 HB3 LEU 94 HB2 LEU 94 -6.791 6.347 3.854 738 HG LEU 94 HG LEU 94 -7.851 4.222 3.005 739 HD11 LEU 94 HD11 LEU 94 -9.516 3.515 4.355 740 HD12 LEU 94 HD12 LEU 94 -10.494 4.543 3.307 741 HD13 LEU 94 HD13 LEU 94 -9.942 5.147 4.870 742 HD21 LEU 94 HD21 LEU 94 -8.757 6.986 2.492 743 HD22 LEU 94 HD22 LEU 94 -9.748 5.695 1.815 744 HD23 LEU 94 HD23 LEU 94 -8.037 5.804 1.399 745 H VAL 95 H VAL 95 -5.953 2.843 4.542 746 HA VAL 95 HA VAL 95 -3.274 3.980 4.175 747 HB VAL 95 HB VAL 95 -3.722 1.255 5.392 748 HG11 VAL 95 HG11 VAL 95 -1.254 1.605 5.962 749 HG12 VAL 95 HG12 VAL 95 -1.291 2.901 4.766 750 HG13 VAL 95 HG13 VAL 95 -1.660 1.245 4.284 751 HG21 VAL 95 HG21 VAL 95 -2.831 2.297 7.482 752 HG22 VAL 95 HG22 VAL 95 -4.438 2.856 7.017 753 HG23 VAL 95 HG23 VAL 95 -3.029 3.873 6.715 754 H ILE 96 H ILE 96 -2.826 3.784 2.083 755 HA ILE 96 HA ILE 96 -4.110 1.813 0.427 756 HB ILE 96 HB ILE 96 -1.830 3.609 -0.385 757 HG12 ILE 96 HG13 ILE 96 -3.554 4.995 0.656 758 HG13 ILE 96 HG12 ILE 96 -3.539 5.245 -1.087 759 HG21 ILE 96 HG21 ILE 96 -4.116 2.498 -2.003 760 HG22 ILE 96 HG22 ILE 96 -2.520 1.754 -1.899 761 HG23 ILE 96 HG23 ILE 96 -2.699 3.362 -2.601 762 HD11 ILE 96 HD11 ILE 96 -5.525 3.687 0.536 763 HD12 ILE 96 HD12 ILE 96 -5.442 3.612 -1.224 764 HD13 ILE 96 HD13 ILE 96 -5.799 5.142 -0.423 765 H ALA 97 H ALA 97 -3.346 -0.115 -0.189 766 HA ALA 97 HA ALA 97 -0.562 -0.776 0.518 767 HB1 ALA 97 HB1 ALA 97 -3.096 -2.268 0.820 768 HB2 ALA 97 HB2 ALA 97 -1.662 -2.243 1.846 769 HB3 ALA 97 HB3 ALA 97 -1.670 -3.200 0.365 770 H GLY 98 H GLY 98 -2.976 -0.795 -1.989 771 HA2 GLY 98 HA3 GLY 98 -1.283 -0.853 -4.131 772 HA3 GLY 98 HA2 GLY 98 -1.535 -2.550 -3.751 773 H GLY 99 H GLY 99 -4.033 -1.659 -6.310 774 HA2 GLY 99 HA3 GLY 99 -1.208 -2.235 -5.822 775 HA3 GLY 99 HA2 GLY 99 -2.066 -2.429 -7.341 776 H ALA 100 H ALA 100 -0.415 -1.355 -8.466 777 HA ALA 100 HA ALA 100 0.601 1.176 -7.843 778 HB1 ALA 100 HB1 ALA 100 0.574 -0.578 -10.206 779 HB2 ALA 100 HB2 ALA 100 1.911 0.279 -9.440 780 HB3 ALA 100 HB3 ALA 100 0.824 1.137 -10.532 781 H GLN 101 H GLN 101 -2.235 0.217 -9.715 782 HA GLN 101 HA GLN 101 -2.861 2.781 -10.720 783 HB2 GLN 101 HB3 GLN 101 -4.119 0.151 -10.622 784 HB3 GLN 101 HB2 GLN 101 -5.285 1.458 -10.490 785 HG2 GLN 101 HG3 GLN 101 -3.206 1.413 -12.646 786 HG3 GLN 101 HG2 GLN 101 -4.749 0.577 -12.816 787 HE21 GLN 101 HE21 GLN 101 -6.564 2.206 -11.811 788 HE22 GLN 101 HE22 GLN 101 -6.587 3.727 -12.628 789 H ILE 102 H ILE 102 -3.691 1.091 -7.753 790 HA ILE 102 HA ILE 102 -5.625 2.943 -6.833 791 HB ILE 102 HB ILE 102 -3.883 1.128 -5.162 792 HG12 ILE 102 HG13 ILE 102 -5.077 -0.089 -6.962 793 HG13 ILE 102 HG12 ILE 102 -5.662 -0.522 -5.359 794 HG21 ILE 102 HG21 ILE 102 -5.207 2.983 -4.040 795 HG22 ILE 102 HG22 ILE 102 -5.495 1.343 -3.459 796 HG23 ILE 102 HG23 ILE 102 -6.654 2.111 -4.545 797 HD11 ILE 102 HD11 ILE 102 -7.364 -0.123 -7.237 798 HD12 ILE 102 HD12 ILE 102 -7.036 1.588 -6.964 799 HD13 ILE 102 HD13 ILE 102 -7.667 0.592 -5.654 800 H PHE 103 H PHE 103 -2.154 2.569 -6.186 801 HA PHE 103 HA PHE 103 -1.876 4.651 -4.346 802 HB2 PHE 103 HB3 PHE 103 0.065 3.491 -6.348 803 HB3 PHE 103 HB2 PHE 103 0.528 4.710 -5.165 804 HD1 PHE 103 HD1 PHE 103 -0.743 3.917 -2.732 805 HD2 PHE 103 HD2 PHE 103 0.986 1.477 -5.760 806 HE1 PHE 103 HE1 PHE 103 -0.333 2.150 -1.069 807 HE2 PHE 103 HE2 PHE 103 1.398 -0.295 -4.104 808 HZ PHE 103 HZ PHE 103 0.738 0.041 -1.755 809 H THR 104 H THR 104 -1.716 4.649 -7.876 810 HA THR 104 HA THR 104 -0.906 7.282 -8.277 811 HB THR 104 HB THR 104 -2.747 5.618 -10.002 812 HG1 THR 104 HG1 THR 104 -0.806 4.562 -9.691 813 HG21 THR 104 HG21 THR 104 -0.909 7.436 -11.329 814 HG22 THR 104 HG22 THR 104 -2.140 8.259 -10.370 815 HG23 THR 104 HG23 THR 104 -2.618 7.122 -11.631 816 H ALA 105 H ALA 105 -4.215 5.970 -8.039 817 HA ALA 105 HA ALA 105 -5.585 8.350 -8.518 818 HB1 ALA 105 HB1 ALA 105 -6.236 5.780 -7.212 819 HB2 ALA 105 HB2 ALA 105 -7.060 6.631 -8.518 820 HB3 ALA 105 HB3 ALA 105 -7.291 7.145 -6.847 821 H PHE 106 H PHE 106 -4.886 6.931 -5.282 822 HA PHE 106 HA PHE 106 -5.662 9.318 -3.970 823 HB2 PHE 106 HB3 PHE 106 -4.131 6.895 -3.008 824 HB3 PHE 106 HB2 PHE 106 -4.681 8.197 -1.958 825 HD1 PHE 106 HD2 PHE 106 -5.849 5.553 -4.274 826 HD2 PHE 106 HD1 PHE 106 -6.873 8.229 -1.127 827 HE1 PHE 106 HE2 PHE 106 -8.023 4.425 -4.029 828 HE2 PHE 106 HE1 PHE 106 -9.047 7.104 -0.875 829 HZ PHE 106 HZ PHE 106 -9.623 5.200 -2.329 830 H LYS 107 H LYS 107 -2.819 8.442 -5.625 831 HA LYS 107 HA LYS 107 -0.735 9.507 -4.215 832 HB2 LYS 107 HB3 LYS 107 0.435 9.510 -6.176 833 HB3 LYS 107 HB2 LYS 107 -0.949 8.569 -6.706 834 HG2 LYS 107 HG3 LYS 107 -1.951 10.741 -7.526 835 HG3 LYS 107 HG2 LYS 107 -0.370 11.467 -7.236 836 HD2 LYS 107 HD3 LYS 107 0.655 9.858 -8.763 837 HD3 LYS 107 HD2 LYS 107 -0.920 9.112 -9.041 838 HE2 LYS 107 HE3 LYS 107 -1.608 10.766 -10.417 839 HE3 LYS 107 HE2 LYS 107 -0.787 12.020 -9.488 840 HZ1 LYS 107 HZ1 LYS 107 1.071 11.840 -10.721 841 HZ2 LYS 107 HZ2 LYS 107 0.016 11.214 -11.885 842 HZ3 LYS 107 HZ3 LYS 107 0.930 10.166 -10.922 843 H ASP 108 H ASP 108 -3.296 11.212 -5.861 844 HA ASP 108 HA ASP 108 -2.110 13.814 -5.336 845 HB2 ASP 108 HB3 ASP 108 -4.404 12.796 -6.925 846 HB3 ASP 108 HB2 ASP 108 -4.558 14.424 -6.271 847 H ASP 109 H ASP 109 -4.804 11.809 -4.268 848 HA ASP 109 HA ASP 109 -5.702 13.812 -2.365 849 HB2 ASP 109 HB3 ASP 109 -6.882 11.607 -3.681 850 HB3 ASP 109 HB2 ASP 109 -6.940 11.253 -1.957 851 H VAL 110 H VAL 110 -3.089 11.980 -2.252 852 HA VAL 110 HA VAL 110 -3.437 10.749 0.344 853 HB VAL 110 HB VAL 110 -2.066 9.636 -1.358 854 HG11 VAL 110 HG11 VAL 110 -1.117 12.100 -1.974 855 HG12 VAL 110 HG12 VAL 110 -0.359 10.586 -2.468 856 HG13 VAL 110 HG13 VAL 110 0.228 11.441 -1.042 857 HG21 VAL 110 HG21 VAL 110 -1.639 9.292 1.066 858 HG22 VAL 110 HG22 VAL 110 -0.377 10.522 0.978 859 HG23 VAL 110 HG23 VAL 110 -0.218 9.028 0.055 860 H ASP 111 H ASP 111 -2.017 11.185 2.149 861 HA ASP 111 HA ASP 111 -1.062 13.970 2.248 862 HB2 ASP 111 HB3 ASP 111 -3.251 13.533 3.477 863 HB3 ASP 111 HB2 ASP 111 -2.316 12.538 4.590 864 H THR 112 H THR 112 -0.780 10.709 3.615 865 HA THR 112 HA THR 112 1.968 11.380 4.437 866 HB THR 112 HB THR 112 0.169 9.241 5.590 867 HG1 THR 112 HG1 THR 112 -0.233 10.605 7.200 868 HG21 THR 112 HG21 THR 112 2.327 8.474 5.992 869 HG22 THR 112 HG22 THR 112 1.908 9.355 7.460 870 HG23 THR 112 HG23 THR 112 2.961 10.098 6.256 871 H LEU 113 H LEU 113 3.555 9.640 4.264 872 HA LEU 113 HA LEU 113 2.880 7.559 2.322 873 HB2 LEU 113 HB3 LEU 113 4.294 9.886 1.692 874 HB3 LEU 113 HB2 LEU 113 5.516 8.639 1.835 875 HG LEU 113 HG LEU 113 4.362 7.295 0.148 876 HD11 LEU 113 HD11 LEU 113 2.526 9.604 -0.371 877 HD12 LEU 113 HD12 LEU 113 2.080 8.329 0.761 878 HD13 LEU 113 HD13 LEU 113 2.401 7.935 -0.926 879 HD21 LEU 113 HD21 LEU 113 5.339 10.032 -0.328 880 HD22 LEU 113 HD22 LEU 113 4.488 9.266 -1.671 881 HD23 LEU 113 HD23 LEU 113 5.911 8.493 -0.973 882 H LEU 114 H LEU 114 3.831 5.654 2.689 883 HA LEU 114 HA LEU 114 6.117 5.488 4.520 884 HB2 LEU 114 HB3 LEU 114 3.528 3.955 4.758 885 HB3 LEU 114 HB2 LEU 114 5.009 3.460 5.556 886 HG LEU 114 HG LEU 114 4.009 6.228 6.030 887 HD11 LEU 114 HD11 LEU 114 2.996 4.156 7.863 888 HD12 LEU 114 HD12 LEU 114 2.209 4.246 6.287 889 HD13 LEU 114 HD13 LEU 114 2.257 5.666 7.332 890 HD21 LEU 114 HD21 LEU 114 5.210 4.240 7.938 891 HD22 LEU 114 HD22 LEU 114 5.112 5.993 8.101 892 HD23 LEU 114 HD23 LEU 114 6.189 5.278 6.902 893 H VAL 115 H VAL 115 7.679 4.522 3.370 894 HA VAL 115 HA VAL 115 6.890 2.275 1.627 895 HB VAL 115 HB VAL 115 8.547 2.934 -0.010 896 HG11 VAL 115 HG11 VAL 115 6.226 3.872 -0.071 897 HG12 VAL 115 HG12 VAL 115 7.436 4.835 -0.918 898 HG13 VAL 115 HG13 VAL 115 6.867 5.336 0.674 899 HG21 VAL 115 HG21 VAL 115 9.158 5.120 1.957 900 HG22 VAL 115 HG22 VAL 115 9.584 5.249 0.251 901 HG23 VAL 115 HG23 VAL 115 10.261 3.951 1.233 902 H THR 116 H THR 116 8.392 0.644 1.263 903 HA THR 116 HA THR 116 10.631 0.504 3.173 904 HB THR 116 HB THR 116 8.701 -1.672 2.337 905 HG1 THR 116 HG1 THR 116 8.349 -1.768 4.595 906 HG21 THR 116 HG21 THR 116 9.965 -3.140 3.890 907 HG22 THR 116 HG22 THR 116 11.244 -1.926 3.918 908 HG23 THR 116 HG23 THR 116 10.829 -2.735 2.407 909 H ARG 117 H ARG 117 12.287 0.987 1.785 910 HA ARG 117 HA ARG 117 12.375 -0.256 -0.839 911 HB2 ARG 117 HB3 ARG 117 13.682 2.019 0.479 912 HB3 ARG 117 HB2 ARG 117 14.735 1.108 -0.593 913 HG2 ARG 117 HG3 ARG 117 12.839 1.337 -2.312 914 HG3 ARG 117 HG2 ARG 117 12.227 2.603 -1.246 915 HD2 ARG 117 HD3 ARG 117 15.090 2.799 -1.837 916 HD3 ARG 117 HD2 ARG 117 14.046 2.975 -3.247 917 HE ARG 117 HE ARG 117 14.340 4.821 -1.061 918 HH11 ARG 117 HH11 ARG 117 12.250 3.743 -3.640 919 HH12 ARG 117 HH12 ARG 117 11.393 5.244 -3.741 920 HH21 ARG 117 HH21 ARG 117 13.215 6.796 -1.194 921 HH22 ARG 117 HH22 ARG 117 11.941 6.977 -2.353 922 H LEU 118 H LEU 118 12.994 -2.320 -0.852 923 HA LEU 118 HA LEU 118 14.748 -3.505 1.020 924 HB2 LEU 118 HB3 LEU 118 13.385 -4.304 -1.469 925 HB3 LEU 118 HB2 LEU 118 14.868 -5.176 -1.128 926 HG LEU 118 HG LEU 118 13.863 -5.628 1.189 927 HD11 LEU 118 HD11 LEU 118 11.345 -4.879 -0.290 928 HD12 LEU 118 HD12 LEU 118 12.069 -3.959 1.030 929 HD13 LEU 118 HD13 LEU 118 11.443 -5.581 1.325 930 HD21 LEU 118 HD21 LEU 118 12.186 -7.323 -0.079 931 HD22 LEU 118 HD22 LEU 118 13.929 -7.566 0.045 932 HD23 LEU 118 HD23 LEU 118 13.239 -6.851 -1.412 933 H ALA 119 H ALA 119 16.804 -4.622 0.374 934 HA ALA 119 HA ALA 119 18.529 -2.701 -0.977 935 HB1 ALA 119 HB1 ALA 119 20.019 -4.925 -0.063 936 HB2 ALA 119 HB2 ALA 119 18.840 -4.528 1.188 937 HB3 ALA 119 HB3 ALA 119 19.962 -3.296 0.611 938 H GLY 120 H GLY 120 17.605 -6.112 -1.188 939 HA2 GLY 120 HA3 GLY 120 19.271 -6.856 -3.305 940 HA3 GLY 120 HA2 GLY 120 17.741 -7.620 -2.908 941 H SER 121 H SER 121 18.904 -7.122 -5.515 942 HA SER 121 HA SER 121 17.116 -5.105 -6.652 943 HB2 SER 121 HB3 SER 121 18.526 -5.009 -8.499 944 HB3 SER 121 HB2 SER 121 19.661 -5.365 -7.198 945 HG SER 121 HG SER 121 20.122 -7.156 -8.174 946 H PHE 122 H PHE 122 15.176 -5.775 -7.257 947 HA PHE 122 HA PHE 122 14.905 -8.492 -8.368 948 HB2 PHE 122 HB3 PHE 122 12.793 -6.832 -6.976 949 HB3 PHE 122 HB2 PHE 122 12.584 -8.467 -7.594 950 HD1 PHE 122 HD2 PHE 122 14.621 -6.498 -5.185 951 HD2 PHE 122 HD1 PHE 122 12.956 -10.279 -6.208 952 HE1 PHE 122 HE2 PHE 122 15.358 -7.404 -3.019 953 HE2 PHE 122 HE1 PHE 122 13.690 -11.191 -4.044 954 HZ PHE 122 HZ PHE 122 14.893 -9.754 -2.447 955 H GLU 123 H GLU 123 13.321 -8.772 -10.071 956 HA GLU 123 HA GLU 123 12.870 -6.307 -11.622 957 HB2 GLU 123 HB3 GLU 123 13.237 -7.561 -13.665 958 HB3 GLU 123 HB2 GLU 123 14.637 -7.721 -12.613 959 HG2 GLU 123 HG3 GLU 123 13.030 -9.869 -11.929 960 HG3 GLU 123 HG2 GLU 123 12.878 -9.751 -13.681 961 H GLY 124 H GLY 124 10.871 -5.962 -12.409 962 HA2 GLY 124 HA3 GLY 124 8.961 -8.135 -12.636 963 HA3 GLY 124 HA2 GLY 124 8.599 -6.957 -11.384 964 H ASP 125 H ASP 125 6.624 -6.748 -12.756 965 HA ASP 125 HA ASP 125 7.102 -4.821 -14.935 966 HB2 ASP 125 HB3 ASP 125 5.978 -7.225 -15.320 967 HB3 ASP 125 HB2 ASP 125 4.538 -6.323 -14.857 968 H THR 126 H THR 126 6.715 -4.359 -12.030 969 HA THR 126 HA THR 126 4.572 -2.403 -12.295 970 HB THR 126 HB THR 126 4.575 -3.925 -9.743 971 HG1 THR 126 HG1 THR 126 4.421 -5.690 -10.948 972 HG21 THR 126 HG21 THR 126 3.005 -2.183 -9.827 973 HG22 THR 126 HG22 THR 126 2.088 -3.668 -10.081 974 HG23 THR 126 HG23 THR 126 2.480 -2.628 -11.451 975 H LYS 127 H LYS 127 5.750 -0.623 -12.007 976 HA LYS 127 HA LYS 127 7.555 -0.486 -9.679 977 HB2 LYS 127 HB3 LYS 127 7.639 0.800 -12.388 978 HB3 LYS 127 HB2 LYS 127 8.422 1.588 -11.025 979 HG2 LYS 127 HG3 LYS 127 10.134 0.157 -11.034 980 HG3 LYS 127 HG2 LYS 127 9.084 -1.243 -11.262 981 HD2 LYS 127 HD3 LYS 127 8.858 -0.502 -13.678 982 HD3 LYS 127 HD2 LYS 127 10.181 0.620 -13.356 983 HE2 LYS 127 HE3 LYS 127 11.691 -1.140 -12.903 984 HE3 LYS 127 HE2 LYS 127 10.392 -2.327 -12.801 985 HZ1 LYS 127 HZ1 LYS 127 11.726 -1.234 -15.137 986 HZ2 LYS 127 HZ2 LYS 127 10.054 -1.441 -15.283 987 HZ3 LYS 127 HZ3 LYS 127 11.038 -2.761 -14.897 988 H MET 128 H MET 128 7.712 1.755 -8.718 989 HA MET 128 HA MET 128 5.161 2.599 -7.881 990 HB2 MET 128 HB3 MET 128 7.281 2.840 -6.571 991 HB3 MET 128 HB2 MET 128 7.742 4.150 -7.649 992 HG2 MET 128 HG3 MET 128 6.782 4.924 -5.515 993 HG3 MET 128 HG2 MET 128 5.887 5.481 -6.927 994 HE1 MET 128 HE1 MET 128 3.109 5.090 -4.237 995 HE2 MET 128 HE2 MET 128 3.398 5.952 -5.748 996 HE3 MET 128 HE3 MET 128 4.610 5.987 -4.468 997 H ILE 129 H ILE 129 4.182 4.695 -8.121 998 HA ILE 129 HA ILE 129 4.504 5.741 -10.841 999 HB ILE 129 HB ILE 129 2.273 6.749 -10.516 1000 HG12 ILE 129 HG13 ILE 129 1.151 5.440 -8.382 1001 HG13 ILE 129 HG12 ILE 129 2.750 5.835 -7.762 1002 HG21 ILE 129 HG21 ILE 129 1.200 4.295 -10.005 1003 HG22 ILE 129 HG22 ILE 129 2.846 3.880 -10.484 1004 HG23 ILE 129 HG23 ILE 129 1.824 4.823 -11.568 1005 HD11 ILE 129 HD11 ILE 129 0.892 7.502 -7.342 1006 HD12 ILE 129 HD12 ILE 129 1.001 7.889 -9.059 1007 HD13 ILE 129 HD13 ILE 129 2.397 8.128 -8.011 1008 HA PRO 130 HA PRO 130 6.188 9.637 -9.663 1009 HB2 PRO 130 HB3 PRO 130 4.546 11.374 -11.068 1010 HB3 PRO 130 HB2 PRO 130 5.945 10.532 -11.739 1011 HG2 PRO 130 HG3 PRO 130 3.046 9.828 -11.909 1012 HG3 PRO 130 HG2 PRO 130 4.305 9.710 -13.153 1013 HD2 PRO 130 HD3 PRO 130 3.454 7.545 -11.834 1014 HD3 PRO 130 HD2 PRO 130 5.165 7.740 -12.270 1015 H LEU 131 H LEU 131 5.912 11.298 -8.203 1016 HA LEU 131 HA LEU 131 3.234 11.897 -7.212 1017 HB2 LEU 131 HB3 LEU 131 5.296 11.359 -5.134 1018 HB3 LEU 131 HB2 LEU 131 3.551 11.245 -5.030 1019 HG LEU 131 HG LEU 131 4.969 9.257 -6.737 1020 HD11 LEU 131 HD11 LEU 131 5.357 9.578 -3.838 1021 HD12 LEU 131 HD12 LEU 131 6.362 8.767 -5.039 1022 HD13 LEU 131 HD13 LEU 131 4.942 7.952 -4.383 1023 HD21 LEU 131 HD21 LEU 131 2.737 8.843 -4.774 1024 HD22 LEU 131 HD22 LEU 131 3.158 7.878 -6.188 1025 HD23 LEU 131 HD23 LEU 131 2.445 9.478 -6.393 1026 H ASN 132 H ASN 132 3.148 13.817 -5.887 1027 HA ASN 132 HA ASN 132 5.000 15.825 -6.762 1028 HB2 ASN 132 HB3 ASN 132 2.376 15.760 -5.633 1029 HB3 ASN 132 HB2 ASN 132 3.377 16.800 -4.626 1030 HD21 ASN 132 HD21 ASN 132 3.720 18.811 -5.271 1031 HD22 ASN 132 HD22 ASN 132 3.349 19.440 -6.837 1032 H TRP 133 H TRP 133 6.848 14.604 -5.823 1033 HA TRP 133 HA TRP 133 7.305 14.203 -3.133 1034 HB2 TRP 133 HB3 TRP 133 9.276 14.912 -5.308 1035 HB3 TRP 133 HB2 TRP 133 9.727 14.317 -3.713 1036 HD1 TRP 133 HD1 TRP 133 8.239 13.165 -7.029 1037 HE1 TRP 133 HE1 TRP 133 8.190 10.592 -7.070 1038 HE3 TRP 133 HE3 TRP 133 9.570 12.247 -2.178 1039 HZ2 TRP 133 HZ2 TRP 133 8.657 8.456 -5.286 1040 HZ3 TRP 133 HZ3 TRP 133 9.746 9.911 -1.426 1041 HH2 TRP 133 HH2 TRP 133 9.298 8.056 -2.948 1042 H ASP 134 H ASP 134 7.888 17.177 -5.021 1043 HA ASP 134 HA ASP 134 9.248 18.617 -3.076 1044 HB2 ASP 134 HB3 ASP 134 8.797 19.239 -5.516 1045 HB3 ASP 134 HB2 ASP 134 7.244 19.854 -4.957 1046 H ASP 135 H ASP 135 5.758 18.286 -3.597 1047 HA ASP 135 HA ASP 135 5.060 20.070 -1.477 1048 HB2 ASP 135 HB3 ASP 135 3.604 18.285 -3.347 1049 HB3 ASP 135 HB2 ASP 135 2.785 18.694 -1.843 1050 H PHE 136 H PHE 136 6.404 17.055 -1.353 1051 HA PHE 136 HA PHE 136 5.141 16.501 1.250 1052 HB2 PHE 136 HB3 PHE 136 5.899 14.631 -0.969 1053 HB3 PHE 136 HB2 PHE 136 5.892 14.059 0.695 1054 HD1 PHE 136 HD2 PHE 136 3.664 16.150 -1.453 1055 HD2 PHE 136 HD1 PHE 136 4.007 12.912 1.286 1056 HE1 PHE 136 HE2 PHE 136 1.236 15.775 -1.599 1057 HE2 PHE 136 HE1 PHE 136 1.580 12.530 1.145 1058 HZ PHE 136 HZ PHE 136 0.191 13.963 -0.298 1059 H THR 137 H THR 137 6.452 16.261 2.947 1060 HA THR 137 HA THR 137 9.355 16.252 2.436 1061 HB THR 137 HB THR 137 7.762 17.506 4.676 1062 HG1 THR 137 HG1 THR 137 9.363 18.511 2.578 1063 HG21 THR 137 HG21 THR 137 10.162 18.452 5.191 1064 HG22 THR 137 HG22 THR 137 10.659 16.897 4.522 1065 HG23 THR 137 HG23 THR 137 9.581 16.952 5.917 1066 H LYS 138 H LYS 138 10.672 14.901 3.611 1067 HA LYS 138 HA LYS 138 9.517 12.483 4.546 1068 HB2 LYS 138 HB3 LYS 138 11.731 12.559 3.490 1069 HB3 LYS 138 HB2 LYS 138 12.345 13.513 4.833 1070 HG2 LYS 138 HG3 LYS 138 12.460 11.729 6.235 1071 HG3 LYS 138 HG2 LYS 138 11.103 10.899 5.469 1072 HD2 LYS 138 HD3 LYS 138 12.993 9.622 4.906 1073 HD3 LYS 138 HD2 LYS 138 12.645 10.579 3.465 1074 HE2 LYS 138 HE3 LYS 138 14.524 11.833 3.676 1075 HE3 LYS 138 HE2 LYS 138 14.493 11.778 5.437 1076 HZ1 LYS 138 HZ1 LYS 138 15.021 9.242 4.148 1077 HZ2 LYS 138 HZ2 LYS 138 15.776 9.957 5.482 1078 HZ3 LYS 138 HZ3 LYS 138 16.220 10.414 3.915 1079 H VAL 139 H VAL 139 8.821 11.949 6.503 1080 HA VAL 139 HA VAL 139 9.216 13.839 8.695 1081 HB VAL 139 HB VAL 139 7.479 11.414 8.930 1082 HG11 VAL 139 HG11 VAL 139 6.913 14.186 9.913 1083 HG12 VAL 139 HG12 VAL 139 8.013 13.119 10.785 1084 HG13 VAL 139 HG13 VAL 139 6.333 12.643 10.538 1085 HG21 VAL 139 HG21 VAL 139 5.598 12.646 7.957 1086 HG22 VAL 139 HG22 VAL 139 6.874 12.369 6.771 1087 HG23 VAL 139 HG23 VAL 139 6.690 13.959 7.512 1088 H SER 140 H SER 140 9.928 10.530 7.768 1089 HA SER 140 HA SER 140 11.881 10.368 9.904 1090 HB2 SER 140 HB3 SER 140 10.066 8.016 9.814 1091 HB3 SER 140 HB2 SER 140 10.948 8.709 11.175 1092 HG SER 140 HG SER 140 8.679 9.040 11.331 1093 H SER 141 H SER 141 13.309 8.530 9.706 1094 HA SER 141 HA SER 141 13.150 6.902 7.325 1095 HB2 SER 141 HB3 SER 141 15.374 7.647 6.472 1096 HB3 SER 141 HB2 SER 141 14.136 8.899 6.367 1097 HG SER 141 HG SER 141 15.020 9.614 8.475 1098 H ARG 142 H ARG 142 13.869 4.948 7.839 1099 HA ARG 142 HA ARG 142 16.058 4.689 9.778 1100 HB2 ARG 142 HB3 ARG 142 13.827 4.322 10.882 1101 HB3 ARG 142 HB2 ARG 142 13.592 2.944 9.815 1102 HG2 ARG 142 HG3 ARG 142 14.365 2.115 11.899 1103 HG3 ARG 142 HG2 ARG 142 15.693 1.965 10.747 1104 HD2 ARG 142 HD3 ARG 142 15.957 4.507 11.906 1105 HD3 ARG 142 HD2 ARG 142 15.585 3.407 13.232 1106 HE ARG 142 HE ARG 142 17.628 2.425 11.470 1107 HH11 ARG 142 HH11 ARG 142 16.983 4.432 14.251 1108 HH12 ARG 142 HH12 ARG 142 18.589 4.289 14.883 1109 HH21 ARG 142 HH21 ARG 142 19.741 2.236 12.299 1110 HH22 ARG 142 HH22 ARG 142 20.155 3.043 13.775 1111 H THR 143 H THR 143 17.407 2.915 9.477 1112 HA THR 143 HA THR 143 16.962 1.425 6.973 1113 HB THR 143 HB THR 143 19.642 2.098 8.191 1114 HG1 THR 143 HG1 THR 143 18.465 3.971 7.472 1115 HG21 THR 143 HG21 THR 143 20.645 1.285 6.311 1116 HG22 THR 143 HG22 THR 143 19.207 1.504 5.313 1117 HG23 THR 143 HG23 THR 143 19.288 0.169 6.463 1118 H VAL 144 H VAL 144 16.229 -0.520 7.574 1119 HA VAL 144 HA VAL 144 17.440 -1.875 9.871 1120 HB VAL 144 HB VAL 144 15.085 -2.791 8.216 1121 HG11 VAL 144 HG11 VAL 144 16.139 -3.615 10.918 1122 HG12 VAL 144 HG12 VAL 144 16.088 -4.589 9.448 1123 HG13 VAL 144 HG13 VAL 144 14.588 -4.129 10.254 1124 HG21 VAL 144 HG21 VAL 144 13.616 -1.757 9.719 1125 HG22 VAL 144 HG22 VAL 144 14.839 -0.530 9.389 1126 HG23 VAL 144 HG23 VAL 144 14.894 -1.448 10.894 1127 H GLU 145 H GLU 145 18.888 -3.461 9.626 1128 HA GLU 145 HA GLU 145 19.130 -4.717 6.971 1129 HB2 GLU 145 HB3 GLU 145 21.612 -4.966 7.642 1130 HB3 GLU 145 HB2 GLU 145 21.047 -3.400 7.080 1131 HG2 GLU 145 HG3 GLU 145 21.225 -2.435 9.143 1132 HG3 GLU 145 HG2 GLU 145 21.009 -3.963 9.997 1133 H ASP 146 H ASP 146 19.595 -6.887 6.879 1134 HA ASP 146 HA ASP 146 19.401 -8.348 9.431 1135 HB2 ASP 146 HB3 ASP 146 17.952 -8.630 6.897 1136 HB3 ASP 146 HB2 ASP 146 18.615 -10.148 7.495 1137 H THR 147 H THR 147 20.041 -10.861 8.656 1138 HA THR 147 HA THR 147 22.834 -10.829 8.558 1139 HB THR 147 HB THR 147 22.366 -13.325 7.749 1140 HG1 THR 147 HG1 THR 147 19.922 -12.763 9.022 1141 HG21 THR 147 HG21 THR 147 22.952 -13.736 9.833 1142 HG22 THR 147 HG22 THR 147 21.325 -13.326 10.376 1143 HG23 THR 147 HG23 THR 147 22.565 -12.075 10.280 1144 H ASN 148 H ASN 148 20.433 -11.319 6.013 1145 HA ASN 148 HA ASN 148 22.502 -11.580 3.989 1146 HB2 ASN 148 HB3 ASN 148 19.584 -12.035 4.126 1147 HB3 ASN 148 HB2 ASN 148 20.186 -11.456 2.576 1148 HD21 ASN 148 HD21 ASN 148 19.289 -14.134 3.995 1149 HD22 ASN 148 HD22 ASN 148 20.391 -15.276 3.313 1150 HA PRO 149 HA PRO 149 22.678 -7.251 3.061 1151 HB2 PRO 149 HB3 PRO 149 23.434 -7.427 0.427 1152 HB3 PRO 149 HB2 PRO 149 24.542 -7.610 1.791 1153 HG2 PRO 149 HG3 PRO 149 23.207 -9.716 0.138 1154 HG3 PRO 149 HG2 PRO 149 24.874 -9.654 0.741 1155 HD2 PRO 149 HD3 PRO 149 22.997 -11.166 1.929 1156 HD3 PRO 149 HD2 PRO 149 24.264 -10.346 2.865 1157 H ALA 150 H ALA 150 20.792 -9.477 1.134 1158 HA ALA 150 HA ALA 150 19.383 -7.398 -0.284 1159 HB1 ALA 150 HB1 ALA 150 19.485 -9.272 -1.592 1160 HB2 ALA 150 HB2 ALA 150 17.894 -9.484 -0.860 1161 HB3 ALA 150 HB3 ALA 150 19.281 -10.371 -0.227 1162 H LEU 151 H LEU 151 19.080 -8.926 2.764 1163 HA LEU 151 HA LEU 151 16.227 -8.469 2.974 1164 HB2 LEU 151 HB3 LEU 151 18.300 -9.556 4.859 1165 HB3 LEU 151 HB2 LEU 151 16.671 -9.194 5.396 1166 HG LEU 151 HG LEU 151 17.563 -11.300 3.444 1167 HD11 LEU 151 HD11 LEU 151 16.960 -12.786 5.022 1168 HD12 LEU 151 HD12 LEU 151 15.580 -11.824 5.553 1169 HD13 LEU 151 HD13 LEU 151 17.204 -11.421 6.112 1170 HD21 LEU 151 HD21 LEU 151 15.124 -11.767 3.112 1171 HD22 LEU 151 HD22 LEU 151 15.706 -10.290 2.343 1172 HD23 LEU 151 HD23 LEU 151 14.788 -10.199 3.846 1173 H THR 152 H THR 152 18.603 -6.347 2.890 1174 HA THR 152 HA THR 152 18.058 -4.849 5.298 1175 HB THR 152 HB THR 152 19.495 -3.746 2.901 1176 HG1 THR 152 HG1 THR 152 20.551 -5.559 4.807 1177 HG21 THR 152 HG21 THR 152 19.691 -2.094 4.405 1178 HG22 THR 152 HG22 THR 152 20.992 -3.105 5.034 1179 HG23 THR 152 HG23 THR 152 19.394 -3.159 5.779 1180 H HIS 153 H HIS 153 16.373 -3.546 5.542 1181 HA HIS 153 HA HIS 153 15.153 -2.363 3.133 1182 HB2 HIS 153 HB3 HIS 153 13.508 -2.812 5.581 1183 HB3 HIS 153 HB2 HIS 153 13.023 -2.811 3.889 1184 HD1 HIS 153 HD1 HIS 153 12.758 -5.060 6.354 1185 HD2 HIS 153 HD2 HIS 153 14.901 -5.245 2.799 1186 HE1 HIS 153 HE1 HIS 153 13.089 -7.510 5.894 1187 HE2 HIS 153 HE2 HIS 153 14.459 -7.596 3.782 1188 H THR 154 H THR 154 14.121 -0.301 3.410 1189 HA THR 154 HA THR 154 15.101 1.214 5.737 1190 HB THR 154 HB THR 154 14.943 2.300 2.923 1191 HG1 THR 154 HG1 THR 154 16.782 1.387 2.592 1192 HG21 THR 154 HG21 THR 154 14.851 3.978 4.728 1193 HG22 THR 154 HG22 THR 154 16.295 4.108 3.724 1194 HG23 THR 154 HG23 THR 154 16.397 3.375 5.325 1195 H TYR 155 H TYR 155 13.416 1.875 6.882 1196 HA TYR 155 HA TYR 155 10.840 2.311 5.585 1197 HB2 TYR 155 HB3 TYR 155 11.760 1.888 8.392 1198 HB3 TYR 155 HB2 TYR 155 10.267 2.785 8.141 1199 HD1 TYR 155 HD1 TYR 155 8.456 1.661 6.695 1200 HD2 TYR 155 HD2 TYR 155 11.744 -0.444 8.385 1201 HE1 TYR 155 HE1 TYR 155 7.224 -0.453 6.446 1202 HE2 TYR 155 HE2 TYR 155 10.522 -2.564 8.139 1203 HH TYR 155 HH TYR 155 7.371 -2.836 7.749 1204 H GLU 156 H GLU 156 10.141 4.277 5.035 1205 HA GLU 156 HA GLU 156 11.270 6.603 6.437 1206 HB2 GLU 156 HB3 GLU 156 10.753 6.513 3.466 1207 HB3 GLU 156 HB2 GLU 156 11.513 7.812 4.376 1208 HG2 GLU 156 HG3 GLU 156 13.102 5.666 4.974 1209 HG3 GLU 156 HG2 GLU 156 12.652 5.357 3.298 1210 H VAL 157 H VAL 157 9.948 8.361 6.706 1211 HA VAL 157 HA VAL 157 7.104 7.924 6.094 1212 HB VAL 157 HB VAL 157 8.201 9.688 8.284 1213 HG11 VAL 157 HG11 VAL 157 5.740 9.179 9.076 1214 HG12 VAL 157 HG12 VAL 157 5.478 8.905 7.353 1215 HG13 VAL 157 HG13 VAL 157 6.074 10.466 7.917 1216 HG21 VAL 157 HG21 VAL 157 7.853 7.977 9.849 1217 HG22 VAL 157 HG22 VAL 157 8.684 7.187 8.509 1218 HG23 VAL 157 HG23 VAL 157 6.942 6.994 8.703 1219 H TRP 158 H TRP 158 5.874 9.654 5.419 1220 HA TRP 158 HA TRP 158 7.211 12.152 4.730 1221 HB2 TRP 158 HB3 TRP 158 5.919 10.424 2.622 1222 HB3 TRP 158 HB2 TRP 158 6.477 12.072 2.370 1223 HD1 TRP 158 HD1 TRP 158 7.889 8.574 3.214 1224 HE1 TRP 158 HE1 TRP 158 10.323 8.474 2.383 1225 HE3 TRP 158 HE3 TRP 158 8.421 13.419 1.671 1226 HZ2 TRP 158 HZ2 TRP 158 12.218 10.218 1.227 1227 HZ3 TRP 158 HZ3 TRP 158 10.576 14.122 0.714 1228 HH2 TRP 158 HH2 TRP 158 12.435 12.553 0.498 1229 H GLN 159 H GLN 159 5.923 13.899 4.673 1230 HA GLN 159 HA GLN 159 3.022 13.564 4.606 1231 HB2 GLN 159 HB3 GLN 159 4.423 13.935 7.019 1232 HB3 GLN 159 HB2 GLN 159 3.714 15.498 6.639 1233 HG2 GLN 159 HG3 GLN 159 1.876 14.729 7.615 1234 HG3 GLN 159 HG2 GLN 159 1.645 13.765 6.157 1235 HE21 GLN 159 HE21 GLN 159 0.575 12.940 8.517 1236 HE22 GLN 159 HE22 GLN 159 1.409 11.539 9.089 1237 H LYS 160 H LYS 160 1.938 15.336 3.742 1238 HA LYS 160 HA LYS 160 3.337 17.009 2.020 1239 HB2 LYS 160 HB3 LYS 160 0.727 16.391 2.367 1240 HB3 LYS 160 HB2 LYS 160 0.746 18.020 3.029 1241 HG2 LYS 160 HG3 LYS 160 1.982 17.481 0.365 1242 HG3 LYS 160 HG2 LYS 160 0.232 17.650 0.516 1243 HD2 LYS 160 HD3 LYS 160 2.267 19.679 1.438 1244 HD3 LYS 160 HD2 LYS 160 1.336 19.777 -0.059 1245 HE2 LYS 160 HE3 LYS 160 -0.642 19.407 1.756 1246 HE3 LYS 160 HE2 LYS 160 0.526 20.312 2.718 1247 HZ1 LYS 160 HZ1 LYS 160 -1.137 21.681 1.473 1248 HZ2 LYS 160 HZ2 LYS 160 -0.386 21.192 0.039 1249 HZ3 LYS 160 HZ3 LYS 160 0.479 22.089 1.182 1250 H LYS 161 H LYS 161 4.115 19.053 2.124 1251 HA LYS 161 HA LYS 161 4.978 20.072 4.586 1252 HB2 LYS 161 HB3 LYS 161 4.790 21.278 1.834 1253 HB3 LYS 161 HB2 LYS 161 5.418 22.190 3.200 1254 HG2 LYS 161 HG3 LYS 161 7.134 20.448 3.532 1255 HG3 LYS 161 HG2 LYS 161 6.533 19.622 2.093 1256 HD2 LYS 161 HD3 LYS 161 8.211 20.841 1.144 1257 HD3 LYS 161 HD2 LYS 161 6.902 22.018 1.020 1258 HE2 LYS 161 HE3 LYS 161 7.719 22.802 3.350 1259 HE3 LYS 161 HE2 LYS 161 9.198 21.936 2.940 1260 HZ1 LYS 161 HZ1 LYS 161 8.857 23.354 0.730 1261 HZ2 LYS 161 HZ2 LYS 161 9.735 23.923 2.058 1262 HZ3 LYS 161 HZ3 LYS 161 8.128 24.405 1.838 1263 H ALA 162 H ALA 162 4.101 21.411 6.040 1264 HA ALA 162 HA ALA 162 2.560 22.676 7.138 1265 HB1 ALA 162 HB1 ALA 162 2.214 23.726 4.341 1266 HB2 ALA 162 HB2 ALA 162 3.132 24.437 5.669 1267 HB3 ALA 162 HB3 ALA 162 1.370 24.408 5.731 1268 H51A NDP 170 H51A NDP 170 -5.119 -1.170 -9.530 1269 H52A NDP 170 H52A NDP 170 -5.752 -2.573 -8.667 1270 H4B NDP 170 H4B NDP 170 -7.133 -3.044 -10.795 1271 H3B NDP 170 H3B NDP 170 -6.148 -0.273 -11.495 1272 HO3A NDP 170 HO3A NDP 170 -5.345 -2.100 -12.658 1273 H2B NDP 170 H2B NDP 170 -8.324 0.182 -12.376 1274 H1B NDP 170 H1B NDP 170 -9.736 -0.927 -10.274 1275 H8A NDP 170 H8A NDP 170 -6.490 0.810 -9.281 1276 H61A NDP 170 H61A NDP 170 -8.448 5.138 -8.190 1277 H62A NDP 170 H62A NDP 170 -10.077 5.770 -8.270 1278 H2A NDP 170 H2A NDP 170 -12.614 2.582 -10.153 1279 H51N NDP 170 H51N NDP 170 -1.286 -4.365 -8.070 1280 H52N NDP 170 H52N NDP 170 -0.530 -3.373 -9.328 1281 H4D NDP 170 H4D NDP 170 1.048 -5.267 -9.811 1282 H3D NDP 170 H3D NDP 170 -0.373 -6.614 -7.503 1283 HO3N NDP 170 HO3N NDP 170 -0.379 -7.076 -10.022 1284 H2D NDP 170 H2D NDP 170 1.754 -7.553 -6.897 1285 HO2N NDP 170 HO2N NDP 170 3.315 -7.876 -8.274 1286 H1D NDP 170 H1D NDP 170 3.180 -5.208 -7.199 1287 H2N NDP 170 H2N NDP 170 3.589 -5.140 -4.825 1288 H71N NDP 170 H71N NDP 170 5.250 -4.648 -2.106 1289 H72N NDP 170 H72N NDP 170 4.897 -5.260 -3.701 1290 H41N NDP 170 H41N NDP 170 0.435 -3.842 -2.761 1291 H42N NDP 170 H42N NDP 170 0.399 -5.618 -2.490 1292 H5N NDP 170 H5N NDP 170 -1.327 -4.916 -4.145 1293 H6N NDP 170 H6N NDP 170 -0.458 -5.300 -6.459 Start of MODEL 9 1 H1 THR 1 HT1 THR 1 -4.321 7.988 5.727 2 H2 THR 1 HT2 THR 1 -5.828 8.580 5.157 3 H3 THR 1 HT3 THR 1 -4.543 9.670 5.482 4 HA THR 1 HA THR 1 -4.830 7.734 3.304 5 HB THR 1 HB THR 1 -4.130 9.863 2.058 6 HG1 THR 1 HG1 THR 1 -4.521 11.787 3.225 7 HG21 THR 1 HG21 THR 1 -6.313 10.801 2.005 8 HG22 THR 1 HG22 THR 1 -6.715 10.096 3.571 9 HG23 THR 1 HG23 THR 1 -6.479 9.053 2.168 10 H ALA 2 H ALA 2 -3.080 6.413 4.198 11 HA ALA 2 HA ALA 2 -0.435 7.598 3.655 12 HB1 ALA 2 HB1 ALA 2 -0.537 5.269 5.457 13 HB2 ALA 2 HB2 ALA 2 -1.222 6.764 6.094 14 HB3 ALA 2 HB3 ALA 2 0.451 6.728 5.537 15 H PHE 3 H PHE 3 1.055 6.350 2.536 16 HA PHE 3 HA PHE 3 -0.091 4.040 1.123 17 HB2 PHE 3 HB3 PHE 3 2.099 5.986 0.433 18 HB3 PHE 3 HB2 PHE 3 1.943 4.450 -0.406 19 HD1 PHE 3 HD1 PHE 3 -0.818 6.646 0.750 20 HD2 PHE 3 HD2 PHE 3 1.405 5.146 -2.553 21 HE1 PHE 3 HE1 PHE 3 -2.443 7.654 -0.797 22 HE2 PHE 3 HE2 PHE 3 -0.213 6.151 -4.104 23 HZ PHE 3 HZ PHE 3 -2.139 7.408 -3.229 24 H LEU 4 H LEU 4 0.569 2.071 1.744 25 HA LEU 4 HA LEU 4 3.285 1.820 2.858 26 HB2 LEU 4 HB3 LEU 4 1.566 1.599 4.603 27 HB3 LEU 4 HB2 LEU 4 0.821 0.295 3.698 28 HG LEU 4 HG LEU 4 2.747 -1.121 4.042 29 HD11 LEU 4 HD11 LEU 4 4.457 -0.081 5.786 30 HD12 LEU 4 HD12 LEU 4 3.974 1.410 4.977 31 HD13 LEU 4 HD13 LEU 4 4.672 0.086 4.043 32 HD21 LEU 4 HD21 LEU 4 0.954 -0.442 5.943 33 HD22 LEU 4 HD22 LEU 4 2.465 -0.086 6.780 34 HD23 LEU 4 HD23 LEU 4 2.172 -1.702 6.138 35 H TRP 5 H TRP 5 4.522 0.728 1.479 36 HA TRP 5 HA TRP 5 3.690 -1.856 0.551 37 HB2 TRP 5 HB3 TRP 5 3.525 -1.517 -1.733 38 HB3 TRP 5 HB2 TRP 5 2.747 -0.074 -1.096 39 HD1 TRP 5 HD1 TRP 5 5.870 -1.216 -2.972 40 HE1 TRP 5 HE1 TRP 5 7.030 0.850 -3.978 41 HE3 TRP 5 HE3 TRP 5 3.086 2.431 -0.740 42 HZ2 TRP 5 HZ2 TRP 5 6.791 3.661 -3.843 43 HZ3 TRP 5 HZ3 TRP 5 3.613 4.790 -1.233 44 HH2 TRP 5 HH2 TRP 5 5.427 5.387 -2.752 45 H ALA 6 H ALA 6 5.403 -3.043 -0.536 46 HA ALA 6 HA ALA 6 8.041 -2.105 0.352 47 HB1 ALA 6 HB1 ALA 6 8.712 -4.326 0.510 48 HB2 ALA 6 HB2 ALA 6 7.470 -4.884 -0.609 49 HB3 ALA 6 HB3 ALA 6 7.026 -4.382 1.022 50 H GLN 7 H GLN 7 9.809 -2.008 -1.033 51 HA GLN 7 HA GLN 7 9.426 -2.698 -3.835 52 HB2 GLN 7 HB3 GLN 7 10.266 -0.417 -4.528 53 HB3 GLN 7 HB2 GLN 7 8.626 -0.465 -3.897 54 HG2 GLN 7 HG3 GLN 7 10.415 -0.009 -1.733 55 HG3 GLN 7 HG2 GLN 7 10.799 1.117 -3.035 56 HE21 GLN 7 HE21 GLN 7 8.233 -0.053 -0.943 57 HE22 GLN 7 HE22 GLN 7 7.257 1.369 -1.031 58 H ASP 8 H ASP 8 11.420 -2.544 -5.109 59 HA ASP 8 HA ASP 8 13.712 -3.275 -3.461 60 HB2 ASP 8 HB3 ASP 8 14.678 -4.187 -5.492 61 HB3 ASP 8 HB2 ASP 8 13.026 -4.763 -5.319 62 H ARG 9 H ARG 9 15.828 -2.678 -5.077 63 HA ARG 9 HA ARG 9 16.391 -0.033 -4.389 64 HB2 ARG 9 HB3 ARG 9 17.718 -1.967 -6.266 65 HB3 ARG 9 HB2 ARG 9 18.347 -0.344 -6.023 66 HG2 ARG 9 HG3 ARG 9 17.949 -2.396 -3.857 67 HG3 ARG 9 HG2 ARG 9 19.486 -2.004 -4.631 68 HD2 ARG 9 HD3 ARG 9 17.767 -0.149 -2.990 69 HD3 ARG 9 HD2 ARG 9 19.310 -0.852 -2.509 70 HE ARG 9 HE ARG 9 20.009 0.463 -4.716 71 HH11 ARG 9 HH11 ARG 9 18.061 1.474 -1.999 72 HH12 ARG 9 HH12 ARG 9 18.502 3.141 -2.147 73 HH21 ARG 9 HH21 ARG 9 20.588 2.656 -4.906 74 HH22 ARG 9 HH22 ARG 9 19.935 3.812 -3.794 75 H ASP 10 H ASP 10 14.952 -1.316 -7.307 76 HA ASP 10 HA ASP 10 15.356 1.183 -8.739 77 HB2 ASP 10 HB3 ASP 10 14.530 -1.549 -9.429 78 HB3 ASP 10 HB2 ASP 10 13.628 -0.299 -10.280 79 H GLY 11 H GLY 11 12.829 -0.573 -7.105 80 HA2 GLY 11 HA3 GLY 11 11.193 1.054 -6.025 81 HA3 GLY 11 HA2 GLY 11 10.947 1.632 -7.666 82 H LEU 12 H LEU 12 11.485 -1.660 -7.762 83 HA LEU 12 HA LEU 12 9.050 -2.402 -8.780 84 HB2 LEU 12 HB3 LEU 12 11.330 -3.693 -8.452 85 HB3 LEU 12 HB2 LEU 12 10.526 -4.325 -7.030 86 HG LEU 12 HG LEU 12 8.808 -5.358 -8.373 87 HD11 LEU 12 HD11 LEU 12 9.653 -5.060 -11.016 88 HD12 LEU 12 HD12 LEU 12 9.675 -3.432 -10.339 89 HD13 LEU 12 HD13 LEU 12 8.197 -4.393 -10.279 90 HD21 LEU 12 HD21 LEU 12 11.373 -6.175 -8.269 91 HD22 LEU 12 HD22 LEU 12 11.141 -6.087 -10.015 92 HD23 LEU 12 HD23 LEU 12 10.077 -7.095 -9.034 93 H ILE 13 H ILE 13 7.623 -4.173 -7.649 94 HA ILE 13 HA ILE 13 7.167 -3.726 -4.847 95 HB ILE 13 HB ILE 13 4.857 -3.036 -5.001 96 HG12 ILE 13 HG13 ILE 13 4.968 -2.295 -7.862 97 HG13 ILE 13 HG12 ILE 13 4.831 -4.018 -7.538 98 HG21 ILE 13 HG21 ILE 13 6.484 -1.152 -6.690 99 HG22 ILE 13 HG22 ILE 13 6.722 -1.357 -4.954 100 HG23 ILE 13 HG23 ILE 13 5.181 -0.757 -5.569 101 HD11 ILE 13 HD11 ILE 13 2.969 -1.871 -6.561 102 HD12 ILE 13 HD12 ILE 13 2.842 -3.586 -6.172 103 HD13 ILE 13 HD13 ILE 13 2.650 -3.042 -7.838 104 H GLY 14 H GLY 14 6.265 -5.231 -7.877 105 HA2 GLY 14 HA3 GLY 14 5.852 -7.741 -6.478 106 HA3 GLY 14 HA2 GLY 14 4.457 -7.104 -7.334 107 H LYS 15 H LYS 15 5.071 -9.421 -8.187 108 HA LYS 15 HA LYS 15 6.416 -8.981 -10.752 109 HB2 LYS 15 HB3 LYS 15 7.452 -11.207 -10.623 110 HB3 LYS 15 HB2 LYS 15 8.020 -10.159 -9.330 111 HG2 LYS 15 HG3 LYS 15 7.106 -11.429 -7.715 112 HG3 LYS 15 HG2 LYS 15 5.685 -11.829 -8.682 113 HD2 LYS 15 HD3 LYS 15 7.592 -13.142 -10.065 114 HD3 LYS 15 HD2 LYS 15 8.271 -13.227 -8.438 115 HE2 LYS 15 HE3 LYS 15 5.406 -13.938 -8.966 116 HE3 LYS 15 HE2 LYS 15 6.697 -15.113 -9.220 117 HZ1 LYS 15 HZ1 LYS 15 5.942 -15.457 -7.045 118 HZ2 LYS 15 HZ2 LYS 15 5.892 -13.804 -6.690 119 HZ3 LYS 15 HZ3 LYS 15 7.382 -14.588 -6.860 120 H ASP 16 H ASP 16 3.819 -8.718 -10.668 121 HA ASP 16 HA ASP 16 1.970 -9.415 -11.829 122 HB2 ASP 16 HB3 ASP 16 3.853 -11.077 -12.897 123 HB3 ASP 16 HB2 ASP 16 2.761 -12.240 -12.151 124 H GLY 17 H GLY 17 1.753 -9.214 -9.249 125 HA2 GLY 17 HA3 GLY 17 -0.385 -10.554 -8.376 126 HA3 GLY 17 HA2 GLY 17 0.894 -11.709 -8.030 127 H HIS 18 H HIS 18 2.890 -10.478 -6.955 128 HA HIS 18 HA HIS 18 2.374 -8.287 -5.257 129 HB2 HIS 18 HB3 HIS 18 2.188 -9.407 -3.101 130 HB3 HIS 18 HB2 HIS 18 0.869 -9.910 -4.152 131 HD1 HIS 18 HD1 HIS 18 3.242 -11.270 -1.882 132 HD2 HIS 18 HD2 HIS 18 1.614 -12.521 -5.495 133 HE1 HIS 18 HE1 HIS 18 3.630 -13.753 -1.970 134 HE2 HIS 18 HE2 HIS 18 2.715 -14.474 -4.204 135 H LEU 19 H LEU 19 4.027 -8.723 -3.148 136 HA LEU 19 HA LEU 19 6.586 -8.565 -4.333 137 HB2 LEU 19 HB3 LEU 19 7.420 -8.546 -1.992 138 HB3 LEU 19 HB2 LEU 19 6.175 -7.357 -2.322 139 HG LEU 19 HG LEU 19 4.608 -9.293 -1.368 140 HD11 LEU 19 HD11 LEU 19 7.302 -10.134 -0.700 141 HD12 LEU 19 HD12 LEU 19 5.775 -11.005 -0.557 142 HD13 LEU 19 HD13 LEU 19 6.294 -9.919 0.732 143 HD21 LEU 19 HD21 LEU 19 4.482 -8.067 0.615 144 HD22 LEU 19 HD22 LEU 19 5.055 -6.897 -0.574 145 HD23 LEU 19 HD23 LEU 19 6.189 -7.628 0.562 146 HA PRO 20 HA PRO 20 7.334 -12.988 -4.349 147 HB2 PRO 20 HB3 PRO 20 9.592 -12.973 -5.779 148 HB3 PRO 20 HB2 PRO 20 8.030 -12.603 -6.518 149 HG2 PRO 20 HG3 PRO 20 10.207 -10.749 -5.654 150 HG3 PRO 20 HG2 PRO 20 9.178 -10.674 -7.095 151 HD2 PRO 20 HD3 PRO 20 8.779 -9.206 -4.779 152 HD3 PRO 20 HD2 PRO 20 7.529 -9.555 -5.988 153 H TRP 21 H TRP 21 9.548 -10.569 -3.136 154 HA TRP 21 HA TRP 21 11.472 -12.400 -2.102 155 HB2 TRP 21 HB3 TRP 21 12.170 -10.359 -0.718 156 HB3 TRP 21 HB2 TRP 21 12.282 -10.224 -2.469 157 HD1 TRP 21 HD1 TRP 21 9.546 -9.409 0.176 158 HE1 TRP 21 HE1 TRP 21 8.522 -7.128 -0.434 159 HE3 TRP 21 HE3 TRP 21 12.249 -8.413 -4.044 160 HZ2 TRP 21 HZ2 TRP 21 8.820 -5.166 -2.444 161 HZ3 TRP 21 HZ3 TRP 21 11.817 -6.316 -5.255 162 HH2 TRP 21 HH2 TRP 21 10.138 -4.726 -4.470 163 H HIS 22 H HIS 22 11.753 -13.181 -0.042 164 HA HIS 22 HA HIS 22 9.339 -13.399 1.541 165 HB2 HIS 22 HB3 HIS 22 11.943 -14.804 1.399 166 HB3 HIS 22 HB2 HIS 22 11.178 -14.756 2.983 167 HD1 HIS 22 HD1 HIS 22 9.133 -16.219 3.345 168 HD2 HIS 22 HD2 HIS 22 10.491 -16.240 -0.581 169 HE1 HIS 22 HE1 HIS 22 7.873 -18.075 2.209 170 HE2 HIS 22 HE2 HIS 22 8.775 -18.125 -0.143 171 H LEU 23 H LEU 23 9.136 -11.249 2.298 172 HA LEU 23 HA LEU 23 11.200 -10.355 4.184 173 HB2 LEU 23 HB3 LEU 23 9.282 -9.005 2.419 174 HB3 LEU 23 HB2 LEU 23 9.394 -8.304 4.022 175 HG LEU 23 HG LEU 23 11.837 -8.055 3.719 176 HD11 LEU 23 HD11 LEU 23 11.544 -9.896 1.711 177 HD12 LEU 23 HD12 LEU 23 12.971 -8.898 1.993 178 HD13 LEU 23 HD13 LEU 23 11.753 -8.386 0.825 179 HD21 LEU 23 HD21 LEU 23 9.864 -6.445 2.830 180 HD22 LEU 23 HD22 LEU 23 10.763 -6.702 1.335 181 HD23 LEU 23 HD23 LEU 23 11.578 -6.037 2.751 182 HA PRO 24 HA PRO 24 8.012 -12.045 7.047 183 HB2 PRO 24 HB3 PRO 24 9.798 -12.418 9.090 184 HB3 PRO 24 HB2 PRO 24 9.477 -13.617 7.833 185 HG2 PRO 24 HG3 PRO 24 11.721 -11.651 8.050 186 HG3 PRO 24 HG2 PRO 24 11.763 -13.350 7.542 187 HD2 PRO 24 HD3 PRO 24 11.831 -11.325 5.767 188 HD3 PRO 24 HD2 PRO 24 11.018 -12.863 5.409 189 H ASP 25 H ASP 25 10.544 -9.643 7.608 190 HA ASP 25 HA ASP 25 9.333 -8.488 9.900 191 HB2 ASP 25 HB3 ASP 25 10.944 -6.606 9.383 192 HB3 ASP 25 HB2 ASP 25 11.673 -8.182 9.637 193 H ASP 26 H ASP 26 9.037 -8.002 6.457 194 HA ASP 26 HA ASP 26 7.705 -5.470 6.652 195 HB2 ASP 26 HB3 ASP 26 9.009 -6.369 4.640 196 HB3 ASP 26 HB2 ASP 26 7.584 -7.344 4.294 197 H LEU 27 H LEU 27 6.646 -8.798 5.971 198 HA LEU 27 HA LEU 27 3.918 -8.262 5.691 199 HB2 LEU 27 HB3 LEU 27 5.030 -10.783 6.900 200 HB3 LEU 27 HB2 LEU 27 3.554 -10.594 5.973 201 HG LEU 27 HG LEU 27 6.022 -9.867 4.533 202 HD11 LEU 27 HD11 LEU 27 6.291 -12.074 6.063 203 HD12 LEU 27 HD12 LEU 27 7.070 -11.855 4.496 204 HD13 LEU 27 HD13 LEU 27 5.567 -12.770 4.613 205 HD21 LEU 27 HD21 LEU 27 3.387 -11.111 4.014 206 HD22 LEU 27 HD22 LEU 27 4.721 -11.574 2.958 207 HD23 LEU 27 HD23 LEU 27 4.262 -9.878 3.106 208 H HIS 28 H HIS 28 5.646 -9.478 8.564 209 HA HIS 28 HA HIS 28 3.499 -9.392 10.335 210 HB2 HIS 28 HB3 HIS 28 6.474 -9.178 10.739 211 HB3 HIS 28 HB2 HIS 28 5.359 -9.104 12.100 212 HD1 HIS 28 HD1 HIS 28 5.011 -11.423 9.134 213 HD2 HIS 28 HD2 HIS 28 5.887 -11.563 13.194 214 HE1 HIS 28 HE1 HIS 28 5.062 -13.866 9.727 215 HE2 HIS 28 HE2 HIS 28 5.508 -13.923 12.206 216 H TYR 29 H TYR 29 5.922 -6.903 9.603 217 HA TYR 29 HA TYR 29 4.996 -4.989 11.448 218 HB2 TYR 29 HB3 TYR 29 7.213 -4.897 10.339 219 HB3 TYR 29 HB2 TYR 29 6.416 -4.508 8.818 220 HD1 TYR 29 HD2 TYR 29 5.258 -2.326 8.555 221 HD2 TYR 29 HD1 TYR 29 7.566 -3.234 12.012 222 HE1 TYR 29 HE2 TYR 29 5.340 0.066 9.122 223 HE2 TYR 29 HE1 TYR 29 7.654 -0.846 12.588 224 HH TYR 29 HH TYR 29 5.720 1.353 11.619 225 H PHE 30 H PHE 30 3.974 -5.842 8.220 226 HA PHE 30 HA PHE 30 2.474 -3.538 7.621 227 HB2 PHE 30 HB3 PHE 30 3.136 -5.773 6.243 228 HB3 PHE 30 HB2 PHE 30 1.451 -6.124 6.612 229 HD1 PHE 30 HD1 PHE 30 -0.183 -4.070 6.164 230 HD2 PHE 30 HD2 PHE 30 3.593 -4.666 4.293 231 HE1 PHE 30 HE1 PHE 30 -0.891 -2.642 4.290 232 HE2 PHE 30 HE2 PHE 30 2.892 -3.239 2.416 233 HZ PHE 30 HZ PHE 30 0.648 -2.225 2.413 234 H ARG 31 H ARG 31 1.258 -6.730 8.657 235 HA ARG 31 HA ARG 31 -1.339 -5.785 9.252 236 HB2 ARG 31 HB3 ARG 31 -0.333 -8.230 8.883 237 HB3 ARG 31 HB2 ARG 31 -0.296 -8.201 10.640 238 HG2 ARG 31 HG3 ARG 31 -2.755 -7.464 10.467 239 HG3 ARG 31 HG2 ARG 31 -2.653 -8.051 8.805 240 HD2 ARG 31 HD3 ARG 31 -3.408 -9.922 9.925 241 HD3 ARG 31 HD2 ARG 31 -1.666 -10.190 9.901 242 HE ARG 31 HE ARG 31 -2.314 -8.818 12.250 243 HH11 ARG 31 HH11 ARG 31 -2.821 -11.945 10.786 244 HH12 ARG 31 HH12 ARG 31 -2.930 -12.776 12.301 245 HH21 ARG 31 HH21 ARG 31 -2.457 -9.909 14.244 246 HH22 ARG 31 HH22 ARG 31 -2.724 -11.620 14.265 247 H ALA 32 H ALA 32 1.601 -6.033 11.116 248 HA ALA 32 HA ALA 32 0.481 -5.785 13.693 249 HB1 ALA 32 HB1 ALA 32 3.214 -4.952 12.728 250 HB2 ALA 32 HB2 ALA 32 2.768 -6.552 13.320 251 HB3 ALA 32 HB3 ALA 32 2.731 -5.166 14.411 252 H GLN 33 H GLN 33 1.164 -3.462 11.196 253 HA GLN 33 HA GLN 33 0.850 -1.205 13.001 254 HB2 GLN 33 HB3 GLN 33 1.984 -1.633 10.377 255 HB3 GLN 33 HB2 GLN 33 0.869 -0.274 10.353 256 HG2 GLN 33 HG3 GLN 33 2.696 -0.278 12.634 257 HG3 GLN 33 HG2 GLN 33 3.491 -0.150 11.066 258 HE21 GLN 33 HE21 GLN 33 3.992 1.904 10.781 259 HE22 GLN 33 HE22 GLN 33 2.931 3.248 11.012 260 H THR 34 H THR 34 -0.900 -2.819 10.401 261 HA THR 34 HA THR 34 -3.116 -0.935 10.655 262 HB THR 34 HB THR 34 -4.031 -2.601 8.806 263 HG1 THR 34 HG1 THR 34 -2.103 -3.961 9.171 264 HG21 THR 34 HG21 THR 34 -2.406 -0.225 8.681 265 HG22 THR 34 HG22 THR 34 -3.765 -0.722 7.672 266 HG23 THR 34 HG23 THR 34 -2.134 -1.274 7.290 267 H VAL 35 H VAL 35 -2.811 -2.316 12.968 268 HA VAL 35 HA VAL 35 -4.535 -4.645 12.964 269 HB VAL 35 HB VAL 35 -3.395 -3.195 15.354 270 HG11 VAL 35 HG11 VAL 35 -4.858 -4.600 16.346 271 HG12 VAL 35 HG12 VAL 35 -3.583 -5.786 16.065 272 HG13 VAL 35 HG13 VAL 35 -4.943 -5.671 14.948 273 HG21 VAL 35 HG21 VAL 35 -1.473 -4.502 15.256 274 HG22 VAL 35 HG22 VAL 35 -1.736 -4.053 13.571 275 HG23 VAL 35 HG23 VAL 35 -2.198 -5.658 14.138 276 H GLY 36 H GLY 36 -6.605 -4.056 12.485 277 HA2 GLY 36 HA3 GLY 36 -8.749 -3.500 13.238 278 HA3 GLY 36 HA2 GLY 36 -8.026 -2.583 14.551 279 H LYS 37 H LYS 37 -6.985 -2.114 11.264 280 HA LYS 37 HA LYS 37 -8.362 0.492 11.249 281 HB2 LYS 37 HB3 LYS 37 -5.774 -0.140 9.833 282 HB3 LYS 37 HB2 LYS 37 -6.505 1.440 10.078 283 HG2 LYS 37 HG3 LYS 37 -6.126 0.263 12.626 284 HG3 LYS 37 HG2 LYS 37 -4.630 0.072 11.711 285 HD2 LYS 37 HD3 LYS 37 -5.981 2.717 11.627 286 HD3 LYS 37 HD2 LYS 37 -5.152 2.263 13.117 287 HE2 LYS 37 HE3 LYS 37 -3.084 2.263 12.130 288 HE3 LYS 37 HE2 LYS 37 -3.728 1.883 10.533 289 HZ1 LYS 37 HZ1 LYS 37 -4.737 4.224 10.676 290 HZ2 LYS 37 HZ2 LYS 37 -3.085 4.081 10.344 291 HZ3 LYS 37 HZ3 LYS 37 -3.602 4.491 11.902 292 H ILE 38 H ILE 38 -7.947 1.280 8.690 293 HA ILE 38 HA ILE 38 -9.261 -0.822 7.094 294 HB ILE 38 HB ILE 38 -9.847 1.738 5.978 295 HG12 ILE 38 HG13 ILE 38 -10.912 1.538 8.789 296 HG13 ILE 38 HG12 ILE 38 -9.440 2.433 8.429 297 HG21 ILE 38 HG21 ILE 38 -11.495 0.335 5.442 298 HG22 ILE 38 HG22 ILE 38 -12.202 0.779 6.994 299 HG23 ILE 38 HG23 ILE 38 -11.219 -0.678 6.855 300 HD11 ILE 38 HD11 ILE 38 -11.079 3.496 6.595 301 HD12 ILE 38 HD12 ILE 38 -10.874 4.144 8.222 302 HD13 ILE 38 HD13 ILE 38 -12.244 3.094 7.857 303 H MET 39 H MET 39 -8.178 -1.453 5.363 304 HA MET 39 HA MET 39 -6.096 0.330 4.285 305 HB2 MET 39 HB3 MET 39 -4.989 -1.573 5.080 306 HB3 MET 39 HB2 MET 39 -6.262 -2.657 4.544 307 HG2 MET 39 HG3 MET 39 -4.811 -1.152 2.453 308 HG3 MET 39 HG2 MET 39 -3.925 -2.423 3.294 309 HE1 MET 39 HE1 MET 39 -5.232 -4.500 3.985 310 HE2 MET 39 HE2 MET 39 -5.635 -5.589 2.657 311 HE3 MET 39 HE3 MET 39 -6.912 -4.698 3.486 312 H VAL 40 H VAL 40 -6.252 1.005 2.247 313 HA VAL 40 HA VAL 40 -8.529 0.161 0.656 314 HB VAL 40 HB VAL 40 -6.443 2.235 -0.019 315 HG11 VAL 40 HG11 VAL 40 -8.369 3.121 -1.420 316 HG12 VAL 40 HG12 VAL 40 -9.144 1.560 -1.151 317 HG13 VAL 40 HG13 VAL 40 -7.593 1.642 -1.986 318 HG21 VAL 40 HG21 VAL 40 -8.138 2.365 2.121 319 HG22 VAL 40 HG22 VAL 40 -9.080 3.158 0.859 320 HG23 VAL 40 HG23 VAL 40 -7.473 3.758 1.268 321 H VAL 41 H VAL 41 -8.361 -1.527 -0.663 322 HA VAL 41 HA VAL 41 -5.755 -2.050 -1.932 323 HB VAL 41 HB VAL 41 -7.036 -3.759 -0.302 324 HG11 VAL 41 HG11 VAL 41 -8.920 -3.788 -2.095 325 HG12 VAL 41 HG12 VAL 41 -8.415 -5.292 -1.328 326 HG13 VAL 41 HG13 VAL 41 -7.839 -4.890 -2.946 327 HG21 VAL 41 HG21 VAL 41 -5.855 -5.480 -2.127 328 HG22 VAL 41 HG22 VAL 41 -5.071 -4.687 -0.762 329 HG23 VAL 41 HG23 VAL 41 -5.015 -3.947 -2.361 330 H GLY 42 H GLY 42 -5.749 -2.820 -4.119 331 HA2 GLY 42 HA3 GLY 42 -7.872 -1.589 -5.690 332 HA3 GLY 42 HA2 GLY 42 -6.329 -2.167 -6.300 333 H ARG 43 H ARG 43 -8.413 -2.751 -7.807 334 HA ARG 43 HA ARG 43 -9.934 -4.998 -7.236 335 HB2 ARG 43 HB3 ARG 43 -10.260 -3.479 -9.180 336 HB3 ARG 43 HB2 ARG 43 -8.858 -4.215 -9.945 337 HG2 ARG 43 HG3 ARG 43 -10.218 -6.432 -9.529 338 HG3 ARG 43 HG2 ARG 43 -11.583 -5.313 -9.515 339 HD2 ARG 43 HD3 ARG 43 -9.539 -5.548 -11.719 340 HD3 ARG 43 HD2 ARG 43 -11.157 -6.246 -11.749 341 HE ARG 43 HE ARG 43 -11.044 -3.388 -11.312 342 HH11 ARG 43 HH11 ARG 43 -11.339 -5.963 -13.653 343 HH12 ARG 43 HH12 ARG 43 -12.097 -4.959 -14.842 344 HH21 ARG 43 HH21 ARG 43 -12.035 -2.073 -12.874 345 HH22 ARG 43 HH22 ARG 43 -12.493 -2.750 -14.401 346 H ARG 44 H ARG 44 -7.000 -4.928 -9.253 347 HA ARG 44 HA ARG 44 -6.677 -7.695 -9.437 348 HB2 ARG 44 HB3 ARG 44 -5.272 -5.373 -10.274 349 HB3 ARG 44 HB2 ARG 44 -4.112 -6.427 -9.478 350 HG2 ARG 44 HG3 ARG 44 -3.936 -7.385 -11.488 351 HG3 ARG 44 HG2 ARG 44 -5.437 -8.201 -11.046 352 HD2 ARG 44 HD3 ARG 44 -5.546 -5.512 -12.337 353 HD3 ARG 44 HD2 ARG 44 -5.232 -6.936 -13.328 354 HE ARG 44 HE ARG 44 -7.719 -6.196 -12.089 355 HH11 ARG 44 HH11 ARG 44 -5.833 -8.835 -13.376 356 HH12 ARG 44 HH12 ARG 44 -7.214 -9.831 -13.694 357 HH21 ARG 44 HH21 ARG 44 -9.536 -7.505 -12.506 358 HH22 ARG 44 HH22 ARG 44 -9.316 -9.076 -13.201 359 H THR 45 H THR 45 -6.056 -5.564 -6.815 360 HA THR 45 HA THR 45 -4.093 -7.235 -5.549 361 HB THR 45 HB THR 45 -5.636 -5.141 -4.072 362 HG1 THR 45 HG1 THR 45 -5.185 -3.910 -5.756 363 HG21 THR 45 HG21 THR 45 -3.955 -6.177 -2.773 364 HG22 THR 45 HG22 THR 45 -3.331 -4.598 -3.249 365 HG23 THR 45 HG23 THR 45 -2.775 -6.053 -4.077 366 H TYR 46 H TYR 46 -7.566 -6.535 -4.960 367 HA TYR 46 HA TYR 46 -7.855 -8.091 -2.684 368 HB2 TYR 46 HB3 TYR 46 -10.214 -8.154 -3.096 369 HB3 TYR 46 HB2 TYR 46 -9.625 -6.590 -3.634 370 HD1 TYR 46 HD2 TYR 46 -10.135 -10.001 -5.119 371 HD2 TYR 46 HD1 TYR 46 -10.584 -5.791 -5.569 372 HE1 TYR 46 HE2 TYR 46 -11.184 -10.350 -7.300 373 HE2 TYR 46 HE1 TYR 46 -11.656 -6.142 -7.747 374 HH TYR 46 HH TYR 46 -11.416 -8.462 -9.570 375 H GLU 47 H GLU 47 -7.891 -9.079 -6.076 376 HA GLU 47 HA GLU 47 -8.420 -11.840 -5.417 377 HB2 GLU 47 HB3 GLU 47 -8.425 -10.215 -7.781 378 HB3 GLU 47 HB2 GLU 47 -7.410 -11.626 -8.055 379 HG2 GLU 47 HG3 GLU 47 -9.169 -13.109 -7.666 380 HG3 GLU 47 HG2 GLU 47 -10.153 -11.867 -6.895 381 H SER 48 H SER 48 -5.693 -9.801 -5.725 382 HA SER 48 HA SER 48 -3.857 -12.069 -5.995 383 HB2 SER 48 HB3 SER 48 -3.405 -9.085 -6.161 384 HB3 SER 48 HB2 SER 48 -2.104 -10.275 -6.224 385 HG SER 48 HG SER 48 -2.714 -10.866 -8.180 386 H PHE 49 H PHE 49 -5.444 -11.078 -3.506 387 HA PHE 49 HA PHE 49 -3.131 -10.857 -1.700 388 HB2 PHE 49 HB3 PHE 49 -5.309 -9.206 -1.852 389 HB3 PHE 49 HB2 PHE 49 -5.786 -10.308 -0.565 390 HD1 PHE 49 HD1 PHE 49 -3.297 -7.810 -1.613 391 HD2 PHE 49 HD2 PHE 49 -4.719 -10.264 1.561 392 HE1 PHE 49 HE1 PHE 49 -1.911 -6.548 -0.020 393 HE2 PHE 49 HE2 PHE 49 -3.336 -9.005 3.159 394 HZ PHE 49 HZ PHE 49 -1.930 -7.144 2.370 395 HA PRO 50 HA PRO 50 -4.212 -15.139 -0.747 396 HB2 PRO 50 HB3 PRO 50 -2.074 -14.763 1.267 397 HB3 PRO 50 HB2 PRO 50 -2.234 -15.994 0.010 398 HG2 PRO 50 HG3 PRO 50 -0.448 -14.023 -0.215 399 HG3 PRO 50 HG2 PRO 50 -1.332 -14.628 -1.628 400 HD2 PRO 50 HD3 PRO 50 -1.786 -12.138 -0.030 401 HD3 PRO 50 HD2 PRO 50 -1.865 -12.379 -1.788 402 H LYS 51 H LYS 51 -4.269 -12.374 1.313 403 HA LYS 51 HA LYS 51 -5.910 -13.880 3.239 404 HB2 LYS 51 HB3 LYS 51 -3.582 -12.139 3.707 405 HB3 LYS 51 HB2 LYS 51 -4.966 -11.802 4.738 406 HG2 LYS 51 HG3 LYS 51 -4.209 -14.639 4.474 407 HG3 LYS 51 HG2 LYS 51 -3.072 -13.598 5.335 408 HD2 LYS 51 HD3 LYS 51 -4.729 -12.960 6.918 409 HD3 LYS 51 HD2 LYS 51 -6.016 -13.698 5.962 410 HE2 LYS 51 HE3 LYS 51 -4.960 -15.909 6.340 411 HE3 LYS 51 HE2 LYS 51 -3.779 -15.129 7.391 412 HZ1 LYS 51 HZ1 LYS 51 -6.033 -16.197 8.282 413 HZ2 LYS 51 HZ2 LYS 51 -6.576 -14.620 8.001 414 HZ3 LYS 51 HZ3 LYS 51 -5.272 -14.891 9.043 415 H ARG 52 H ARG 52 -7.620 -13.134 1.726 416 HA ARG 52 HA ARG 52 -8.426 -10.373 2.360 417 HB2 ARG 52 HB3 ARG 52 -9.661 -10.396 0.187 418 HB3 ARG 52 HB2 ARG 52 -7.912 -10.467 0.026 419 HG2 ARG 52 HG3 ARG 52 -7.997 -12.408 -1.048 420 HG3 ARG 52 HG2 ARG 52 -9.082 -13.111 0.153 421 HD2 ARG 52 HD3 ARG 52 -10.756 -11.404 -1.133 422 HD3 ARG 52 HD2 ARG 52 -9.677 -11.872 -2.446 423 HE ARG 52 HE ARG 52 -10.333 -14.239 -1.315 424 HH11 ARG 52 HH11 ARG 52 -12.222 -11.550 -2.492 425 HH12 ARG 52 HH12 ARG 52 -13.575 -12.535 -2.940 426 HH21 ARG 52 HH21 ARG 52 -12.111 -15.535 -1.905 427 HH22 ARG 52 HH22 ARG 52 -13.512 -14.797 -2.607 428 HA PRO 53 HA PRO 53 -9.448 -9.439 3.504 429 HB2 PRO 53 HB3 PRO 53 -10.885 -8.936 5.697 430 HB3 PRO 53 HB2 PRO 53 -11.572 -8.731 4.082 431 HG2 PRO 53 HG3 PRO 53 -12.018 -10.890 6.074 432 HG3 PRO 53 HG2 PRO 53 -13.139 -10.205 4.886 433 HD2 PRO 53 HD3 PRO 53 -11.672 -12.602 4.636 434 HD3 PRO 53 HD2 PRO 53 -12.578 -11.776 3.355 435 H LEU 54 H LEU 54 -8.040 -8.781 5.200 436 HA LEU 54 HA LEU 54 -6.658 -10.919 6.482 437 HB2 LEU 54 HB3 LEU 54 -6.403 -7.927 6.600 438 HB3 LEU 54 HB2 LEU 54 -5.415 -8.973 7.600 439 HG LEU 54 HG LEU 54 -5.292 -9.845 4.862 440 HD11 LEU 54 HD11 LEU 54 -3.823 -7.529 4.535 441 HD12 LEU 54 HD12 LEU 54 -5.341 -6.973 5.240 442 HD13 LEU 54 HD13 LEU 54 -5.354 -7.920 3.753 443 HD21 LEU 54 HD21 LEU 54 -3.133 -10.178 5.381 444 HD22 LEU 54 HD22 LEU 54 -3.688 -9.894 7.031 445 HD23 LEU 54 HD23 LEU 54 -2.952 -8.582 6.111 446 HA PRO 55 HA PRO 55 -8.828 -11.119 10.308 447 HB2 PRO 55 HB3 PRO 55 -6.899 -12.045 11.956 448 HB3 PRO 55 HB2 PRO 55 -7.629 -13.041 10.691 449 HG2 PRO 55 HG3 PRO 55 -5.025 -11.563 10.669 450 HG3 PRO 55 HG2 PRO 55 -5.384 -13.204 10.101 451 HD2 PRO 55 HD3 PRO 55 -5.188 -11.074 8.428 452 HD3 PRO 55 HD2 PRO 55 -6.252 -12.458 8.105 453 H GLU 56 H GLU 56 -9.160 -10.124 12.267 454 HA GLU 56 HA GLU 56 -9.226 -8.357 13.691 455 HB2 GLU 56 HB3 GLU 56 -7.013 -9.735 14.215 456 HB3 GLU 56 HB2 GLU 56 -6.256 -8.218 13.752 457 HG2 GLU 56 HG3 GLU 56 -7.410 -7.035 15.474 458 HG3 GLU 56 HG2 GLU 56 -8.394 -8.448 15.853 459 H ARG 57 H ARG 57 -9.048 -7.676 10.812 460 HA ARG 57 HA ARG 57 -8.435 -4.872 11.209 461 HB2 ARG 57 HB3 ARG 57 -6.850 -4.623 9.488 462 HB3 ARG 57 HB2 ARG 57 -6.311 -6.016 10.409 463 HG2 ARG 57 HG3 ARG 57 -6.036 -6.791 8.283 464 HG3 ARG 57 HG2 ARG 57 -7.676 -7.349 8.614 465 HD2 ARG 57 HD3 ARG 57 -7.202 -6.175 6.370 466 HD3 ARG 57 HD2 ARG 57 -8.639 -5.713 7.276 467 HE ARG 57 HE ARG 57 -7.779 -3.614 7.446 468 HH11 ARG 57 HH11 ARG 57 -5.144 -5.814 6.816 469 HH12 ARG 57 HH12 ARG 57 -3.967 -4.554 6.657 470 HH21 ARG 57 HH21 ARG 57 -6.235 -1.959 7.235 471 HH22 ARG 57 HH22 ARG 57 -4.586 -2.365 6.896 472 H THR 58 H THR 58 -9.045 -3.559 9.248 473 HA THR 58 HA THR 58 -11.428 -4.753 7.998 474 HB THR 58 HB THR 58 -10.857 -1.809 8.359 475 HG1 THR 58 HG1 THR 58 -11.058 -2.736 10.393 476 HG21 THR 58 HG21 THR 58 -12.643 -2.791 6.691 477 HG22 THR 58 HG22 THR 58 -12.973 -1.362 7.671 478 HG23 THR 58 HG23 THR 58 -13.589 -2.937 8.172 479 H ASN 59 H ASN 59 -11.484 -4.954 5.844 480 HA ASN 59 HA ASN 59 -9.247 -3.813 4.321 481 HB2 ASN 59 HB3 ASN 59 -11.069 -6.115 3.600 482 HB3 ASN 59 HB2 ASN 59 -9.666 -5.576 2.681 483 HD21 ASN 59 HD21 ASN 59 -10.580 -6.677 5.919 484 HD22 ASN 59 HD22 ASN 59 -9.131 -7.567 6.216 485 H VAL 60 H VAL 60 -9.605 -3.032 2.188 486 HA VAL 60 HA VAL 60 -12.350 -2.207 1.575 487 HB VAL 60 HB VAL 60 -9.941 -0.385 1.575 488 HG11 VAL 60 HG11 VAL 60 -10.927 0.698 -0.103 489 HG12 VAL 60 HG12 VAL 60 -12.183 1.153 1.048 490 HG13 VAL 60 HG13 VAL 60 -12.392 -0.274 0.034 491 HG21 VAL 60 HG21 VAL 60 -12.095 0.751 2.967 492 HG22 VAL 60 HG22 VAL 60 -10.583 0.134 3.632 493 HG23 VAL 60 HG23 VAL 60 -11.987 -0.924 3.508 494 H VAL 61 H VAL 61 -12.881 -2.508 -0.508 495 HA VAL 61 HA VAL 61 -10.717 -3.233 -2.362 496 HB VAL 61 HB VAL 61 -13.635 -4.009 -2.393 497 HG11 VAL 61 HG11 VAL 61 -11.686 -3.952 -4.529 498 HG12 VAL 61 HG12 VAL 61 -13.413 -4.303 -4.589 499 HG13 VAL 61 HG13 VAL 61 -12.264 -5.590 -4.226 500 HG21 VAL 61 HG21 VAL 61 -13.049 -5.953 -1.437 501 HG22 VAL 61 HG22 VAL 61 -11.615 -5.071 -0.910 502 HG23 VAL 61 HG23 VAL 61 -11.552 -6.072 -2.362 503 H LEU 62 H LEU 62 -10.484 -2.247 -4.287 504 HA LEU 62 HA LEU 62 -12.405 -0.125 -4.980 505 HB2 LEU 62 HB3 LEU 62 -10.088 0.568 -4.049 506 HB3 LEU 62 HB2 LEU 62 -9.477 0.060 -5.611 507 HG LEU 62 HG LEU 62 -11.075 1.687 -6.673 508 HD11 LEU 62 HD11 LEU 62 -11.498 3.542 -4.709 509 HD12 LEU 62 HD12 LEU 62 -11.813 2.025 -3.869 510 HD13 LEU 62 HD13 LEU 62 -12.708 2.422 -5.336 511 HD21 LEU 62 HD21 LEU 62 -9.126 2.966 -4.767 512 HD22 LEU 62 HD22 LEU 62 -9.655 3.567 -6.339 513 HD23 LEU 62 HD23 LEU 62 -8.645 2.124 -6.241 514 H THR 63 H THR 63 -13.499 -1.180 -6.567 515 HA THR 63 HA THR 63 -11.943 -1.943 -8.939 516 HB THR 63 HB THR 63 -12.685 -3.980 -7.743 517 HG1 THR 63 HG1 THR 63 -12.670 -3.763 -10.133 518 HG21 THR 63 HG21 THR 63 -14.825 -2.869 -6.866 519 HG22 THR 63 HG22 THR 63 -14.897 -4.557 -7.369 520 HG23 THR 63 HG23 THR 63 -15.513 -3.293 -8.433 521 H HIS 64 H HIS 64 -12.850 -1.402 -10.916 522 HA HIS 64 HA HIS 64 -14.617 0.798 -10.948 523 HB2 HIS 64 HB3 HIS 64 -13.615 -1.005 -13.150 524 HB3 HIS 64 HB2 HIS 64 -14.640 0.394 -13.450 525 HD1 HIS 64 HD1 HIS 64 -13.555 2.734 -12.448 526 HD2 HIS 64 HD2 HIS 64 -10.975 -0.429 -13.217 527 HE1 HIS 64 HE1 HIS 64 -11.265 3.759 -12.608 528 HE2 HIS 64 HE2 HIS 64 -9.709 1.814 -12.983 529 H GLN 65 H GLN 65 -15.127 -2.644 -11.345 530 HA GLN 65 HA GLN 65 -17.568 -2.754 -12.581 531 HB2 GLN 65 HB3 GLN 65 -16.286 -4.435 -10.466 532 HB3 GLN 65 HB2 GLN 65 -17.953 -4.759 -10.924 533 HG2 GLN 65 HG3 GLN 65 -17.384 -5.586 -12.943 534 HG3 GLN 65 HG2 GLN 65 -16.024 -4.480 -13.136 535 HE21 GLN 65 HE21 GLN 65 -14.128 -4.927 -11.735 536 HE22 GLN 65 HE22 GLN 65 -13.707 -6.579 -11.455 537 H GLU 66 H GLU 66 -19.586 -2.173 -12.124 538 HA GLU 66 HA GLU 66 -20.108 -0.753 -9.660 539 HB2 GLU 66 HB3 GLU 66 -22.308 -0.266 -10.686 540 HB3 GLU 66 HB2 GLU 66 -20.961 0.197 -11.716 541 HG2 GLU 66 HG3 GLU 66 -21.515 -2.380 -12.515 542 HG3 GLU 66 HG2 GLU 66 -23.107 -1.697 -12.189 543 H ASP 67 H ASP 67 -21.022 -3.766 -11.199 544 HA ASP 67 HA ASP 67 -22.834 -4.421 -9.012 545 HB2 ASP 67 HB3 ASP 67 -22.520 -5.257 -11.784 546 HB3 ASP 67 HB2 ASP 67 -22.737 -6.624 -10.695 547 H TYR 68 H TYR 68 -19.742 -4.375 -8.860 548 HA TYR 68 HA TYR 68 -19.067 -7.132 -8.388 549 HB2 TYR 68 HB3 TYR 68 -17.406 -5.388 -9.104 550 HB3 TYR 68 HB2 TYR 68 -17.537 -4.681 -7.497 551 HD1 TYR 68 HD1 TYR 68 -16.405 -7.626 -9.399 552 HD2 TYR 68 HD2 TYR 68 -16.463 -5.693 -5.609 553 HE1 TYR 68 HE1 TYR 68 -14.692 -9.188 -8.583 554 HE2 TYR 68 HE2 TYR 68 -14.748 -7.250 -4.783 555 HH TYR 68 HH TYR 68 -13.833 -10.065 -6.520 556 H GLN 69 H GLN 69 -18.819 -8.178 -6.430 557 HA GLN 69 HA GLN 69 -19.790 -6.737 -4.053 558 HB2 GLN 69 HB3 GLN 69 -20.540 -9.504 -4.990 559 HB3 GLN 69 HB2 GLN 69 -20.836 -8.934 -3.353 560 HG2 GLN 69 HG3 GLN 69 -21.913 -7.632 -5.843 561 HG3 GLN 69 HG2 GLN 69 -22.805 -8.765 -4.828 562 HE21 GLN 69 HE21 GLN 69 -21.227 -5.624 -4.879 563 HE22 GLN 69 HE22 GLN 69 -22.160 -4.926 -3.604 564 H ALA 70 H ALA 70 -18.160 -6.579 -2.688 565 HA ALA 70 HA ALA 70 -16.228 -8.785 -2.484 566 HB1 ALA 70 HB1 ALA 70 -14.657 -7.214 -1.607 567 HB2 ALA 70 HB2 ALA 70 -15.901 -5.973 -1.452 568 HB3 ALA 70 HB3 ALA 70 -15.377 -6.502 -3.051 569 H GLN 71 H GLN 71 -17.175 -10.160 -1.046 570 HA GLN 71 HA GLN 71 -18.499 -9.300 1.323 571 HB2 GLN 71 HB3 GLN 71 -17.433 -12.014 0.527 572 HB3 GLN 71 HB2 GLN 71 -18.446 -11.712 1.932 573 HG2 GLN 71 HG3 GLN 71 -19.975 -12.445 0.384 574 HG3 GLN 71 HG2 GLN 71 -20.094 -10.694 0.215 575 HE21 GLN 71 HE21 GLN 71 -20.614 -10.433 -1.859 576 HE22 GLN 71 HE22 GLN 71 -19.706 -11.039 -3.198 577 H GLY 72 H GLY 72 -17.665 -8.747 3.223 578 HA2 GLY 72 HA3 GLY 72 -16.198 -9.157 5.072 579 HA3 GLY 72 HA2 GLY 72 -14.995 -9.749 3.937 580 H ALA 73 H ALA 73 -15.534 -7.400 2.122 581 HA ALA 73 HA ALA 73 -14.246 -5.312 3.753 582 HB1 ALA 73 HB1 ALA 73 -12.441 -5.265 2.450 583 HB2 ALA 73 HB2 ALA 73 -13.413 -5.259 0.980 584 HB3 ALA 73 HB3 ALA 73 -13.003 -6.786 1.760 585 H VAL 74 H VAL 74 -14.295 -3.135 2.572 586 HA VAL 74 HA VAL 74 -17.027 -2.652 1.753 587 HB VAL 74 HB VAL 74 -16.066 -0.227 1.583 588 HG11 VAL 74 HG11 VAL 74 -16.877 -1.838 3.914 589 HG12 VAL 74 HG12 VAL 74 -17.602 -0.382 3.233 590 HG13 VAL 74 HG13 VAL 74 -16.171 -0.258 4.256 591 HG21 VAL 74 HG21 VAL 74 -13.708 -0.932 1.780 592 HG22 VAL 74 HG22 VAL 74 -14.039 -1.462 3.430 593 HG23 VAL 74 HG23 VAL 74 -14.191 0.242 3.003 594 H VAL 75 H VAL 75 -17.700 -2.003 -0.239 595 HA VAL 75 HA VAL 75 -15.696 -2.182 -2.385 596 HB VAL 75 HB VAL 75 -18.681 -2.524 -2.642 597 HG11 VAL 75 HG11 VAL 75 -16.880 -1.957 -4.595 598 HG12 VAL 75 HG12 VAL 75 -18.380 -2.850 -4.844 599 HG13 VAL 75 HG13 VAL 75 -16.864 -3.720 -4.612 600 HG21 VAL 75 HG21 VAL 75 -16.951 -4.871 -2.958 601 HG22 VAL 75 HG22 VAL 75 -18.515 -4.710 -2.158 602 HG23 VAL 75 HG23 VAL 75 -17.041 -4.239 -1.314 603 H VAL 76 H VAL 76 -15.404 -0.611 -3.818 604 HA VAL 76 HA VAL 76 -17.300 1.509 -4.235 605 HB VAL 76 HB VAL 76 -15.864 3.358 -3.620 606 HG11 VAL 76 HG11 VAL 76 -17.393 2.392 -1.924 607 HG12 VAL 76 HG12 VAL 76 -15.995 3.208 -1.225 608 HG13 VAL 76 HG13 VAL 76 -16.043 1.447 -1.297 609 HG21 VAL 76 HG21 VAL 76 -13.669 3.148 -3.394 610 HG22 VAL 76 HG22 VAL 76 -13.819 1.409 -3.651 611 HG23 VAL 76 HG23 VAL 76 -13.887 2.067 -2.016 612 H HIS 77 H HIS 77 -16.656 2.894 -6.049 613 HA HIS 77 HA HIS 77 -14.560 1.636 -7.696 614 HB2 HIS 77 HB3 HIS 77 -16.824 2.962 -9.079 615 HB3 HIS 77 HB2 HIS 77 -15.912 1.525 -9.529 616 HD1 HIS 77 HD1 HIS 77 -16.442 -0.406 -7.338 617 HD2 HIS 77 HD2 HIS 77 -19.382 2.168 -8.753 618 HE1 HIS 77 HE1 HIS 77 -18.629 -1.472 -6.705 619 HE2 HIS 77 HE2 HIS 77 -20.395 0.062 -7.643 620 H ASP 78 H ASP 78 -15.632 4.529 -6.284 621 HA ASP 78 HA ASP 78 -13.880 6.060 -8.094 622 HB2 ASP 78 HB3 ASP 78 -16.469 6.528 -8.021 623 HB3 ASP 78 HB2 ASP 78 -16.060 7.407 -6.550 624 H VAL 79 H VAL 79 -12.689 7.805 -7.161 625 HA VAL 79 HA VAL 79 -11.532 7.170 -4.668 626 HB VAL 79 HB VAL 79 -10.495 9.513 -4.965 627 HG11 VAL 79 HG11 VAL 79 -10.044 7.039 -6.494 628 HG12 VAL 79 HG12 VAL 79 -8.956 7.932 -5.431 629 HG13 VAL 79 HG13 VAL 79 -9.219 8.481 -7.087 630 HG21 VAL 79 HG21 VAL 79 -11.429 9.190 -7.793 631 HG22 VAL 79 HG22 VAL 79 -10.658 10.584 -7.037 632 HG23 VAL 79 HG23 VAL 79 -12.320 10.165 -6.625 633 H ALA 80 H ALA 80 -13.918 9.529 -5.708 634 HA ALA 80 HA ALA 80 -14.029 10.975 -3.270 635 HB1 ALA 80 HB1 ALA 80 -15.997 12.014 -4.151 636 HB2 ALA 80 HB2 ALA 80 -16.224 10.712 -5.319 637 HB3 ALA 80 HB3 ALA 80 -14.853 11.809 -5.477 638 H ALA 81 H ALA 81 -15.883 8.265 -4.580 639 HA ALA 81 HA ALA 81 -17.852 8.041 -2.651 640 HB1 ALA 81 HB1 ALA 81 -16.637 5.521 -3.632 641 HB2 ALA 81 HB2 ALA 81 -17.279 6.637 -4.837 642 HB3 ALA 81 HB3 ALA 81 -18.329 6.013 -3.564 643 H VAL 82 H VAL 82 -14.812 6.153 -2.700 644 HA VAL 82 HA VAL 82 -15.014 5.020 -0.208 645 HB VAL 82 HB VAL 82 -13.252 4.681 -2.088 646 HG11 VAL 82 HG11 VAL 82 -11.303 5.868 -2.068 647 HG12 VAL 82 HG12 VAL 82 -11.450 6.294 -0.362 648 HG13 VAL 82 HG13 VAL 82 -12.428 7.130 -1.567 649 HG21 VAL 82 HG21 VAL 82 -12.249 4.515 0.740 650 HG22 VAL 82 HG22 VAL 82 -11.880 3.449 -0.616 651 HG23 VAL 82 HG23 VAL 82 -13.491 3.439 0.100 652 H PHE 83 H PHE 83 -13.936 8.287 -1.017 653 HA PHE 83 HA PHE 83 -12.753 8.917 1.435 654 HB2 PHE 83 HB3 PHE 83 -14.102 10.616 -0.661 655 HB3 PHE 83 HB2 PHE 83 -13.330 11.297 0.755 656 HD1 PHE 83 HD2 PHE 83 -11.057 9.117 0.722 657 HD2 PHE 83 HD1 PHE 83 -12.652 11.800 -2.174 658 HE1 PHE 83 HE2 PHE 83 -8.905 9.110 -0.465 659 HE2 PHE 83 HE1 PHE 83 -10.501 11.795 -3.366 660 HZ PHE 83 HZ PHE 83 -8.624 10.450 -2.512 661 H ALA 84 H ALA 84 -16.114 9.164 0.338 662 HA ALA 84 HA ALA 84 -17.131 10.481 2.602 663 HB1 ALA 84 HB1 ALA 84 -19.318 9.441 1.937 664 HB2 ALA 84 HB2 ALA 84 -18.445 8.560 0.683 665 HB3 ALA 84 HB3 ALA 84 -18.500 10.322 0.647 666 H TYR 85 H TYR 85 -16.619 7.083 1.876 667 HA TYR 85 HA TYR 85 -17.793 6.014 4.195 668 HB2 TYR 85 HB3 TYR 85 -17.223 4.087 3.202 669 HB3 TYR 85 HB2 TYR 85 -16.349 5.002 1.984 670 HD1 TYR 85 HD1 TYR 85 -15.850 3.684 5.455 671 HD2 TYR 85 HD2 TYR 85 -14.136 4.500 1.653 672 HE1 TYR 85 HE1 TYR 85 -13.745 2.643 6.188 673 HE2 TYR 85 HE2 TYR 85 -12.025 3.463 2.373 674 HH TYR 85 HH TYR 85 -10.838 2.926 4.399 675 H ALA 86 H ALA 86 -14.313 6.574 3.549 676 HA ALA 86 HA ALA 86 -13.256 6.130 5.995 677 HB1 ALA 86 HB1 ALA 86 -11.541 7.843 5.459 678 HB2 ALA 86 HB2 ALA 86 -12.541 8.361 4.101 679 HB3 ALA 86 HB3 ALA 86 -11.869 6.731 4.130 680 H LYS 87 H LYS 87 -15.215 8.892 5.087 681 HA LYS 87 HA LYS 87 -14.626 10.449 7.406 682 HB2 LYS 87 HB3 LYS 87 -15.956 10.920 5.053 683 HB3 LYS 87 HB2 LYS 87 -17.287 10.809 6.197 684 HG2 LYS 87 HG3 LYS 87 -16.883 13.006 6.445 685 HG3 LYS 87 HG2 LYS 87 -15.648 12.434 7.567 686 HD2 LYS 87 HD3 LYS 87 -14.294 13.737 6.314 687 HD3 LYS 87 HD2 LYS 87 -14.272 12.327 5.252 688 HE2 LYS 87 HE3 LYS 87 -14.710 14.474 4.073 689 HE3 LYS 87 HE2 LYS 87 -15.979 13.268 3.862 690 HZ1 LYS 87 HZ1 LYS 87 -16.457 15.788 4.543 691 HZ2 LYS 87 HZ2 LYS 87 -16.325 15.107 6.086 692 HZ3 LYS 87 HZ3 LYS 87 -17.465 14.504 4.991 693 H GLN 88 H GLN 88 -17.218 8.248 6.490 694 HA GLN 88 HA GLN 88 -18.748 8.437 8.834 695 HB2 GLN 88 HB3 GLN 88 -19.065 7.169 6.462 696 HB3 GLN 88 HB2 GLN 88 -18.672 5.802 7.495 697 HG2 GLN 88 HG3 GLN 88 -20.654 5.853 8.520 698 HG3 GLN 88 HG2 GLN 88 -20.658 7.612 8.638 699 HE21 GLN 88 HE21 GLN 88 -20.402 5.610 5.748 700 HE22 GLN 88 HE22 GLN 88 -21.866 6.162 5.015 701 H HIS 89 H HIS 89 -15.756 6.853 8.208 702 HA HIS 89 HA HIS 89 -15.964 5.365 10.737 703 HB2 HIS 89 HB3 HIS 89 -14.538 4.860 8.175 704 HB3 HIS 89 HB2 HIS 89 -13.759 4.315 9.657 705 HD1 HIS 89 HD1 HIS 89 -16.285 3.354 11.179 706 HD2 HIS 89 HD2 HIS 89 -15.439 2.475 7.207 707 HE1 HIS 89 HE1 HIS 89 -17.570 1.254 10.667 708 HE2 HIS 89 HE2 HIS 89 -17.115 0.792 8.233 709 HA PRO 90 HA PRO 90 -12.969 8.815 11.570 710 HB2 PRO 90 HB3 PRO 90 -14.038 9.640 13.894 711 HB3 PRO 90 HB2 PRO 90 -14.680 10.167 12.333 712 HG2 PRO 90 HG3 PRO 90 -15.688 8.026 14.170 713 HG3 PRO 90 HG2 PRO 90 -16.602 9.267 13.291 714 HD2 PRO 90 HD3 PRO 90 -16.365 6.690 12.430 715 HD3 PRO 90 HD2 PRO 90 -16.587 8.068 11.335 716 H ASP 91 H ASP 91 -13.771 5.850 12.914 717 HA ASP 91 HA ASP 91 -11.945 6.057 15.174 718 HB2 ASP 91 HB3 ASP 91 -14.249 4.746 15.011 719 HB3 ASP 91 HB2 ASP 91 -13.206 3.469 14.394 720 H GLN 92 H GLN 92 -11.912 5.037 11.899 721 HA GLN 92 HA GLN 92 -9.303 3.741 12.341 722 HB2 GLN 92 HB3 GLN 92 -11.254 3.063 10.139 723 HB3 GLN 92 HB2 GLN 92 -9.746 2.238 10.508 724 HG2 GLN 92 HG3 GLN 92 -10.671 1.008 12.129 725 HG3 GLN 92 HG2 GLN 92 -11.627 2.355 12.744 726 HE21 GLN 92 HE21 GLN 92 -13.733 2.195 12.501 727 HE22 GLN 92 HE22 GLN 92 -14.555 1.220 11.336 728 H GLU 93 H GLU 93 -7.960 3.715 10.280 729 HA GLU 93 HA GLU 93 -8.260 6.278 8.857 730 HB2 GLU 93 HB3 GLU 93 -6.211 5.578 10.596 731 HB3 GLU 93 HB2 GLU 93 -5.522 5.290 9.004 732 HG2 GLU 93 HG3 GLU 93 -6.931 7.856 9.589 733 HG3 GLU 93 HG2 GLU 93 -5.268 7.611 10.117 734 H LEU 94 H LEU 94 -7.187 6.335 6.721 735 HA LEU 94 HA LEU 94 -7.539 3.757 5.370 736 HB2 LEU 94 HB3 LEU 94 -7.829 6.601 4.563 737 HB3 LEU 94 HB2 LEU 94 -7.314 5.466 3.330 738 HG LEU 94 HG LEU 94 -9.338 4.098 3.798 739 HD11 LEU 94 HD11 LEU 94 -9.696 4.836 6.108 740 HD12 LEU 94 HD12 LEU 94 -11.139 5.050 5.117 741 HD13 LEU 94 HD13 LEU 94 -10.133 6.441 5.521 742 HD21 LEU 94 HD21 LEU 94 -9.800 6.978 3.033 743 HD22 LEU 94 HD22 LEU 94 -10.927 5.655 2.735 744 HD23 LEU 94 HD23 LEU 94 -9.346 5.660 1.953 745 H VAL 95 H VAL 95 -5.899 2.704 4.451 746 HA VAL 95 HA VAL 95 -3.375 4.125 3.972 747 HB VAL 95 HB VAL 95 -3.497 1.398 5.261 748 HG11 VAL 95 HG11 VAL 95 -1.065 2.041 5.760 749 HG12 VAL 95 HG12 VAL 95 -1.277 3.270 4.514 750 HG13 VAL 95 HG13 VAL 95 -1.471 1.564 4.112 751 HG21 VAL 95 HG21 VAL 95 -4.128 2.578 7.082 752 HG22 VAL 95 HG22 VAL 95 -3.531 4.106 6.434 753 HG23 VAL 95 HG23 VAL 95 -2.408 2.957 7.160 754 H ILE 96 H ILE 96 -2.874 3.890 1.900 755 HA ILE 96 HA ILE 96 -4.048 1.841 0.274 756 HB ILE 96 HB ILE 96 -1.777 3.610 -0.596 757 HG12 ILE 96 HG13 ILE 96 -3.360 5.113 0.449 758 HG13 ILE 96 HG12 ILE 96 -3.509 5.265 -1.298 759 HG21 ILE 96 HG21 ILE 96 -2.476 1.841 -2.120 760 HG22 ILE 96 HG22 ILE 96 -2.870 3.430 -2.776 761 HG23 ILE 96 HG23 ILE 96 -4.136 2.433 -2.060 762 HD11 ILE 96 HD11 ILE 96 -5.438 3.608 -1.095 763 HD12 ILE 96 HD12 ILE 96 -5.700 5.253 -0.515 764 HD13 ILE 96 HD13 ILE 96 -5.380 3.953 0.633 765 H ALA 97 H ALA 97 -3.314 -0.160 0.067 766 HA ALA 97 HA ALA 97 -0.486 -0.699 0.667 767 HB1 ALA 97 HB1 ALA 97 -1.266 -3.070 0.964 768 HB2 ALA 97 HB2 ALA 97 -2.917 -2.468 0.809 769 HB3 ALA 97 HB3 ALA 97 -1.897 -1.915 2.138 770 H GLY 98 H GLY 98 -2.882 -0.807 -1.820 771 HA2 GLY 98 HA3 GLY 98 -1.262 -1.005 -3.973 772 HA3 GLY 98 HA2 GLY 98 -1.440 -2.682 -3.482 773 H GLY 99 H GLY 99 -4.016 -2.103 -6.029 774 HA2 GLY 99 HA3 GLY 99 -1.180 -2.539 -5.581 775 HA3 GLY 99 HA2 GLY 99 -2.049 -2.754 -7.090 776 H ALA 100 H ALA 100 -0.508 -1.659 -8.300 777 HA ALA 100 HA ALA 100 0.554 0.863 -7.699 778 HB1 ALA 100 HB1 ALA 100 1.146 -0.945 -9.539 779 HB2 ALA 100 HB2 ALA 100 1.584 0.753 -9.726 780 HB3 ALA 100 HB3 ALA 100 0.157 0.115 -10.543 781 H GLN 101 H GLN 101 -2.239 -0.031 -9.709 782 HA GLN 101 HA GLN 101 -2.908 2.511 -10.620 783 HB2 GLN 101 HB3 GLN 101 -4.255 -0.088 -10.385 784 HB3 GLN 101 HB2 GLN 101 -5.348 1.288 -10.379 785 HG2 GLN 101 HG3 GLN 101 -3.220 1.060 -12.462 786 HG3 GLN 101 HG2 GLN 101 -4.728 0.160 -12.617 787 HE21 GLN 101 HE21 GLN 101 -6.636 1.787 -11.823 788 HE22 GLN 101 HE22 GLN 101 -6.676 3.242 -12.753 789 H ILE 102 H ILE 102 -3.553 0.967 -7.547 790 HA ILE 102 HA ILE 102 -5.511 2.836 -6.660 791 HB ILE 102 HB ILE 102 -3.738 1.125 -4.921 792 HG12 ILE 102 HG13 ILE 102 -4.785 -0.286 -6.608 793 HG13 ILE 102 HG12 ILE 102 -5.550 -0.558 -5.045 794 HG21 ILE 102 HG21 ILE 102 -5.350 1.381 -3.246 795 HG22 ILE 102 HG22 ILE 102 -6.561 1.981 -4.379 796 HG23 ILE 102 HG23 ILE 102 -5.184 2.993 -3.942 797 HD11 ILE 102 HD11 ILE 102 -6.767 1.439 -6.871 798 HD12 ILE 102 HD12 ILE 102 -7.524 0.364 -5.698 799 HD13 ILE 102 HD13 ILE 102 -6.960 -0.273 -7.243 800 H PHE 103 H PHE 103 -2.010 2.561 -6.236 801 HA PHE 103 HA PHE 103 -1.696 4.666 -4.404 802 HB2 PHE 103 HB3 PHE 103 0.244 3.689 -6.513 803 HB3 PHE 103 HB2 PHE 103 0.659 4.700 -5.134 804 HD1 PHE 103 HD2 PHE 103 -0.894 3.383 -2.992 805 HD2 PHE 103 HD1 PHE 103 1.430 1.732 -6.150 806 HE1 PHE 103 HE2 PHE 103 -0.493 1.368 -1.638 807 HE2 PHE 103 HE1 PHE 103 1.834 -0.286 -4.803 808 HZ PHE 103 HZ PHE 103 0.873 -0.469 -2.544 809 H THR 104 H THR 104 -1.922 4.598 -7.903 810 HA THR 104 HA THR 104 -1.070 7.208 -8.449 811 HB THR 104 HB THR 104 -3.098 5.544 -9.950 812 HG1 THR 104 HG1 THR 104 -1.396 4.705 -11.015 813 HG21 THR 104 HG21 THR 104 -1.385 7.255 -11.528 814 HG22 THR 104 HG22 THR 104 -2.417 8.172 -10.429 815 HG23 THR 104 HG23 THR 104 -3.135 7.043 -11.578 816 H ALA 105 H ALA 105 -4.406 5.981 -8.043 817 HA ALA 105 HA ALA 105 -5.731 8.395 -8.377 818 HB1 ALA 105 HB1 ALA 105 -6.528 5.870 -7.883 819 HB2 ALA 105 HB2 ALA 105 -7.591 7.273 -7.780 820 HB3 ALA 105 HB3 ALA 105 -6.855 6.615 -6.319 821 H PHE 106 H PHE 106 -4.882 6.923 -5.208 822 HA PHE 106 HA PHE 106 -5.541 9.286 -3.801 823 HB2 PHE 106 HB3 PHE 106 -3.975 6.831 -2.999 824 HB3 PHE 106 HB2 PHE 106 -4.408 8.123 -1.884 825 HD1 PHE 106 HD2 PHE 106 -5.809 5.543 -4.137 826 HD2 PHE 106 HD1 PHE 106 -6.533 8.200 -0.891 827 HE1 PHE 106 HE2 PHE 106 -7.984 4.462 -3.743 828 HE2 PHE 106 HE1 PHE 106 -8.709 7.122 -0.491 829 HZ PHE 106 HZ PHE 106 -9.438 5.252 -1.920 830 H LYS 107 H LYS 107 -2.816 8.457 -5.656 831 HA LYS 107 HA LYS 107 -0.637 9.470 -4.370 832 HB2 LYS 107 HB3 LYS 107 0.385 9.581 -6.415 833 HB3 LYS 107 HB2 LYS 107 -1.016 8.621 -6.859 834 HG2 LYS 107 HG3 LYS 107 -2.130 10.778 -7.545 835 HG3 LYS 107 HG2 LYS 107 -0.555 11.549 -7.345 836 HD2 LYS 107 HD3 LYS 107 0.406 10.005 -8.985 837 HD3 LYS 107 HD2 LYS 107 -1.169 9.234 -9.183 838 HE2 LYS 107 HE3 LYS 107 -2.045 11.004 -10.344 839 HE3 LYS 107 HE2 LYS 107 -0.975 12.176 -9.575 840 HZ1 LYS 107 HZ1 LYS 107 0.865 11.067 -10.878 841 HZ2 LYS 107 HZ2 LYS 107 -0.235 11.988 -11.774 842 HZ3 LYS 107 HZ3 LYS 107 -0.347 10.301 -11.776 843 H ASP 108 H ASP 108 -3.245 11.290 -5.860 844 HA ASP 108 HA ASP 108 -1.994 13.836 -5.231 845 HB2 ASP 108 HB3 ASP 108 -3.703 13.040 -7.233 846 HB3 ASP 108 HB2 ASP 108 -4.785 13.890 -6.134 847 H ASP 109 H ASP 109 -4.742 11.875 -4.200 848 HA ASP 109 HA ASP 109 -5.561 13.841 -2.232 849 HB2 ASP 109 HB3 ASP 109 -6.931 11.955 -3.640 850 HB3 ASP 109 HB2 ASP 109 -6.745 11.150 -2.084 851 H VAL 110 H VAL 110 -2.992 11.945 -2.185 852 HA VAL 110 HA VAL 110 -3.351 10.675 0.392 853 HB VAL 110 HB VAL 110 -2.018 9.558 -1.339 854 HG11 VAL 110 HG11 VAL 110 -0.286 10.480 -2.435 855 HG12 VAL 110 HG12 VAL 110 0.318 11.307 -0.999 856 HG13 VAL 110 HG13 VAL 110 -1.013 12.003 -1.924 857 HG21 VAL 110 HG21 VAL 110 -1.581 9.095 1.032 858 HG22 VAL 110 HG22 VAL 110 -0.362 10.369 1.049 859 HG23 VAL 110 HG23 VAL 110 -0.123 8.935 0.052 860 H ASP 111 H ASP 111 -2.018 11.089 2.230 861 HA ASP 111 HA ASP 111 -0.966 13.839 2.348 862 HB2 ASP 111 HB3 ASP 111 -2.530 12.323 4.443 863 HB3 ASP 111 HB2 ASP 111 -1.689 13.838 4.756 864 H THR 112 H THR 112 -0.731 10.547 3.625 865 HA THR 112 HA THR 112 2.014 11.162 4.497 866 HB THR 112 HB THR 112 0.217 8.969 5.546 867 HG1 THR 112 HG1 THR 112 0.861 11.507 6.629 868 HG21 THR 112 HG21 THR 112 2.981 9.851 6.233 869 HG22 THR 112 HG22 THR 112 2.322 8.222 6.070 870 HG23 THR 112 HG23 THR 112 1.928 9.196 7.487 871 H LEU 113 H LEU 113 3.591 9.424 4.265 872 HA LEU 113 HA LEU 113 2.908 7.376 2.297 873 HB2 LEU 113 HB3 LEU 113 4.367 9.748 1.713 874 HB3 LEU 113 HB2 LEU 113 5.477 8.395 1.618 875 HG LEU 113 HG LEU 113 4.114 7.320 -0.057 876 HD11 LEU 113 HD11 LEU 113 2.200 9.604 0.393 877 HD12 LEU 113 HD12 LEU 113 1.908 7.893 0.705 878 HD13 LEU 113 HD13 LEU 113 2.102 8.466 -0.951 879 HD21 LEU 113 HD21 LEU 113 5.506 8.652 -1.243 880 HD22 LEU 113 HD22 LEU 113 5.003 10.115 -0.395 881 HD23 LEU 113 HD23 LEU 113 3.992 9.446 -1.676 882 H LEU 114 H LEU 114 3.897 5.484 2.626 883 HA LEU 114 HA LEU 114 6.261 5.363 4.359 884 HB2 LEU 114 HB3 LEU 114 3.710 3.791 4.711 885 HB3 LEU 114 HB2 LEU 114 5.231 3.322 5.448 886 HG LEU 114 HG LEU 114 4.260 6.086 5.958 887 HD11 LEU 114 HD11 LEU 114 3.077 3.637 7.257 888 HD12 LEU 114 HD12 LEU 114 2.227 4.798 6.237 889 HD13 LEU 114 HD13 LEU 114 2.853 5.297 7.809 890 HD21 LEU 114 HD21 LEU 114 5.193 5.520 8.210 891 HD22 LEU 114 HD22 LEU 114 6.364 5.467 6.892 892 HD23 LEU 114 HD23 LEU 114 5.699 3.968 7.542 893 H VAL 115 H VAL 115 7.762 4.517 3.048 894 HA VAL 115 HA VAL 115 6.993 2.178 1.424 895 HB VAL 115 HB VAL 115 8.606 2.861 -0.273 896 HG11 VAL 115 HG11 VAL 115 7.333 4.605 -1.249 897 HG12 VAL 115 HG12 VAL 115 6.790 5.183 0.326 898 HG13 VAL 115 HG13 VAL 115 6.210 3.637 -0.294 899 HG21 VAL 115 HG21 VAL 115 9.040 5.230 1.535 900 HG22 VAL 115 HG22 VAL 115 9.544 5.186 -0.155 901 HG23 VAL 115 HG23 VAL 115 10.233 4.046 1.001 902 H THR 116 H THR 116 8.492 0.541 1.146 903 HA THR 116 HA THR 116 10.771 0.576 3.016 904 HB THR 116 HB THR 116 8.973 -1.714 2.194 905 HG1 THR 116 HG1 THR 116 8.420 -1.735 4.333 906 HG21 THR 116 HG21 THR 116 11.098 -2.716 2.313 907 HG22 THR 116 HG22 THR 116 10.312 -3.040 3.859 908 HG23 THR 116 HG23 THR 116 11.542 -1.781 3.742 909 H ARG 117 H ARG 117 12.416 1.121 1.658 910 HA ARG 117 HA ARG 117 12.628 -0.130 -0.952 911 HB2 ARG 117 HB3 ARG 117 14.103 2.050 0.476 912 HB3 ARG 117 HB2 ARG 117 14.831 1.280 -0.927 913 HG2 ARG 117 HG3 ARG 117 12.039 2.232 -1.193 914 HG3 ARG 117 HG2 ARG 117 13.317 3.447 -1.116 915 HD2 ARG 117 HD3 ARG 117 13.851 1.180 -2.910 916 HD3 ARG 117 HD2 ARG 117 12.503 2.210 -3.390 917 HE ARG 117 HE ARG 117 14.871 3.677 -2.698 918 HH11 ARG 117 HH11 ARG 117 13.219 1.975 -5.257 919 HH12 ARG 117 HH12 ARG 117 14.032 2.833 -6.523 920 HH21 ARG 117 HH21 ARG 117 15.941 4.808 -4.361 921 HH22 ARG 117 HH22 ARG 117 15.578 4.441 -6.014 922 H LEU 118 H LEU 118 13.323 -2.169 -0.955 923 HA LEU 118 HA LEU 118 15.004 -3.323 0.991 924 HB2 LEU 118 HB3 LEU 118 13.917 -4.119 -1.650 925 HB3 LEU 118 HB2 LEU 118 15.336 -4.987 -1.096 926 HG LEU 118 HG LEU 118 14.067 -5.485 1.032 927 HD11 LEU 118 HD11 LEU 118 11.451 -5.359 0.056 928 HD12 LEU 118 HD12 LEU 118 12.155 -3.774 -0.265 929 HD13 LEU 118 HD13 LEU 118 12.151 -4.422 1.375 930 HD21 LEU 118 HD21 LEU 118 13.643 -6.591 -1.649 931 HD22 LEU 118 HD22 LEU 118 12.401 -7.018 -0.471 932 HD23 LEU 118 HD23 LEU 118 14.093 -7.394 -0.144 933 H ALA 119 H ALA 119 17.152 -4.296 0.539 934 HA ALA 119 HA ALA 119 18.913 -2.289 -0.565 935 HB1 ALA 119 HB1 ALA 119 20.360 -4.617 0.153 936 HB2 ALA 119 HB2 ALA 119 19.119 -4.354 1.379 937 HB3 ALA 119 HB3 ALA 119 20.273 -3.074 1.004 938 H GLY 120 H GLY 120 18.064 -5.660 -1.242 939 HA2 GLY 120 HA3 GLY 120 19.859 -5.991 -3.404 940 HA3 GLY 120 HA2 GLY 120 18.450 -6.987 -3.073 941 H SER 121 H SER 121 19.509 -6.022 -5.613 942 HA SER 121 HA SER 121 17.413 -4.190 -6.520 943 HB2 SER 121 HB3 SER 121 20.148 -4.617 -7.255 944 HB3 SER 121 HB2 SER 121 19.133 -4.915 -8.666 945 HG SER 121 HG SER 121 19.504 -2.565 -7.194 946 H PHE 122 H PHE 122 15.664 -4.917 -7.536 947 HA PHE 122 HA PHE 122 15.771 -7.592 -8.767 948 HB2 PHE 122 HB3 PHE 122 13.458 -6.358 -7.259 949 HB3 PHE 122 HB2 PHE 122 13.421 -7.912 -8.086 950 HD1 PHE 122 HD2 PHE 122 15.488 -6.127 -5.542 951 HD2 PHE 122 HD1 PHE 122 13.727 -9.787 -6.810 952 HE1 PHE 122 HE2 PHE 122 16.313 -7.226 -3.501 953 HE2 PHE 122 HE1 PHE 122 14.549 -10.893 -4.772 954 HZ PHE 122 HZ PHE 122 15.844 -9.613 -3.114 955 H GLU 123 H GLU 123 14.068 -7.957 -10.407 956 HA GLU 123 HA GLU 123 13.260 -5.501 -11.800 957 HB2 GLU 123 HB3 GLU 123 13.907 -6.471 -13.951 958 HB3 GLU 123 HB2 GLU 123 15.297 -6.329 -12.884 959 HG2 GLU 123 HG3 GLU 123 14.285 -8.873 -12.396 960 HG3 GLU 123 HG2 GLU 123 14.170 -8.662 -14.143 961 H GLY 124 H GLY 124 11.256 -5.558 -12.707 962 HA2 GLY 124 HA3 GLY 124 9.902 -8.078 -13.158 963 HA3 GLY 124 HA2 GLY 124 9.254 -7.131 -11.828 964 H ASP 125 H ASP 125 7.334 -6.462 -12.604 965 HA ASP 125 HA ASP 125 7.399 -4.649 -14.894 966 HB2 ASP 125 HB3 ASP 125 5.605 -7.061 -14.645 967 HB3 ASP 125 HB2 ASP 125 5.221 -5.703 -15.699 968 H THR 126 H THR 126 7.097 -4.404 -11.942 969 HA THR 126 HA THR 126 4.712 -2.731 -12.006 970 HB THR 126 HB THR 126 5.027 -4.364 -9.546 971 HG1 THR 126 HG1 THR 126 3.774 -5.406 -11.863 972 HG21 THR 126 HG21 THR 126 2.609 -4.327 -9.540 973 HG22 THR 126 HG22 THR 126 2.599 -3.536 -11.116 974 HG23 THR 126 HG23 THR 126 3.251 -2.694 -9.711 975 H LYS 127 H LYS 127 5.660 -0.829 -11.659 976 HA LYS 127 HA LYS 127 7.388 -0.557 -9.286 977 HB2 LYS 127 HB3 LYS 127 8.432 1.391 -10.581 978 HB3 LYS 127 HB2 LYS 127 8.864 -0.237 -11.087 979 HG2 LYS 127 HG3 LYS 127 8.064 0.094 -13.129 980 HG3 LYS 127 HG2 LYS 127 6.537 0.720 -12.506 981 HD2 LYS 127 HD3 LYS 127 8.688 2.617 -12.123 982 HD3 LYS 127 HD2 LYS 127 8.530 2.158 -13.819 983 HE2 LYS 127 HE3 LYS 127 6.044 2.786 -12.326 984 HE3 LYS 127 HE2 LYS 127 7.109 4.129 -12.737 985 HZ1 LYS 127 HZ1 LYS 127 5.587 3.903 -14.503 986 HZ2 LYS 127 HZ2 LYS 127 5.794 2.227 -14.589 987 HZ3 LYS 127 HZ3 LYS 127 7.043 3.258 -15.075 988 H MET 128 H MET 128 7.429 1.727 -8.444 989 HA MET 128 HA MET 128 4.817 2.579 -7.851 990 HB2 MET 128 HB3 MET 128 6.857 2.953 -6.435 991 HB3 MET 128 HB2 MET 128 7.344 4.209 -7.564 992 HG2 MET 128 HG3 MET 128 6.251 5.105 -5.562 993 HG3 MET 128 HG2 MET 128 5.384 5.504 -7.043 994 HE1 MET 128 HE1 MET 128 4.212 6.152 -4.703 995 HE2 MET 128 HE2 MET 128 3.041 5.103 -3.903 996 HE3 MET 128 HE3 MET 128 2.657 5.821 -5.468 997 H ILE 129 H ILE 129 3.950 4.775 -8.225 998 HA ILE 129 HA ILE 129 4.316 5.526 -11.036 999 HB ILE 129 HB ILE 129 2.157 6.666 -10.848 1000 HG12 ILE 129 HG13 ILE 129 0.929 5.852 -8.577 1001 HG13 ILE 129 HG12 ILE 129 2.568 6.076 -7.976 1002 HG21 ILE 129 HG21 ILE 129 1.585 4.630 -11.591 1003 HG22 ILE 129 HG22 ILE 129 0.923 4.407 -9.972 1004 HG23 ILE 129 HG23 ILE 129 2.535 3.803 -10.357 1005 HD11 ILE 129 HD11 ILE 129 2.564 8.353 -8.488 1006 HD12 ILE 129 HD12 ILE 129 0.968 8.040 -7.804 1007 HD13 ILE 129 HD13 ILE 129 1.164 8.201 -9.549 1008 HA PRO 130 HA PRO 130 6.182 9.412 -10.093 1009 HB2 PRO 130 HB3 PRO 130 5.030 11.067 -11.928 1010 HB3 PRO 130 HB2 PRO 130 6.271 9.877 -12.337 1011 HG2 PRO 130 HG3 PRO 130 3.298 9.692 -12.634 1012 HG3 PRO 130 HG2 PRO 130 4.569 9.194 -13.766 1013 HD2 PRO 130 HD3 PRO 130 3.278 7.426 -12.194 1014 HD3 PRO 130 HD2 PRO 130 4.986 7.226 -12.631 1015 H LEU 131 H LEU 131 5.800 10.700 -8.413 1016 HA LEU 131 HA LEU 131 3.113 11.867 -8.096 1017 HB2 LEU 131 HB3 LEU 131 4.638 11.423 -5.623 1018 HB3 LEU 131 HB2 LEU 131 2.931 11.198 -5.946 1019 HG LEU 131 HG LEU 131 4.191 9.133 -7.348 1020 HD11 LEU 131 HD11 LEU 131 5.736 9.904 -4.976 1021 HD12 LEU 131 HD12 LEU 131 6.205 8.948 -6.381 1022 HD13 LEU 131 HD13 LEU 131 5.301 8.197 -5.066 1023 HD21 LEU 131 HD21 LEU 131 3.265 8.384 -4.696 1024 HD22 LEU 131 HD22 LEU 131 2.633 7.944 -6.283 1025 HD23 LEU 131 HD23 LEU 131 2.143 9.460 -5.528 1026 H ASN 132 H ASN 132 3.157 13.757 -6.516 1027 HA ASN 132 HA ASN 132 5.233 15.586 -7.367 1028 HB2 ASN 132 HB3 ASN 132 2.544 15.799 -6.327 1029 HB3 ASN 132 HB2 ASN 132 3.633 16.830 -5.403 1030 HD21 ASN 132 HD21 ASN 132 4.717 18.510 -6.447 1031 HD22 ASN 132 HD22 ASN 132 4.196 19.116 -7.978 1032 H TRP 133 H TRP 133 6.945 14.348 -6.321 1033 HA TRP 133 HA TRP 133 7.104 13.897 -3.575 1034 HB2 TRP 133 HB3 TRP 133 9.307 14.292 -5.602 1035 HB3 TRP 133 HB2 TRP 133 9.562 13.705 -3.959 1036 HD1 TRP 133 HD1 TRP 133 7.845 12.676 -7.243 1037 HE1 TRP 133 HE1 TRP 133 7.560 10.117 -7.251 1038 HE3 TRP 133 HE3 TRP 133 9.504 11.669 -2.517 1039 HZ2 TRP 133 HZ2 TRP 133 8.003 7.955 -5.487 1040 HZ3 TRP 133 HZ3 TRP 133 9.546 9.330 -1.754 1041 HH2 TRP 133 HH2 TRP 133 8.810 7.513 -3.210 1042 H ASP 134 H ASP 134 7.955 16.805 -5.437 1043 HA ASP 134 HA ASP 134 9.430 18.122 -3.483 1044 HB2 ASP 134 HB3 ASP 134 7.942 18.870 -5.903 1045 HB3 ASP 134 HB2 ASP 134 8.054 20.159 -4.708 1046 H ASP 135 H ASP 135 5.931 17.978 -3.985 1047 HA ASP 135 HA ASP 135 5.307 19.774 -1.862 1048 HB2 ASP 135 HB3 ASP 135 3.898 18.492 -3.940 1049 HB3 ASP 135 HB2 ASP 135 3.136 17.970 -2.441 1050 H PHE 136 H PHE 136 6.597 16.747 -1.720 1051 HA PHE 136 HA PHE 136 5.369 16.241 0.909 1052 HB2 PHE 136 HB3 PHE 136 6.269 14.238 -1.169 1053 HB3 PHE 136 HB2 PHE 136 5.873 13.807 0.491 1054 HD1 PHE 136 HD1 PHE 136 3.503 14.759 1.281 1055 HD2 PHE 136 HD2 PHE 136 4.633 13.966 -2.744 1056 HE1 PHE 136 HE1 PHE 136 1.131 14.546 0.661 1057 HE2 PHE 136 HE2 PHE 136 2.263 13.753 -3.372 1058 HZ PHE 136 HZ PHE 136 0.509 14.044 -1.668 1059 H THR 137 H THR 137 6.718 16.064 2.580 1060 HA THR 137 HA THR 137 9.609 15.986 2.011 1061 HB THR 137 HB THR 137 8.061 17.396 4.183 1062 HG1 THR 137 HG1 THR 137 9.961 18.374 2.326 1063 HG21 THR 137 HG21 THR 137 10.170 18.176 5.102 1064 HG22 THR 137 HG22 THR 137 11.051 17.127 3.992 1065 HG23 THR 137 HG23 THR 137 10.022 16.424 5.240 1066 H LYS 138 H LYS 138 10.965 14.820 3.427 1067 HA LYS 138 HA LYS 138 9.757 12.428 4.458 1068 HB2 LYS 138 HB3 LYS 138 11.982 12.494 3.300 1069 HB3 LYS 138 HB2 LYS 138 12.631 13.301 4.724 1070 HG2 LYS 138 HG3 LYS 138 12.826 11.390 5.831 1071 HG3 LYS 138 HG2 LYS 138 11.186 10.896 5.423 1072 HD2 LYS 138 HD3 LYS 138 12.776 9.296 4.542 1073 HD3 LYS 138 HD2 LYS 138 11.978 10.149 3.219 1074 HE2 LYS 138 HE3 LYS 138 13.874 11.308 2.641 1075 HE3 LYS 138 HE2 LYS 138 14.551 11.222 4.267 1076 HZ1 LYS 138 HZ1 LYS 138 14.533 8.646 3.589 1077 HZ2 LYS 138 HZ2 LYS 138 15.853 9.670 3.328 1078 HZ3 LYS 138 HZ3 LYS 138 14.773 9.346 2.067 1079 H VAL 139 H VAL 139 8.876 12.284 6.383 1080 HA VAL 139 HA VAL 139 9.666 14.173 8.466 1081 HB VAL 139 HB VAL 139 7.696 13.057 9.714 1082 HG11 VAL 139 HG11 VAL 139 7.902 15.296 8.247 1083 HG12 VAL 139 HG12 VAL 139 6.422 14.806 9.071 1084 HG13 VAL 139 HG13 VAL 139 6.628 14.467 7.353 1085 HG21 VAL 139 HG21 VAL 139 7.729 11.326 7.614 1086 HG22 VAL 139 HG22 VAL 139 6.462 12.450 7.124 1087 HG23 VAL 139 HG23 VAL 139 6.343 11.604 8.667 1088 H SER 140 H SER 140 9.808 10.767 7.680 1089 HA SER 140 HA SER 140 11.517 10.388 10.025 1090 HB2 SER 140 HB3 SER 140 8.855 9.410 9.906 1091 HB3 SER 140 HB2 SER 140 9.931 8.021 9.755 1092 HG SER 140 HG SER 140 10.767 8.432 11.709 1093 H SER 141 H SER 141 12.993 8.669 9.863 1094 HA SER 141 HA SER 141 13.064 7.069 7.452 1095 HB2 SER 141 HB3 SER 141 15.593 7.926 7.243 1096 HB3 SER 141 HB2 SER 141 14.263 8.704 6.387 1097 HG SER 141 HG SER 141 15.461 10.268 7.456 1098 H ARG 142 H ARG 142 13.727 5.104 7.992 1099 HA ARG 142 HA ARG 142 15.775 4.777 10.057 1100 HB2 ARG 142 HB3 ARG 142 13.465 4.559 11.073 1101 HB3 ARG 142 HB2 ARG 142 13.240 3.137 10.064 1102 HG2 ARG 142 HG3 ARG 142 14.125 1.947 11.709 1103 HG3 ARG 142 HG2 ARG 142 15.672 2.706 11.332 1104 HD2 ARG 142 HD3 ARG 142 15.112 4.535 12.898 1105 HD3 ARG 142 HD2 ARG 142 13.624 3.689 13.316 1106 HE ARG 142 HE ARG 142 15.698 1.903 13.731 1107 HH11 ARG 142 HH11 ARG 142 14.681 4.994 14.991 1108 HH12 ARG 142 HH12 ARG 142 15.367 4.723 16.557 1109 HH21 ARG 142 HH21 ARG 142 16.601 1.544 15.792 1110 HH22 ARG 142 HH22 ARG 142 16.457 2.764 17.012 1111 H THR 143 H THR 143 17.295 3.387 9.417 1112 HA THR 143 HA THR 143 16.724 1.695 7.093 1113 HB THR 143 HB THR 143 19.418 2.332 8.298 1114 HG1 THR 143 HG1 THR 143 18.464 4.247 7.602 1115 HG21 THR 143 HG21 THR 143 18.704 0.521 6.303 1116 HG22 THR 143 HG22 THR 143 20.321 1.101 6.703 1117 HG23 THR 143 HG23 THR 143 19.373 1.920 5.462 1118 H VAL 144 H VAL 144 15.995 -0.250 7.670 1119 HA VAL 144 HA VAL 144 17.152 -1.596 10.001 1120 HB VAL 144 HB VAL 144 14.815 -2.512 8.323 1121 HG11 VAL 144 HG11 VAL 144 14.270 -3.821 10.356 1122 HG12 VAL 144 HG12 VAL 144 15.790 -3.284 11.069 1123 HG13 VAL 144 HG13 VAL 144 15.803 -4.285 9.618 1124 HG21 VAL 144 HG21 VAL 144 14.469 -0.256 9.363 1125 HG22 VAL 144 HG22 VAL 144 14.675 -1.023 10.938 1126 HG23 VAL 144 HG23 VAL 144 13.336 -1.499 9.895 1127 H GLU 145 H GLU 145 18.533 -3.254 9.806 1128 HA GLU 145 HA GLU 145 18.825 -4.502 7.153 1129 HB2 GLU 145 HB3 GLU 145 21.285 -4.813 7.901 1130 HB3 GLU 145 HB2 GLU 145 20.772 -3.242 7.301 1131 HG2 GLU 145 HG3 GLU 145 20.832 -2.273 9.394 1132 HG3 GLU 145 HG2 GLU 145 20.705 -3.822 10.227 1133 H ASP 146 H ASP 146 19.243 -6.684 7.072 1134 HA ASP 146 HA ASP 146 18.933 -8.137 9.617 1135 HB2 ASP 146 HB3 ASP 146 17.697 -8.501 6.943 1136 HB3 ASP 146 HB2 ASP 146 18.152 -9.970 7.801 1137 H THR 147 H THR 147 19.596 -10.651 8.940 1138 HA THR 147 HA THR 147 22.384 -10.640 8.910 1139 HB THR 147 HB THR 147 22.247 -12.992 8.892 1140 HG1 THR 147 HG1 THR 147 20.543 -14.121 8.033 1141 HG21 THR 147 HG21 THR 147 20.708 -13.560 10.532 1142 HG22 THR 147 HG22 THR 147 19.540 -12.359 9.980 1143 HG23 THR 147 HG23 THR 147 21.012 -11.845 10.804 1144 H ASN 148 H ASN 148 20.047 -11.283 6.330 1145 HA ASN 148 HA ASN 148 22.091 -11.740 4.362 1146 HB2 ASN 148 HB3 ASN 148 19.278 -12.144 4.549 1147 HB3 ASN 148 HB2 ASN 148 19.584 -11.148 3.129 1148 HD21 ASN 148 HD21 ASN 148 18.753 -14.001 3.523 1149 HD22 ASN 148 HD22 ASN 148 19.853 -14.911 2.551 1150 HA PRO 149 HA PRO 149 22.911 -7.495 3.348 1151 HB2 PRO 149 HB3 PRO 149 23.481 -8.493 0.622 1152 HB3 PRO 149 HB2 PRO 149 24.532 -7.621 1.743 1153 HG2 PRO 149 HG3 PRO 149 24.890 -10.224 1.246 1154 HG3 PRO 149 HG2 PRO 149 25.155 -9.544 2.861 1155 HD2 PRO 149 HD3 PRO 149 22.833 -11.119 1.827 1156 HD3 PRO 149 HD2 PRO 149 23.638 -11.199 3.408 1157 H ALA 150 H ALA 150 20.946 -9.513 1.243 1158 HA ALA 150 HA ALA 150 19.768 -7.251 -0.116 1159 HB1 ALA 150 HB1 ALA 150 19.619 -10.194 -0.355 1160 HB2 ALA 150 HB2 ALA 150 19.796 -8.959 -1.601 1161 HB3 ALA 150 HB3 ALA 150 18.212 -9.277 -0.894 1162 H LEU 151 H LEU 151 19.180 -8.931 2.788 1163 HA LEU 151 HA LEU 151 16.332 -8.407 2.825 1164 HB2 LEU 151 HB3 LEU 151 18.240 -9.613 4.812 1165 HB3 LEU 151 HB2 LEU 151 16.570 -9.268 5.218 1166 HG LEU 151 HG LEU 151 17.607 -11.248 3.202 1167 HD11 LEU 151 HD11 LEU 151 16.950 -12.852 4.642 1168 HD12 LEU 151 HD12 LEU 151 15.554 -11.930 5.201 1169 HD13 LEU 151 HD13 LEU 151 17.161 -11.569 5.833 1170 HD21 LEU 151 HD21 LEU 151 15.783 -10.175 2.104 1171 HD22 LEU 151 HD22 LEU 151 14.803 -10.213 3.570 1172 HD23 LEU 151 HD23 LEU 151 15.194 -11.715 2.731 1173 H THR 152 H THR 152 18.710 -6.323 2.972 1174 HA THR 152 HA THR 152 17.984 -4.921 5.408 1175 HB THR 152 HB THR 152 19.861 -4.061 3.197 1176 HG1 THR 152 HG1 THR 152 20.870 -5.769 3.991 1177 HG21 THR 152 HG21 THR 152 19.330 -3.011 5.941 1178 HG22 THR 152 HG22 THR 152 19.500 -2.136 4.419 1179 HG23 THR 152 HG23 THR 152 20.920 -2.835 5.198 1180 H HIS 153 H HIS 153 16.348 -3.536 5.497 1181 HA HIS 153 HA HIS 153 15.549 -2.146 3.025 1182 HB2 HIS 153 HB3 HIS 153 13.446 -2.641 5.049 1183 HB3 HIS 153 HB2 HIS 153 13.348 -2.667 3.292 1184 HD1 HIS 153 HD1 HIS 153 12.570 -4.858 5.737 1185 HD2 HIS 153 HD2 HIS 153 15.297 -5.154 2.616 1186 HE1 HIS 153 HE1 HIS 153 12.921 -7.323 5.381 1187 HE2 HIS 153 HE2 HIS 153 14.514 -7.478 3.437 1188 H THR 154 H THR 154 14.331 -0.130 3.409 1189 HA THR 154 HA THR 154 15.061 1.156 5.952 1190 HB THR 154 HB THR 154 15.238 2.467 3.235 1191 HG1 THR 154 HG1 THR 154 17.281 1.474 4.930 1192 HG21 THR 154 HG21 THR 154 16.592 3.533 5.645 1193 HG22 THR 154 HG22 THR 154 14.860 3.813 5.465 1194 HG23 THR 154 HG23 THR 154 15.978 4.373 4.221 1195 H TYR 155 H TYR 155 13.356 1.958 6.963 1196 HA TYR 155 HA TYR 155 10.855 2.318 5.508 1197 HB2 TYR 155 HB3 TYR 155 11.625 1.910 8.345 1198 HB3 TYR 155 HB2 TYR 155 10.192 2.891 8.055 1199 HD1 TYR 155 HD1 TYR 155 8.493 1.821 6.305 1200 HD2 TYR 155 HD2 TYR 155 11.347 -0.364 8.580 1201 HE1 TYR 155 HE1 TYR 155 7.152 -0.220 6.016 1202 HE2 TYR 155 HE2 TYR 155 10.015 -2.412 8.296 1203 HH TYR 155 HH TYR 155 6.827 -2.383 7.121 1204 H GLU 156 H GLU 156 10.447 4.242 4.650 1205 HA GLU 156 HA GLU 156 11.424 6.638 6.059 1206 HB2 GLU 156 HB3 GLU 156 11.006 6.167 3.106 1207 HB3 GLU 156 HB2 GLU 156 11.344 7.744 3.805 1208 HG2 GLU 156 HG3 GLU 156 13.504 7.090 4.486 1209 HG3 GLU 156 HG2 GLU 156 13.162 5.387 4.187 1210 H VAL 157 H VAL 157 10.056 8.311 6.430 1211 HA VAL 157 HA VAL 157 7.227 7.863 5.759 1212 HB VAL 157 HB VAL 157 8.256 9.542 8.045 1213 HG11 VAL 157 HG11 VAL 157 5.962 9.995 7.102 1214 HG12 VAL 157 HG12 VAL 157 6.003 9.565 8.812 1215 HG13 VAL 157 HG13 VAL 157 5.514 8.368 7.613 1216 HG21 VAL 157 HG21 VAL 157 7.141 6.748 8.214 1217 HG22 VAL 157 HG22 VAL 157 7.802 7.724 9.526 1218 HG23 VAL 157 HG23 VAL 157 8.864 7.122 8.253 1219 H TRP 158 H TRP 158 5.985 9.580 5.119 1220 HA TRP 158 HA TRP 158 7.286 12.131 4.525 1221 HB2 TRP 158 HB3 TRP 158 5.962 10.466 2.381 1222 HB3 TRP 158 HB2 TRP 158 6.522 12.121 2.175 1223 HD1 TRP 158 HD1 TRP 158 7.967 8.615 2.961 1224 HE1 TRP 158 HE1 TRP 158 10.372 8.524 2.047 1225 HE3 TRP 158 HE3 TRP 158 8.412 13.451 1.362 1226 HZ2 TRP 158 HZ2 TRP 158 12.213 10.272 0.811 1227 HZ3 TRP 158 HZ3 TRP 158 10.527 14.161 0.325 1228 HH2 TRP 158 HH2 TRP 158 12.388 12.603 0.056 1229 H GLN 159 H GLN 159 5.975 13.859 4.617 1230 HA GLN 159 HA GLN 159 3.075 13.456 4.594 1231 HB2 GLN 159 HB3 GLN 159 4.702 14.203 6.915 1232 HB3 GLN 159 HB2 GLN 159 3.381 15.319 6.600 1233 HG2 GLN 159 HG3 GLN 159 1.908 13.222 6.474 1234 HG3 GLN 159 HG2 GLN 159 3.259 12.403 7.256 1235 HE21 GLN 159 HE21 GLN 159 1.280 12.173 8.765 1236 HE22 GLN 159 HE22 GLN 159 1.182 13.343 10.032 1237 H LYS 160 H LYS 160 2.023 15.016 3.504 1238 HA LYS 160 HA LYS 160 3.388 16.920 1.992 1239 HB2 LYS 160 HB3 LYS 160 0.827 15.933 2.060 1240 HB3 LYS 160 HB2 LYS 160 0.592 17.595 2.582 1241 HG2 LYS 160 HG3 LYS 160 2.274 17.122 0.185 1242 HG3 LYS 160 HG2 LYS 160 0.530 16.902 0.036 1243 HD2 LYS 160 HD3 LYS 160 1.530 19.363 1.376 1244 HD3 LYS 160 HD2 LYS 160 1.676 19.251 -0.380 1245 HE2 LYS 160 HE3 LYS 160 -0.426 20.344 0.451 1246 HE3 LYS 160 HE2 LYS 160 -0.669 18.983 -0.643 1247 HZ1 LYS 160 HZ1 LYS 160 -1.081 17.572 1.291 1248 HZ2 LYS 160 HZ2 LYS 160 -2.180 18.856 1.218 1249 HZ3 LYS 160 HZ3 LYS 160 -0.895 18.905 2.318 1250 H LYS 161 H LYS 161 3.788 19.078 2.218 1251 HA LYS 161 HA LYS 161 3.912 20.103 4.893 1252 HB2 LYS 161 HB3 LYS 161 4.603 21.290 2.206 1253 HB3 LYS 161 HB2 LYS 161 4.790 22.172 3.715 1254 HG2 LYS 161 HG3 LYS 161 6.345 20.467 4.521 1255 HG3 LYS 161 HG2 LYS 161 6.160 19.587 3.002 1256 HD2 LYS 161 HD3 LYS 161 7.950 20.767 2.336 1257 HD3 LYS 161 HD2 LYS 161 6.801 22.089 2.123 1258 HE2 LYS 161 HE3 LYS 161 8.617 21.561 4.462 1259 HE3 LYS 161 HE2 LYS 161 8.607 22.959 3.387 1260 HZ1 LYS 161 HZ1 LYS 161 6.647 22.252 5.487 1261 HZ2 LYS 161 HZ2 LYS 161 6.286 23.371 4.272 1262 HZ3 LYS 161 HZ3 LYS 161 7.564 23.667 5.339 1263 H ALA 162 H ALA 162 2.807 21.846 5.772 1264 HA ALA 162 HA ALA 162 1.019 23.189 6.192 1265 HB1 ALA 162 HB1 ALA 162 -0.026 24.064 3.852 1266 HB2 ALA 162 HB2 ALA 162 1.591 23.582 3.336 1267 HB3 ALA 162 HB3 ALA 162 1.394 24.764 4.630 1268 H51A NDP 170 H51A NDP 170 -5.618 -1.119 -9.122 1269 H52A NDP 170 H52A NDP 170 -6.284 -2.627 -8.488 1270 H4B NDP 170 H4B NDP 170 -7.489 -2.900 -10.722 1271 H3B NDP 170 H3B NDP 170 -6.381 -0.128 -11.193 1272 HO3A NDP 170 HO3A NDP 170 -5.530 -1.920 -12.374 1273 H2B NDP 170 H2B NDP 170 -8.461 0.431 -12.242 1274 H1B NDP 170 H1B NDP 170 -10.071 -0.661 -10.296 1275 H8A NDP 170 H8A NDP 170 -6.765 0.808 -9.061 1276 H61A NDP 170 H61A NDP 170 -10.063 5.958 -7.999 1277 H62A NDP 170 H62A NDP 170 -8.485 5.214 -7.872 1278 H2A NDP 170 H2A NDP 170 -12.729 3.000 -10.067 1279 H51N NDP 170 H51N NDP 170 -1.273 -4.699 -7.936 1280 H52N NDP 170 H52N NDP 170 -0.487 -3.757 -9.214 1281 H4D NDP 170 H4D NDP 170 1.069 -5.690 -9.616 1282 H3D NDP 170 H3D NDP 170 -0.388 -6.927 -7.268 1283 HO3N NDP 170 HO3N NDP 170 -0.854 -8.141 -8.976 1284 H2D NDP 170 H2D NDP 170 1.717 -7.872 -6.612 1285 HO2N NDP 170 HO2N NDP 170 3.311 -6.909 -8.609 1286 H1D NDP 170 H1D NDP 170 3.193 -5.567 -7.033 1287 H2N NDP 170 H2N NDP 170 3.651 -5.412 -4.678 1288 H71N NDP 170 H71N NDP 170 5.387 -4.830 -2.034 1289 H72N NDP 170 H72N NDP 170 4.977 -5.537 -3.576 1290 H41N NDP 170 H41N NDP 170 0.569 -3.957 -2.610 1291 H42N NDP 170 H42N NDP 170 0.505 -5.718 -2.257 1292 H5N NDP 170 H5N NDP 170 -1.245 -5.061 -3.906 1293 H6N NDP 170 H6N NDP 170 -0.433 -5.566 -6.218 Start of MODEL 10 1 H1 THR 1 HT1 THR 1 -4.348 10.170 5.558 2 H2 THR 1 HT2 THR 1 -4.963 8.661 6.098 3 H3 THR 1 HT3 THR 1 -5.967 9.730 5.208 4 HA THR 1 HA THR 1 -5.070 7.809 3.969 5 HB THR 1 HB THR 1 -4.535 9.248 2.004 6 HG1 THR 1 HG1 THR 1 -4.702 11.364 3.884 7 HG21 THR 1 HG21 THR 1 -6.910 8.911 2.887 8 HG22 THR 1 HG22 THR 1 -6.618 10.242 1.767 9 HG23 THR 1 HG23 THR 1 -6.769 10.560 3.495 10 H ALA 2 H ALA 2 -3.355 6.517 3.987 11 HA ALA 2 HA ALA 2 -0.677 7.727 3.856 12 HB1 ALA 2 HB1 ALA 2 -1.508 6.709 6.158 13 HB2 ALA 2 HB2 ALA 2 0.159 6.537 5.608 14 HB3 ALA 2 HB3 ALA 2 -0.983 5.209 5.395 15 H PHE 3 H PHE 3 0.966 6.338 2.949 16 HA PHE 3 HA PHE 3 -0.141 4.253 1.179 17 HB2 PHE 3 HB3 PHE 3 1.653 6.538 0.645 18 HB3 PHE 3 HB2 PHE 3 2.129 5.017 -0.098 19 HD1 PHE 3 HD1 PHE 3 -1.359 6.073 0.493 20 HD2 PHE 3 HD2 PHE 3 1.776 5.609 -2.347 21 HE1 PHE 3 HE1 PHE 3 -2.960 6.468 -1.333 22 HE2 PHE 3 HE2 PHE 3 0.182 6.002 -4.177 23 HZ PHE 3 HZ PHE 3 -2.188 6.432 -3.673 24 H LEU 4 H LEU 4 0.560 2.284 1.747 25 HA LEU 4 HA LEU 4 3.317 2.035 2.749 26 HB2 LEU 4 HB3 LEU 4 1.646 1.783 4.552 27 HB3 LEU 4 HB2 LEU 4 0.921 0.453 3.669 28 HG LEU 4 HG LEU 4 2.926 -0.882 3.941 29 HD11 LEU 4 HD11 LEU 4 4.036 1.684 4.959 30 HD12 LEU 4 HD12 LEU 4 4.769 0.473 3.907 31 HD13 LEU 4 HD13 LEU 4 4.635 0.171 5.639 32 HD21 LEU 4 HD21 LEU 4 2.435 0.253 6.656 33 HD22 LEU 4 HD22 LEU 4 2.603 -1.430 6.154 34 HD23 LEU 4 HD23 LEU 4 1.123 -0.541 5.786 35 H TRP 5 H TRP 5 4.499 0.954 1.313 36 HA TRP 5 HA TRP 5 3.565 -1.590 0.327 37 HB2 TRP 5 HB3 TRP 5 3.512 -1.156 -1.957 38 HB3 TRP 5 HB2 TRP 5 2.750 0.276 -1.278 39 HD1 TRP 5 HD1 TRP 5 5.923 -0.862 -3.077 40 HE1 TRP 5 HE1 TRP 5 7.168 1.217 -3.944 41 HE3 TRP 5 HE3 TRP 5 3.122 2.754 -0.811 42 HZ2 TRP 5 HZ2 TRP 5 6.983 4.025 -3.700 43 HZ3 TRP 5 HZ3 TRP 5 3.719 5.116 -1.179 44 HH2 TRP 5 HH2 TRP 5 5.610 5.735 -2.593 45 H ALA 6 H ALA 6 5.244 -2.847 -0.709 46 HA ALA 6 HA ALA 6 7.903 -2.052 0.247 47 HB1 ALA 6 HB1 ALA 6 6.594 -4.679 -0.285 48 HB2 ALA 6 HB2 ALA 6 7.492 -4.135 1.132 49 HB3 ALA 6 HB3 ALA 6 8.352 -4.560 -0.348 50 H GLN 7 H GLN 7 9.734 -2.151 -1.095 51 HA GLN 7 HA GLN 7 9.360 -2.732 -3.916 52 HB2 GLN 7 HB3 GLN 7 10.385 -0.504 -4.543 53 HB3 GLN 7 HB2 GLN 7 8.726 -0.450 -3.964 54 HG2 GLN 7 HG3 GLN 7 10.424 -0.155 -1.721 55 HG3 GLN 7 HG2 GLN 7 11.003 0.931 -2.983 56 HE21 GLN 7 HE21 GLN 7 8.305 0.094 -0.933 57 HE22 GLN 7 HE22 GLN 7 7.446 1.580 -1.123 58 H ASP 8 H ASP 8 11.403 -2.680 -5.141 59 HA ASP 8 HA ASP 8 13.585 -3.609 -3.442 60 HB2 ASP 8 HB3 ASP 8 14.520 -4.611 -5.424 61 HB3 ASP 8 HB2 ASP 8 12.807 -5.004 -5.359 62 H ARG 9 H ARG 9 15.768 -3.153 -5.058 63 HA ARG 9 HA ARG 9 16.533 -0.583 -4.287 64 HB2 ARG 9 HB3 ARG 9 17.728 -2.832 -5.623 65 HB3 ARG 9 HB2 ARG 9 18.225 -1.338 -6.404 66 HG2 ARG 9 HG3 ARG 9 18.374 -1.648 -3.430 67 HG3 ARG 9 HG2 ARG 9 19.653 -2.255 -4.483 68 HD2 ARG 9 HD3 ARG 9 20.465 -0.206 -4.838 69 HD3 ARG 9 HD2 ARG 9 18.863 0.459 -5.153 70 HE ARG 9 HE ARG 9 18.892 0.169 -2.465 71 HH11 ARG 9 HH11 ARG 9 21.065 1.703 -4.724 72 HH12 ARG 9 HH12 ARG 9 21.594 2.903 -3.592 73 HH21 ARG 9 HH21 ARG 9 19.584 1.748 -0.976 74 HH22 ARG 9 HH22 ARG 9 20.754 2.928 -1.465 75 H ASP 10 H ASP 10 15.086 -1.684 -7.282 76 HA ASP 10 HA ASP 10 15.656 0.838 -8.611 77 HB2 ASP 10 HB3 ASP 10 14.533 -1.791 -9.413 78 HB3 ASP 10 HB2 ASP 10 13.970 -0.386 -10.312 79 H GLY 11 H GLY 11 13.001 -0.822 -7.086 80 HA2 GLY 11 HA3 GLY 11 11.437 0.858 -5.983 81 HA3 GLY 11 HA2 GLY 11 11.258 1.503 -7.607 82 H LEU 12 H LEU 12 11.607 -1.829 -7.750 83 HA LEU 12 HA LEU 12 9.165 -2.396 -8.863 84 HB2 LEU 12 HB3 LEU 12 11.362 -3.834 -8.447 85 HB3 LEU 12 HB2 LEU 12 10.420 -4.460 -7.111 86 HG LEU 12 HG LEU 12 8.684 -5.233 -8.677 87 HD11 LEU 12 HD11 LEU 12 10.542 -4.156 -10.798 88 HD12 LEU 12 HD12 LEU 12 8.929 -3.555 -10.412 89 HD13 LEU 12 HD13 LEU 12 9.128 -5.168 -11.095 90 HD21 LEU 12 HD21 LEU 12 11.004 -6.427 -8.135 91 HD22 LEU 12 HD22 LEU 12 11.172 -6.285 -9.885 92 HD23 LEU 12 HD23 LEU 12 9.790 -7.139 -9.198 93 H ILE 13 H ILE 13 7.620 -4.121 -7.794 94 HA ILE 13 HA ILE 13 7.086 -3.688 -5.010 95 HB ILE 13 HB ILE 13 4.844 -2.841 -5.208 96 HG12 ILE 13 HG13 ILE 13 5.058 -2.162 -8.088 97 HG13 ILE 13 HG12 ILE 13 4.744 -3.851 -7.714 98 HG21 ILE 13 HG21 ILE 13 5.303 -0.585 -5.829 99 HG22 ILE 13 HG22 ILE 13 6.633 -1.085 -6.873 100 HG23 ILE 13 HG23 ILE 13 6.770 -1.263 -5.123 101 HD11 ILE 13 HD11 ILE 13 3.101 -1.535 -6.730 102 HD12 ILE 13 HD12 ILE 13 2.768 -3.248 -6.470 103 HD13 ILE 13 HD13 ILE 13 2.695 -2.570 -8.098 104 H GLY 14 H GLY 14 6.229 -5.078 -8.097 105 HA2 GLY 14 HA3 GLY 14 5.694 -7.617 -6.835 106 HA3 GLY 14 HA2 GLY 14 4.298 -6.878 -7.604 107 H LYS 15 H LYS 15 4.785 -9.152 -8.632 108 HA LYS 15 HA LYS 15 6.001 -8.584 -11.224 109 HB2 LYS 15 HB3 LYS 15 6.784 -11.107 -11.086 110 HB3 LYS 15 HB2 LYS 15 7.794 -9.809 -10.468 111 HG2 LYS 15 HG3 LYS 15 7.828 -11.516 -8.845 112 HG3 LYS 15 HG2 LYS 15 6.785 -10.245 -8.205 113 HD2 LYS 15 HD3 LYS 15 5.695 -12.312 -7.777 114 HD3 LYS 15 HD2 LYS 15 4.828 -11.547 -9.110 115 HE2 LYS 15 HE3 LYS 15 5.108 -13.869 -9.627 116 HE3 LYS 15 HE2 LYS 15 6.160 -12.935 -10.688 117 HZ1 LYS 15 HZ1 LYS 15 7.300 -13.894 -8.177 118 HZ2 LYS 15 HZ2 LYS 15 8.021 -13.731 -9.698 119 HZ3 LYS 15 HZ3 LYS 15 7.007 -15.047 -9.380 120 H ASP 16 H ASP 16 3.438 -8.363 -11.031 121 HA ASP 16 HA ASP 16 1.538 -9.054 -12.114 122 HB2 ASP 16 HB3 ASP 16 3.182 -10.491 -13.514 123 HB3 ASP 16 HB2 ASP 16 2.672 -11.819 -12.476 124 H GLY 17 H GLY 17 1.431 -8.873 -9.540 125 HA2 GLY 17 HA3 GLY 17 -0.641 -10.273 -8.581 126 HA3 GLY 17 HA2 GLY 17 0.691 -11.377 -8.274 127 H HIS 18 H HIS 18 2.663 -10.152 -7.235 128 HA HIS 18 HA HIS 18 2.193 -7.921 -5.578 129 HB2 HIS 18 HB3 HIS 18 2.023 -8.988 -3.395 130 HB3 HIS 18 HB2 HIS 18 0.687 -9.505 -4.417 131 HD1 HIS 18 HD1 HIS 18 4.038 -10.781 -3.183 132 HD2 HIS 18 HD2 HIS 18 0.425 -12.206 -4.660 133 HE1 HIS 18 HE1 HIS 18 4.157 -13.282 -2.952 134 HE2 HIS 18 HE2 HIS 18 1.924 -14.116 -3.767 135 H LEU 19 H LEU 19 3.871 -8.375 -3.463 136 HA LEU 19 HA LEU 19 6.412 -8.224 -4.681 137 HB2 LEU 19 HB3 LEU 19 7.277 -8.251 -2.339 138 HB3 LEU 19 HB2 LEU 19 6.061 -7.029 -2.659 139 HG LEU 19 HG LEU 19 4.494 -9.027 -1.718 140 HD11 LEU 19 HD11 LEU 19 5.821 -10.637 -0.894 141 HD12 LEU 19 HD12 LEU 19 6.030 -9.529 0.462 142 HD13 LEU 19 HD13 LEU 19 7.232 -9.583 -0.827 143 HD21 LEU 19 HD21 LEU 19 5.746 -6.614 -0.604 144 HD22 LEU 19 HD22 LEU 19 5.125 -7.753 0.590 145 HD23 LEU 19 HD23 LEU 19 4.051 -7.100 -0.647 146 HA PRO 20 HA PRO 20 7.105 -12.661 -4.765 147 HB2 PRO 20 HB3 PRO 20 9.253 -12.661 -6.344 148 HB3 PRO 20 HB2 PRO 20 7.655 -12.245 -6.976 149 HG2 PRO 20 HG3 PRO 20 9.909 -10.440 -6.186 150 HG3 PRO 20 HG2 PRO 20 8.841 -10.341 -7.597 151 HD2 PRO 20 HD3 PRO 20 8.517 -8.870 -5.286 152 HD3 PRO 20 HD2 PRO 20 7.212 -9.245 -6.429 153 H TRP 21 H TRP 21 8.803 -10.391 -3.038 154 HA TRP 21 HA TRP 21 10.989 -12.210 -2.340 155 HB2 TRP 21 HB3 TRP 21 11.810 -10.205 -1.009 156 HB3 TRP 21 HB2 TRP 21 11.790 -10.019 -2.760 157 HD1 TRP 21 HD1 TRP 21 9.406 -9.179 0.194 158 HE1 TRP 21 HE1 TRP 21 8.307 -6.907 -0.304 159 HE3 TRP 21 HE3 TRP 21 11.479 -8.269 -4.388 160 HZ2 TRP 21 HZ2 TRP 21 8.320 -4.981 -2.372 161 HZ3 TRP 21 HZ3 TRP 21 10.884 -6.190 -5.560 162 HH2 TRP 21 HH2 TRP 21 9.336 -4.582 -4.573 163 H HIS 22 H HIS 22 11.229 -13.111 -0.351 164 HA HIS 22 HA HIS 22 8.883 -13.163 1.341 165 HB2 HIS 22 HB3 HIS 22 10.478 -15.141 0.682 166 HB3 HIS 22 HB2 HIS 22 11.448 -14.554 2.028 167 HD1 HIS 22 HD1 HIS 22 7.681 -14.606 2.059 168 HD2 HIS 22 HD2 HIS 22 10.887 -16.642 3.745 169 HE1 HIS 22 HE1 HIS 22 6.680 -16.099 3.818 170 HE2 HIS 22 HE2 HIS 22 8.629 -17.388 4.760 171 H LEU 23 H LEU 23 8.736 -11.224 2.398 172 HA LEU 23 HA LEU 23 11.002 -10.488 4.131 173 HB2 LEU 23 HB3 LEU 23 9.359 -8.940 2.350 174 HB3 LEU 23 HB2 LEU 23 9.174 -8.343 3.989 175 HG LEU 23 HG LEU 23 11.782 -8.372 4.019 176 HD11 LEU 23 HD11 LEU 23 12.824 -8.023 1.884 177 HD12 LEU 23 HD12 LEU 23 11.271 -8.152 1.059 178 HD13 LEU 23 HD13 LEU 23 11.966 -9.564 1.855 179 HD21 LEU 23 HD21 LEU 23 11.749 -6.088 2.894 180 HD22 LEU 23 HD22 LEU 23 10.658 -6.324 4.259 181 HD23 LEU 23 HD23 LEU 23 10.032 -6.377 2.611 182 HA PRO 24 HA PRO 24 7.812 -12.186 7.032 183 HB2 PRO 24 HB3 PRO 24 10.264 -12.049 8.717 184 HB3 PRO 24 HB2 PRO 24 9.075 -13.348 8.562 185 HG2 PRO 24 HG3 PRO 24 11.467 -13.555 7.413 186 HG3 PRO 24 HG2 PRO 24 10.009 -14.148 6.596 187 HD2 PRO 24 HD3 PRO 24 11.596 -11.672 6.086 188 HD3 PRO 24 HD2 PRO 24 10.757 -12.734 4.937 189 H ASP 25 H ASP 25 10.266 -9.683 7.560 190 HA ASP 25 HA ASP 25 9.001 -8.494 9.791 191 HB2 ASP 25 HB3 ASP 25 10.503 -6.520 9.119 192 HB3 ASP 25 HB2 ASP 25 11.287 -8.021 9.581 193 H ASP 26 H ASP 26 8.970 -7.758 6.318 194 HA ASP 26 HA ASP 26 7.496 -5.393 6.425 195 HB2 ASP 26 HB3 ASP 26 8.676 -6.492 4.417 196 HB3 ASP 26 HB2 ASP 26 7.182 -7.399 4.203 197 H LEU 27 H LEU 27 6.428 -8.752 6.404 198 HA LEU 27 HA LEU 27 3.660 -8.187 6.114 199 HB2 LEU 27 HB3 LEU 27 4.774 -10.613 7.494 200 HB3 LEU 27 HB2 LEU 27 3.283 -10.469 6.585 201 HG LEU 27 HG LEU 27 5.771 -9.969 5.065 202 HD11 LEU 27 HD11 LEU 27 5.852 -12.104 6.744 203 HD12 LEU 27 HD12 LEU 27 6.697 -12.004 5.199 204 HD13 LEU 27 HD13 LEU 27 5.136 -12.819 5.299 205 HD21 LEU 27 HD21 LEU 27 4.469 -11.473 3.468 206 HD22 LEU 27 HD22 LEU 27 3.784 -9.888 3.827 207 HD23 LEU 27 HD23 LEU 27 3.134 -11.327 4.610 208 H HIS 28 H HIS 28 5.567 -9.184 8.957 209 HA HIS 28 HA HIS 28 3.558 -8.881 10.861 210 HB2 HIS 28 HB3 HIS 28 6.554 -8.781 10.993 211 HB3 HIS 28 HB2 HIS 28 5.598 -8.423 12.427 212 HD1 HIS 28 HD1 HIS 28 5.954 -11.220 9.874 213 HD2 HIS 28 HD2 HIS 28 4.918 -10.624 13.854 214 HE1 HIS 28 HE1 HIS 28 5.619 -13.520 10.834 215 HE2 HIS 28 HE2 HIS 28 5.084 -13.137 13.265 216 H TYR 29 H TYR 29 6.004 -6.535 9.781 217 HA TYR 29 HA TYR 29 5.268 -4.435 11.482 218 HB2 TYR 29 HB3 TYR 29 7.297 -4.723 9.824 219 HB3 TYR 29 HB2 TYR 29 6.238 -3.868 8.707 220 HD1 TYR 29 HD2 TYR 29 5.493 -1.557 9.239 221 HD2 TYR 29 HD1 TYR 29 8.377 -3.586 11.620 222 HE1 TYR 29 HE2 TYR 29 6.178 0.588 10.227 223 HE2 TYR 29 HE1 TYR 29 9.069 -1.447 12.615 224 HH TYR 29 HH TYR 29 9.007 0.919 12.122 225 H PHE 30 H PHE 30 3.939 -5.536 8.442 226 HA PHE 30 HA PHE 30 2.326 -3.235 7.952 227 HB2 PHE 30 HB3 PHE 30 2.893 -4.630 6.088 228 HB3 PHE 30 HB2 PHE 30 2.245 -6.060 6.882 229 HD1 PHE 30 HD1 PHE 30 1.197 -2.724 5.603 230 HD2 PHE 30 HD2 PHE 30 0.103 -6.759 6.392 231 HE1 PHE 30 HE1 PHE 30 -0.970 -2.347 4.500 232 HE2 PHE 30 HE2 PHE 30 -2.065 -6.391 5.290 233 HZ PHE 30 HZ PHE 30 -2.604 -4.183 4.342 234 H ARG 31 H ARG 31 1.391 -6.555 8.874 235 HA ARG 31 HA ARG 31 -1.248 -5.931 9.559 236 HB2 ARG 31 HB3 ARG 31 0.171 -8.231 9.332 237 HB3 ARG 31 HB2 ARG 31 0.028 -8.117 11.081 238 HG2 ARG 31 HG3 ARG 31 -2.523 -7.556 10.080 239 HG3 ARG 31 HG2 ARG 31 -1.924 -8.922 9.136 240 HD2 ARG 31 HD3 ARG 31 -3.007 -9.871 10.998 241 HD3 ARG 31 HD2 ARG 31 -1.283 -9.984 11.348 242 HE ARG 31 HE ARG 31 -2.528 -7.620 12.408 243 HH11 ARG 31 HH11 ARG 31 -1.817 -10.986 12.993 244 HH12 ARG 31 HH12 ARG 31 -1.914 -10.837 14.715 245 HH21 ARG 31 HH21 ARG 31 -2.656 -7.421 14.673 246 HH22 ARG 31 HH22 ARG 31 -2.392 -8.813 15.670 247 H ALA 32 H ALA 32 1.719 -5.631 11.358 248 HA ALA 32 HA ALA 32 0.537 -5.402 13.938 249 HB1 ALA 32 HB1 ALA 32 2.843 -6.035 13.758 250 HB2 ALA 32 HB2 ALA 32 2.753 -4.487 14.598 251 HB3 ALA 32 HB3 ALA 32 3.233 -4.543 12.902 252 H GLN 33 H GLN 33 1.352 -3.117 11.395 253 HA GLN 33 HA GLN 33 0.685 -0.838 13.065 254 HB2 GLN 33 HB3 GLN 33 2.155 -1.271 10.625 255 HB3 GLN 33 HB2 GLN 33 0.959 -0.005 10.388 256 HG2 GLN 33 HG3 GLN 33 2.059 0.659 12.807 257 HG3 GLN 33 HG2 GLN 33 3.437 0.018 11.915 258 HE21 GLN 33 HE21 GLN 33 4.550 1.564 10.983 259 HE22 GLN 33 HE22 GLN 33 3.908 2.987 10.244 260 H THR 34 H THR 34 -0.807 -2.848 10.661 261 HA THR 34 HA THR 34 -3.004 -0.973 10.267 262 HB THR 34 HB THR 34 -3.843 -2.705 8.672 263 HG1 THR 34 HG1 THR 34 -1.367 -3.986 9.146 264 HG21 THR 34 HG21 THR 34 -2.233 -0.874 7.992 265 HG22 THR 34 HG22 THR 34 -2.323 -2.289 6.942 266 HG23 THR 34 HG23 THR 34 -0.972 -2.105 8.061 267 H VAL 35 H VAL 35 -2.664 -2.061 12.902 268 HA VAL 35 HA VAL 35 -4.789 -4.037 13.180 269 HB VAL 35 HB VAL 35 -3.195 -2.764 15.403 270 HG11 VAL 35 HG11 VAL 35 -3.774 -5.233 16.253 271 HG12 VAL 35 HG12 VAL 35 -5.153 -4.970 15.184 272 HG13 VAL 35 HG13 VAL 35 -4.842 -3.854 16.514 273 HG21 VAL 35 HG21 VAL 35 -2.562 -5.383 14.059 274 HG22 VAL 35 HG22 VAL 35 -1.609 -4.523 15.269 275 HG23 VAL 35 HG23 VAL 35 -1.765 -3.866 13.640 276 H GLY 36 H GLY 36 -6.776 -3.184 13.021 277 HA2 GLY 36 HA3 GLY 36 -8.629 -2.132 14.008 278 HA3 GLY 36 HA2 GLY 36 -7.533 -1.147 14.965 279 H LYS 37 H LYS 37 -6.845 -1.364 11.606 280 HA LYS 37 HA LYS 37 -8.124 1.251 11.152 281 HB2 LYS 37 HB3 LYS 37 -5.469 0.415 9.984 282 HB3 LYS 37 HB2 LYS 37 -6.217 2.004 9.913 283 HG2 LYS 37 HG3 LYS 37 -5.273 0.671 12.441 284 HG3 LYS 37 HG2 LYS 37 -4.350 1.860 11.521 285 HD2 LYS 37 HD3 LYS 37 -5.610 3.591 12.244 286 HD3 LYS 37 HD2 LYS 37 -7.101 2.646 12.228 287 HE2 LYS 37 HE3 LYS 37 -6.665 3.157 14.496 288 HE3 LYS 37 HE2 LYS 37 -6.229 1.463 14.279 289 HZ1 LYS 37 HZ1 LYS 37 -3.898 2.625 13.778 290 HZ2 LYS 37 HZ2 LYS 37 -4.369 2.134 15.327 291 HZ3 LYS 37 HZ3 LYS 37 -4.539 3.752 14.865 292 H ILE 38 H ILE 38 -7.878 1.691 8.589 293 HA ILE 38 HA ILE 38 -8.997 -0.708 7.297 294 HB ILE 38 HB ILE 38 -9.504 1.913 6.034 295 HG12 ILE 38 HG13 ILE 38 -11.620 1.581 7.892 296 HG13 ILE 38 HG12 ILE 38 -10.124 1.539 8.817 297 HG21 ILE 38 HG21 ILE 38 -11.552 0.910 5.409 298 HG22 ILE 38 HG22 ILE 38 -11.408 -0.329 6.653 299 HG23 ILE 38 HG23 ILE 38 -10.323 -0.346 5.264 300 HD11 ILE 38 HD11 ILE 38 -9.631 3.708 8.373 301 HD12 ILE 38 HD12 ILE 38 -11.389 3.793 8.265 302 HD13 ILE 38 HD13 ILE 38 -10.421 3.683 6.795 303 H MET 39 H MET 39 -8.389 -1.206 5.180 304 HA MET 39 HA MET 39 -6.062 0.274 4.144 305 HB2 MET 39 HB3 MET 39 -5.213 -1.759 5.098 306 HB3 MET 39 HB2 MET 39 -6.452 -2.717 4.300 307 HG2 MET 39 HG3 MET 39 -4.725 -1.136 2.521 308 HG3 MET 39 HG2 MET 39 -3.930 -2.439 3.402 309 HE1 MET 39 HE1 MET 39 -5.178 -4.590 3.795 310 HE2 MET 39 HE2 MET 39 -5.494 -5.591 2.377 311 HE3 MET 39 HE3 MET 39 -6.823 -4.754 3.181 312 H VAL 40 H VAL 40 -6.228 0.918 2.099 313 HA VAL 40 HA VAL 40 -8.546 0.077 0.542 314 HB VAL 40 HB VAL 40 -6.503 2.195 -0.135 315 HG11 VAL 40 HG11 VAL 40 -8.774 2.955 -1.356 316 HG12 VAL 40 HG12 VAL 40 -8.973 1.204 -1.407 317 HG13 VAL 40 HG13 VAL 40 -7.545 1.950 -2.124 318 HG21 VAL 40 HG21 VAL 40 -7.575 3.707 1.136 319 HG22 VAL 40 HG22 VAL 40 -8.162 2.297 2.017 320 HG23 VAL 40 HG23 VAL 40 -9.165 3.037 0.770 321 H VAL 41 H VAL 41 -8.424 -1.393 -1.029 322 HA VAL 41 HA VAL 41 -5.802 -1.890 -2.271 323 HB VAL 41 HB VAL 41 -6.913 -3.651 -0.572 324 HG11 VAL 41 HG11 VAL 41 -8.916 -3.957 -1.977 325 HG12 VAL 41 HG12 VAL 41 -8.007 -5.451 -1.749 326 HG13 VAL 41 HG13 VAL 41 -7.888 -4.571 -3.272 327 HG21 VAL 41 HG21 VAL 41 -5.040 -3.837 -2.823 328 HG22 VAL 41 HG22 VAL 41 -5.677 -5.378 -2.249 329 HG23 VAL 41 HG23 VAL 41 -4.841 -4.299 -1.132 330 H GLY 42 H GLY 42 -5.833 -2.672 -4.450 331 HA2 GLY 42 HA3 GLY 42 -7.996 -1.521 -5.991 332 HA3 GLY 42 HA2 GLY 42 -6.517 -2.223 -6.629 333 H ARG 43 H ARG 43 -8.656 -2.827 -8.040 334 HA ARG 43 HA ARG 43 -10.205 -4.995 -7.167 335 HB2 ARG 43 HB3 ARG 43 -10.302 -5.396 -9.791 336 HB3 ARG 43 HB2 ARG 43 -11.181 -4.093 -9.013 337 HG2 ARG 43 HG3 ARG 43 -9.867 -2.483 -9.920 338 HG3 ARG 43 HG2 ARG 43 -8.431 -3.507 -9.946 339 HD2 ARG 43 HD3 ARG 43 -9.087 -3.163 -12.206 340 HD3 ARG 43 HD2 ARG 43 -9.519 -4.818 -11.786 341 HE ARG 43 HE ARG 43 -11.653 -2.935 -11.402 342 HH11 ARG 43 HH11 ARG 43 -10.059 -5.022 -13.700 343 HH12 ARG 43 HH12 ARG 43 -11.456 -5.186 -14.710 344 HH21 ARG 43 HH21 ARG 43 -13.494 -3.154 -12.727 345 HH22 ARG 43 HH22 ARG 43 -13.406 -4.125 -14.158 346 H ARG 44 H ARG 44 -7.487 -5.056 -9.486 347 HA ARG 44 HA ARG 44 -7.229 -7.851 -9.513 348 HB2 ARG 44 HB3 ARG 44 -5.479 -5.561 -10.293 349 HB3 ARG 44 HB2 ARG 44 -4.761 -7.162 -10.186 350 HG2 ARG 44 HG3 ARG 44 -5.461 -6.658 -12.458 351 HG3 ARG 44 HG2 ARG 44 -6.380 -8.012 -11.796 352 HD2 ARG 44 HD3 ARG 44 -7.502 -5.282 -11.475 353 HD3 ARG 44 HD2 ARG 44 -7.546 -6.001 -13.083 354 HE ARG 44 HE ARG 44 -9.027 -6.858 -10.737 355 HH11 ARG 44 HH11 ARG 44 -8.032 -7.588 -14.006 356 HH12 ARG 44 HH12 ARG 44 -9.303 -8.733 -14.266 357 HH21 ARG 44 HH21 ARG 44 -10.694 -8.365 -11.083 358 HH22 ARG 44 HH22 ARG 44 -10.813 -9.174 -12.610 359 H THR 45 H THR 45 -6.296 -5.500 -7.195 360 HA THR 45 HA THR 45 -4.173 -6.971 -5.992 361 HB THR 45 HB THR 45 -5.637 -5.045 -4.312 362 HG1 THR 45 HG1 THR 45 -4.598 -4.349 -6.840 363 HG21 THR 45 HG21 THR 45 -2.893 -5.843 -4.826 364 HG22 THR 45 HG22 THR 45 -3.619 -5.127 -3.387 365 HG23 THR 45 HG23 THR 45 -3.101 -4.096 -4.721 366 H TYR 46 H TYR 46 -7.589 -6.429 -5.052 367 HA TYR 46 HA TYR 46 -7.556 -7.937 -2.725 368 HB2 TYR 46 HB3 TYR 46 -9.944 -8.039 -2.850 369 HB3 TYR 46 HB2 TYR 46 -9.456 -6.485 -3.511 370 HD1 TYR 46 HD2 TYR 46 -10.106 -9.963 -4.751 371 HD2 TYR 46 HD1 TYR 46 -10.584 -5.782 -5.406 372 HE1 TYR 46 HE2 TYR 46 -11.362 -10.434 -6.792 373 HE2 TYR 46 HE1 TYR 46 -11.865 -6.253 -7.447 374 HH TYR 46 HH TYR 46 -11.809 -8.728 -9.131 375 H GLU 47 H GLU 47 -7.999 -8.995 -6.065 376 HA GLU 47 HA GLU 47 -8.478 -11.734 -5.331 377 HB2 GLU 47 HB3 GLU 47 -8.698 -10.144 -7.682 378 HB3 GLU 47 HB2 GLU 47 -7.658 -11.512 -8.056 379 HG2 GLU 47 HG3 GLU 47 -10.191 -12.031 -6.603 380 HG3 GLU 47 HG2 GLU 47 -10.274 -11.636 -8.318 381 H SER 48 H SER 48 -5.723 -9.782 -5.873 382 HA SER 48 HA SER 48 -3.974 -12.046 -6.420 383 HB2 SER 48 HB3 SER 48 -2.240 -10.466 -6.806 384 HB3 SER 48 HB2 SER 48 -3.693 -9.774 -7.521 385 HG SER 48 HG SER 48 -3.831 -8.780 -5.237 386 H PHE 49 H PHE 49 -5.127 -10.330 -3.702 387 HA PHE 49 HA PHE 49 -2.838 -10.770 -2.027 388 HB2 PHE 49 HB3 PHE 49 -5.044 -9.133 -1.882 389 HB3 PHE 49 HB2 PHE 49 -5.399 -10.353 -0.663 390 HD1 PHE 49 HD1 PHE 49 -2.914 -7.828 -1.725 391 HD2 PHE 49 HD2 PHE 49 -4.283 -10.367 1.407 392 HE1 PHE 49 HE1 PHE 49 -1.421 -6.678 -0.144 393 HE2 PHE 49 HE2 PHE 49 -2.793 -9.220 2.993 394 HZ PHE 49 HZ PHE 49 -1.360 -7.373 2.218 395 HA PRO 50 HA PRO 50 -3.911 -15.011 -1.120 396 HB2 PRO 50 HB3 PRO 50 -1.920 -15.537 0.610 397 HB3 PRO 50 HB2 PRO 50 -1.632 -15.366 -1.125 398 HG2 PRO 50 HG3 PRO 50 -1.198 -13.380 1.072 399 HG3 PRO 50 HG2 PRO 50 -0.155 -13.766 -0.310 400 HD2 PRO 50 HD3 PRO 50 -1.821 -11.603 -0.236 401 HD3 PRO 50 HD2 PRO 50 -1.341 -12.418 -1.738 402 H LYS 51 H LYS 51 -3.902 -12.399 1.109 403 HA LYS 51 HA LYS 51 -5.424 -14.038 3.023 404 HB2 LYS 51 HB3 LYS 51 -3.074 -12.346 3.472 405 HB3 LYS 51 HB2 LYS 51 -4.412 -11.981 4.553 406 HG2 LYS 51 HG3 LYS 51 -3.275 -14.738 4.149 407 HG3 LYS 51 HG2 LYS 51 -2.795 -13.640 5.445 408 HD2 LYS 51 HD3 LYS 51 -4.700 -13.976 6.610 409 HD3 LYS 51 HD2 LYS 51 -5.694 -14.070 5.155 410 HE2 LYS 51 HE3 LYS 51 -3.830 -16.258 6.059 411 HE3 LYS 51 HE2 LYS 51 -5.542 -16.196 6.477 412 HZ1 LYS 51 HZ1 LYS 51 -4.793 -15.994 3.652 413 HZ2 LYS 51 HZ2 LYS 51 -6.174 -16.671 4.354 414 HZ3 LYS 51 HZ3 LYS 51 -4.708 -17.513 4.394 415 H ARG 52 H ARG 52 -7.191 -13.229 1.600 416 HA ARG 52 HA ARG 52 -8.025 -10.530 2.426 417 HB2 ARG 52 HB3 ARG 52 -9.394 -10.558 0.279 418 HB3 ARG 52 HB2 ARG 52 -7.653 -10.388 0.103 419 HG2 ARG 52 HG3 ARG 52 -7.505 -12.243 -1.107 420 HG3 ARG 52 HG2 ARG 52 -8.452 -13.166 0.061 421 HD2 ARG 52 HD3 ARG 52 -10.455 -11.832 -0.983 422 HD3 ARG 52 HD2 ARG 52 -9.351 -11.649 -2.345 423 HE ARG 52 HE ARG 52 -10.709 -14.043 -1.523 424 HH11 ARG 52 HH11 ARG 52 -7.941 -12.770 -3.226 425 HH12 ARG 52 HH12 ARG 52 -7.741 -14.181 -4.211 426 HH21 ARG 52 HH21 ARG 52 -10.447 -15.899 -2.817 427 HH22 ARG 52 HH22 ARG 52 -9.164 -15.957 -3.979 428 HA PRO 53 HA PRO 53 -9.246 -9.501 3.324 429 HB2 PRO 53 HB3 PRO 53 -10.731 -8.941 5.472 430 HB3 PRO 53 HB2 PRO 53 -11.423 -8.921 3.846 431 HG2 PRO 53 HG3 PRO 53 -11.692 -10.960 5.995 432 HG3 PRO 53 HG2 PRO 53 -12.872 -10.442 4.779 433 HD2 PRO 53 HD3 PRO 53 -11.256 -12.739 4.662 434 HD3 PRO 53 HD2 PRO 53 -12.187 -12.040 3.324 435 H LEU 54 H LEU 54 -7.927 -8.593 4.974 436 HA LEU 54 HA LEU 54 -6.324 -10.472 6.367 437 HB2 LEU 54 HB3 LEU 54 -6.454 -7.470 6.359 438 HB3 LEU 54 HB2 LEU 54 -5.340 -8.340 7.397 439 HG LEU 54 HG LEU 54 -5.312 -8.983 4.492 440 HD11 LEU 54 HD11 LEU 54 -4.017 -6.514 5.637 441 HD12 LEU 54 HD12 LEU 54 -5.414 -6.526 4.561 442 HD13 LEU 54 HD13 LEU 54 -3.856 -7.120 3.989 443 HD21 LEU 54 HD21 LEU 54 -3.552 -9.188 6.836 444 HD22 LEU 54 HD22 LEU 54 -2.750 -8.730 5.333 445 HD23 LEU 54 HD23 LEU 54 -3.682 -10.225 5.416 446 HA PRO 55 HA PRO 55 -8.591 -10.775 10.148 447 HB2 PRO 55 HB3 PRO 55 -6.659 -11.713 11.780 448 HB3 PRO 55 HB2 PRO 55 -7.377 -12.696 10.498 449 HG2 PRO 55 HG3 PRO 55 -4.786 -11.194 10.507 450 HG3 PRO 55 HG2 PRO 55 -5.129 -12.830 9.912 451 HD2 PRO 55 HD3 PRO 55 -4.950 -10.668 8.274 452 HD3 PRO 55 HD2 PRO 55 -5.992 -12.062 7.924 453 H GLU 56 H GLU 56 -8.913 -9.808 12.128 454 HA GLU 56 HA GLU 56 -8.983 -8.051 13.567 455 HB2 GLU 56 HB3 GLU 56 -6.028 -8.617 13.429 456 HB3 GLU 56 HB2 GLU 56 -6.719 -7.456 14.555 457 HG2 GLU 56 HG3 GLU 56 -8.270 -9.571 15.093 458 HG3 GLU 56 HG2 GLU 56 -6.806 -10.402 14.571 459 H ARG 57 H ARG 57 -8.819 -7.356 10.690 460 HA ARG 57 HA ARG 57 -8.237 -4.550 11.095 461 HB2 ARG 57 HB3 ARG 57 -6.610 -4.269 9.451 462 HB3 ARG 57 HB2 ARG 57 -6.109 -5.736 10.272 463 HG2 ARG 57 HG3 ARG 57 -5.833 -6.333 8.081 464 HG3 ARG 57 HG2 ARG 57 -7.464 -6.926 8.392 465 HD2 ARG 57 HD3 ARG 57 -6.947 -5.538 6.237 466 HD3 ARG 57 HD2 ARG 57 -8.450 -5.288 7.120 467 HE ARG 57 HE ARG 57 -7.775 -3.155 7.545 468 HH11 ARG 57 HH11 ARG 57 -4.953 -5.052 6.763 469 HH12 ARG 57 HH12 ARG 57 -3.879 -3.694 6.793 470 HH21 ARG 57 HH21 ARG 57 -6.368 -1.370 7.586 471 HH22 ARG 57 HH22 ARG 57 -4.683 -1.601 7.259 472 H THR 58 H THR 58 -8.904 -3.224 9.176 473 HA THR 58 HA THR 58 -11.301 -4.430 7.975 474 HB THR 58 HB THR 58 -10.705 -1.482 8.078 475 HG1 THR 58 HG1 THR 58 -10.698 -1.863 10.183 476 HG21 THR 58 HG21 THR 58 -12.581 -2.165 6.679 477 HG22 THR 58 HG22 THR 58 -13.117 -1.243 8.084 478 HG23 THR 58 HG23 THR 58 -13.304 -2.996 8.056 479 H ASN 59 H ASN 59 -11.278 -4.883 5.874 480 HA ASN 59 HA ASN 59 -9.150 -3.718 4.226 481 HB2 ASN 59 HB3 ASN 59 -10.881 -6.142 3.710 482 HB3 ASN 59 HB2 ASN 59 -9.556 -5.589 2.690 483 HD21 ASN 59 HD21 ASN 59 -10.301 -6.630 5.980 484 HD22 ASN 59 HD22 ASN 59 -8.777 -7.388 6.275 485 H VAL 60 H VAL 60 -9.534 -2.731 2.296 486 HA VAL 60 HA VAL 60 -12.342 -2.176 1.607 487 HB VAL 60 HB VAL 60 -10.022 -0.243 1.644 488 HG11 VAL 60 HG11 VAL 60 -10.938 0.653 -0.196 489 HG12 VAL 60 HG12 VAL 60 -12.179 1.251 0.906 490 HG13 VAL 60 HG13 VAL 60 -12.447 -0.239 0.002 491 HG21 VAL 60 HG21 VAL 60 -11.852 -0.864 3.593 492 HG22 VAL 60 HG22 VAL 60 -12.560 0.559 2.829 493 HG23 VAL 60 HG23 VAL 60 -10.926 0.633 3.487 494 H VAL 61 H VAL 61 -12.864 -2.467 -0.489 495 HA VAL 61 HA VAL 61 -10.678 -3.170 -2.328 496 HB VAL 61 HB VAL 61 -13.574 -4.029 -2.374 497 HG11 VAL 61 HG11 VAL 61 -13.206 -4.226 -4.584 498 HG12 VAL 61 HG12 VAL 61 -12.299 -5.666 -4.120 499 HG13 VAL 61 HG13 VAL 61 -11.453 -4.144 -4.403 500 HG21 VAL 61 HG21 VAL 61 -11.802 -4.993 -0.696 501 HG22 VAL 61 HG22 VAL 61 -11.268 -5.895 -2.114 502 HG23 VAL 61 HG23 VAL 61 -12.926 -6.062 -1.535 503 H LEU 62 H LEU 62 -10.475 -2.196 -4.256 504 HA LEU 62 HA LEU 62 -12.471 -0.154 -4.976 505 HB2 LEU 62 HB3 LEU 62 -10.136 0.601 -4.119 506 HB3 LEU 62 HB2 LEU 62 -9.567 0.080 -5.694 507 HG LEU 62 HG LEU 62 -11.248 1.654 -6.719 508 HD11 LEU 62 HD11 LEU 62 -12.828 2.396 -5.323 509 HD12 LEU 62 HD12 LEU 62 -11.606 3.542 -4.772 510 HD13 LEU 62 HD13 LEU 62 -11.863 2.036 -3.892 511 HD21 LEU 62 HD21 LEU 62 -9.893 3.684 -6.195 512 HD22 LEU 62 HD22 LEU 62 -8.943 2.276 -6.668 513 HD23 LEU 62 HD23 LEU 62 -9.049 2.737 -4.969 514 H THR 63 H THR 63 -13.577 -1.254 -6.522 515 HA THR 63 HA THR 63 -12.042 -2.091 -8.883 516 HB THR 63 HB THR 63 -12.760 -4.081 -7.598 517 HG1 THR 63 HG1 THR 63 -13.010 -4.986 -9.457 518 HG21 THR 63 HG21 THR 63 -15.576 -3.854 -8.323 519 HG22 THR 63 HG22 THR 63 -15.067 -2.737 -7.056 520 HG23 THR 63 HG23 THR 63 -14.821 -4.472 -6.854 521 H HIS 64 H HIS 64 -12.886 -1.500 -10.834 522 HA HIS 64 HA HIS 64 -14.686 0.642 -10.943 523 HB2 HIS 64 HB3 HIS 64 -13.632 -1.219 -13.065 524 HB3 HIS 64 HB2 HIS 64 -14.725 0.108 -13.443 525 HD1 HIS 64 HD1 HIS 64 -13.771 2.553 -12.598 526 HD2 HIS 64 HD2 HIS 64 -11.022 -0.520 -13.110 527 HE1 HIS 64 HE1 HIS 64 -11.531 3.680 -12.787 528 HE2 HIS 64 HE2 HIS 64 -9.887 1.804 -13.147 529 H GLN 65 H GLN 65 -15.197 -2.812 -11.256 530 HA GLN 65 HA GLN 65 -17.656 -2.931 -12.467 531 HB2 GLN 65 HB3 GLN 65 -16.389 -4.595 -10.317 532 HB3 GLN 65 HB2 GLN 65 -18.029 -4.939 -10.851 533 HG2 GLN 65 HG3 GLN 65 -17.359 -5.761 -12.839 534 HG3 GLN 65 HG2 GLN 65 -16.012 -4.632 -12.977 535 HE21 GLN 65 HE21 GLN 65 -14.403 -5.051 -11.001 536 HE22 GLN 65 HE22 GLN 65 -13.873 -6.692 -10.893 537 H GLU 66 H GLU 66 -19.648 -2.298 -11.993 538 HA GLU 66 HA GLU 66 -20.126 -0.888 -9.514 539 HB2 GLU 66 HB3 GLU 66 -22.404 -0.488 -10.560 540 HB3 GLU 66 HB2 GLU 66 -21.026 0.182 -11.420 541 HG2 GLU 66 HG3 GLU 66 -21.595 -2.478 -12.349 542 HG3 GLU 66 HG2 GLU 66 -23.034 -1.465 -12.437 543 H ASP 67 H ASP 67 -21.108 -3.873 -11.063 544 HA ASP 67 HA ASP 67 -22.914 -4.500 -8.859 545 HB2 ASP 67 HB3 ASP 67 -23.390 -4.883 -11.390 546 HB3 ASP 67 HB2 ASP 67 -22.401 -6.325 -11.182 547 H TYR 68 H TYR 68 -19.808 -4.568 -8.777 548 HA TYR 68 HA TYR 68 -19.229 -7.353 -8.360 549 HB2 TYR 68 HB3 TYR 68 -17.514 -5.652 -9.058 550 HB3 TYR 68 HB2 TYR 68 -17.597 -4.985 -7.430 551 HD1 TYR 68 HD1 TYR 68 -17.078 -8.264 -9.144 552 HD2 TYR 68 HD2 TYR 68 -16.069 -5.746 -5.867 553 HE1 TYR 68 HE1 TYR 68 -15.426 -9.920 -8.389 554 HE2 TYR 68 HE2 TYR 68 -14.411 -7.395 -5.104 555 HH TYR 68 HH TYR 68 -14.263 -10.567 -6.362 556 H GLN 69 H GLN 69 -18.881 -8.416 -6.402 557 HA GLN 69 HA GLN 69 -19.841 -7.016 -3.998 558 HB2 GLN 69 HB3 GLN 69 -20.590 -9.779 -4.955 559 HB3 GLN 69 HB2 GLN 69 -20.879 -9.218 -3.314 560 HG2 GLN 69 HG3 GLN 69 -21.972 -7.896 -5.786 561 HG3 GLN 69 HG2 GLN 69 -22.853 -9.055 -4.791 562 HE21 GLN 69 HE21 GLN 69 -21.308 -5.898 -4.789 563 HE22 GLN 69 HE22 GLN 69 -22.248 -5.232 -3.502 564 H ALA 70 H ALA 70 -18.170 -6.867 -2.669 565 HA ALA 70 HA ALA 70 -16.265 -9.102 -2.505 566 HB1 ALA 70 HB1 ALA 70 -14.602 -7.607 -1.865 567 HB2 ALA 70 HB2 ALA 70 -15.763 -6.383 -1.351 568 HB3 ALA 70 HB3 ALA 70 -15.517 -6.699 -3.068 569 H GLN 71 H GLN 71 -17.219 -10.443 -1.045 570 HA GLN 71 HA GLN 71 -18.469 -9.550 1.348 571 HB2 GLN 71 HB3 GLN 71 -17.510 -12.276 0.471 572 HB3 GLN 71 HB2 GLN 71 -18.390 -11.987 1.966 573 HG2 GLN 71 HG3 GLN 71 -20.139 -12.550 0.658 574 HG3 GLN 71 HG2 GLN 71 -20.086 -10.829 0.279 575 HE21 GLN 71 HE21 GLN 71 -21.108 -13.036 -1.311 576 HE22 GLN 71 HE22 GLN 71 -20.229 -13.010 -2.798 577 H GLY 72 H GLY 72 -17.597 -9.049 3.243 578 HA2 GLY 72 HA3 GLY 72 -16.089 -9.497 5.050 579 HA3 GLY 72 HA2 GLY 72 -14.917 -10.078 3.877 580 H ALA 73 H ALA 73 -15.444 -7.714 2.092 581 HA ALA 73 HA ALA 73 -14.156 -5.641 3.745 582 HB1 ALA 73 HB1 ALA 73 -13.344 -6.582 1.002 583 HB2 ALA 73 HB2 ALA 73 -12.392 -6.624 2.486 584 HB3 ALA 73 HB3 ALA 73 -12.775 -5.079 1.727 585 H VAL 74 H VAL 74 -14.162 -3.469 2.569 586 HA VAL 74 HA VAL 74 -16.887 -2.916 1.767 587 HB VAL 74 HB VAL 74 -14.682 -0.874 1.780 588 HG11 VAL 74 HG11 VAL 74 -17.638 -0.889 1.848 589 HG12 VAL 74 HG12 VAL 74 -16.524 0.241 1.079 590 HG13 VAL 74 HG13 VAL 74 -16.828 0.344 2.814 591 HG21 VAL 74 HG21 VAL 74 -15.849 -2.305 4.096 592 HG22 VAL 74 HG22 VAL 74 -15.673 -0.556 4.242 593 HG23 VAL 74 HG23 VAL 74 -14.263 -1.559 3.904 594 H VAL 75 H VAL 75 -17.584 -2.266 -0.223 595 HA VAL 75 HA VAL 75 -15.604 -2.444 -2.397 596 HB VAL 75 HB VAL 75 -18.568 -2.970 -2.599 597 HG11 VAL 75 HG11 VAL 75 -17.395 -2.193 -4.666 598 HG12 VAL 75 HG12 VAL 75 -18.105 -3.802 -4.792 599 HG13 VAL 75 HG13 VAL 75 -16.368 -3.622 -4.553 600 HG21 VAL 75 HG21 VAL 75 -18.227 -5.047 -1.889 601 HG22 VAL 75 HG22 VAL 75 -16.586 -4.583 -1.442 602 HG23 VAL 75 HG23 VAL 75 -16.905 -5.271 -3.034 603 H VAL 76 H VAL 76 -15.310 -0.803 -3.715 604 HA VAL 76 HA VAL 76 -17.359 1.195 -4.156 605 HB VAL 76 HB VAL 76 -15.996 3.105 -3.575 606 HG11 VAL 76 HG11 VAL 76 -16.108 1.127 -1.301 607 HG12 VAL 76 HG12 VAL 76 -17.417 2.185 -1.826 608 HG13 VAL 76 HG13 VAL 76 -15.947 2.875 -1.138 609 HG21 VAL 76 HG21 VAL 76 -13.908 1.906 -2.039 610 HG22 VAL 76 HG22 VAL 76 -13.788 3.003 -3.417 611 HG23 VAL 76 HG23 VAL 76 -13.859 1.261 -3.681 612 H HIS 77 H HIS 77 -16.739 2.685 -5.938 613 HA HIS 77 HA HIS 77 -14.689 1.469 -7.673 614 HB2 HIS 77 HB3 HIS 77 -16.993 2.779 -8.991 615 HB3 HIS 77 HB2 HIS 77 -16.099 1.335 -9.453 616 HD1 HIS 77 HD1 HIS 77 -16.596 -0.643 -7.355 617 HD2 HIS 77 HD2 HIS 77 -19.540 2.063 -8.485 618 HE1 HIS 77 HE1 HIS 77 -18.771 -1.679 -6.637 619 HE2 HIS 77 HE2 HIS 77 -20.545 -0.067 -7.415 620 H ASP 78 H ASP 78 -15.859 4.343 -6.245 621 HA ASP 78 HA ASP 78 -14.128 5.920 -8.035 622 HB2 ASP 78 HB3 ASP 78 -16.865 6.405 -7.069 623 HB3 ASP 78 HB2 ASP 78 -15.786 7.790 -6.931 624 H VAL 79 H VAL 79 -13.101 7.798 -7.061 625 HA VAL 79 HA VAL 79 -11.863 7.160 -4.598 626 HB VAL 79 HB VAL 79 -10.992 9.583 -4.846 627 HG11 VAL 79 HG11 VAL 79 -9.363 8.083 -5.311 628 HG12 VAL 79 HG12 VAL 79 -9.616 8.689 -6.948 629 HG13 VAL 79 HG13 VAL 79 -10.372 7.178 -6.441 630 HG21 VAL 79 HG21 VAL 79 -12.934 9.743 -6.765 631 HG22 VAL 79 HG22 VAL 79 -11.478 9.455 -7.717 632 HG23 VAL 79 HG23 VAL 79 -11.553 10.829 -6.615 633 H ALA 80 H ALA 80 -14.415 9.380 -5.550 634 HA ALA 80 HA ALA 80 -14.577 10.760 -3.078 635 HB1 ALA 80 HB1 ALA 80 -15.642 11.182 -5.523 636 HB2 ALA 80 HB2 ALA 80 -16.219 11.964 -4.051 637 HB3 ALA 80 HB3 ALA 80 -17.044 10.535 -4.673 638 H ALA 81 H ALA 81 -16.210 7.915 -4.388 639 HA ALA 81 HA ALA 81 -18.142 7.541 -2.426 640 HB1 ALA 81 HB1 ALA 81 -16.676 5.204 -3.587 641 HB2 ALA 81 HB2 ALA 81 -17.680 6.225 -4.616 642 HB3 ALA 81 HB3 ALA 81 -18.396 5.385 -3.241 643 H VAL 82 H VAL 82 -15.043 5.771 -2.580 644 HA VAL 82 HA VAL 82 -15.038 4.656 -0.098 645 HB VAL 82 HB VAL 82 -13.311 4.508 -2.043 646 HG11 VAL 82 HG11 VAL 82 -11.602 6.233 -0.329 647 HG12 VAL 82 HG12 VAL 82 -12.680 7.005 -1.491 648 HG13 VAL 82 HG13 VAL 82 -11.467 5.853 -2.046 649 HG21 VAL 82 HG21 VAL 82 -13.388 3.221 0.145 650 HG22 VAL 82 HG22 VAL 82 -12.185 4.368 0.734 651 HG23 VAL 82 HG23 VAL 82 -11.820 3.343 -0.654 652 H PHE 83 H PHE 83 -14.296 8.006 -0.912 653 HA PHE 83 HA PHE 83 -13.104 8.725 1.533 654 HB2 PHE 83 HB3 PHE 83 -14.357 10.182 -0.731 655 HB3 PHE 83 HB2 PHE 83 -14.241 11.054 0.794 656 HD1 PHE 83 HD2 PHE 83 -11.737 10.308 1.921 657 HD2 PHE 83 HD1 PHE 83 -12.734 10.920 -2.171 658 HE1 PHE 83 HE2 PHE 83 -9.387 10.848 1.433 659 HE2 PHE 83 HE1 PHE 83 -10.385 11.460 -2.666 660 HZ PHE 83 HZ PHE 83 -8.708 11.425 -0.862 661 H ALA 84 H ALA 84 -16.472 8.531 0.527 662 HA ALA 84 HA ALA 84 -17.595 9.816 2.773 663 HB1 ALA 84 HB1 ALA 84 -18.637 7.872 0.749 664 HB2 ALA 84 HB2 ALA 84 -19.101 9.550 1.029 665 HB3 ALA 84 HB3 ALA 84 -19.616 8.293 2.154 666 H TYR 85 H TYR 85 -16.651 6.502 2.123 667 HA TYR 85 HA TYR 85 -17.699 5.341 4.462 668 HB2 TYR 85 HB3 TYR 85 -16.827 3.456 3.604 669 HB3 TYR 85 HB2 TYR 85 -16.205 4.427 2.280 670 HD1 TYR 85 HD1 TYR 85 -15.229 3.534 5.792 671 HD2 TYR 85 HD2 TYR 85 -13.986 4.171 1.777 672 HE1 TYR 85 HE1 TYR 85 -12.929 2.919 6.411 673 HE2 TYR 85 HE2 TYR 85 -11.684 3.559 2.384 674 HH TYR 85 HH TYR 85 -10.435 2.483 4.015 675 H ALA 86 H ALA 86 -14.320 6.339 3.822 676 HA ALA 86 HA ALA 86 -13.218 6.078 6.269 677 HB1 ALA 86 HB1 ALA 86 -12.807 8.391 4.382 678 HB2 ALA 86 HB2 ALA 86 -11.933 6.858 4.392 679 HB3 ALA 86 HB3 ALA 86 -11.745 7.988 5.732 680 H LYS 87 H LYS 87 -15.474 8.623 5.317 681 HA LYS 87 HA LYS 87 -15.147 10.262 7.595 682 HB2 LYS 87 HB3 LYS 87 -16.594 10.477 5.314 683 HB3 LYS 87 HB2 LYS 87 -17.868 10.031 6.441 684 HG2 LYS 87 HG3 LYS 87 -17.711 12.434 6.249 685 HG3 LYS 87 HG2 LYS 87 -17.253 11.920 7.873 686 HD2 LYS 87 HD3 LYS 87 -15.411 13.153 7.598 687 HD3 LYS 87 HD2 LYS 87 -14.862 11.896 6.489 688 HE2 LYS 87 HE3 LYS 87 -16.402 13.313 4.817 689 HE3 LYS 87 HE2 LYS 87 -15.931 14.598 5.929 690 HZ1 LYS 87 HZ1 LYS 87 -13.607 14.011 5.540 691 HZ2 LYS 87 HZ2 LYS 87 -14.382 14.445 4.100 692 HZ3 LYS 87 HZ3 LYS 87 -14.080 12.816 4.439 693 H GLN 88 H GLN 88 -17.396 7.658 6.845 694 HA GLN 88 HA GLN 88 -18.786 7.597 9.280 695 HB2 GLN 88 HB3 GLN 88 -19.306 6.352 7.088 696 HB3 GLN 88 HB2 GLN 88 -18.189 5.124 7.666 697 HG2 GLN 88 HG3 GLN 88 -19.657 4.304 9.134 698 HG3 GLN 88 HG2 GLN 88 -20.210 5.904 9.625 699 HE21 GLN 88 HE21 GLN 88 -21.303 7.014 7.532 700 HE22 GLN 88 HE22 GLN 88 -22.589 6.066 6.875 701 H HIS 89 H HIS 89 -15.637 6.504 8.415 702 HA HIS 89 HA HIS 89 -15.316 5.158 11.013 703 HB2 HIS 89 HB3 HIS 89 -14.046 4.795 8.327 704 HB3 HIS 89 HB2 HIS 89 -13.129 4.366 9.769 705 HD1 HIS 89 HD1 HIS 89 -15.567 3.172 11.374 706 HD2 HIS 89 HD2 HIS 89 -14.546 2.239 7.456 707 HE1 HIS 89 HE1 HIS 89 -16.565 0.904 10.942 708 HE2 HIS 89 HE2 HIS 89 -16.010 0.400 8.536 709 HA PRO 90 HA PRO 90 -13.003 9.148 11.358 710 HB2 PRO 90 HB3 PRO 90 -13.679 9.667 13.919 711 HB3 PRO 90 HB2 PRO 90 -14.735 10.065 12.559 712 HG2 PRO 90 HG3 PRO 90 -14.842 7.718 14.416 713 HG3 PRO 90 HG2 PRO 90 -16.168 8.734 13.822 714 HD2 PRO 90 HD3 PRO 90 -15.588 6.299 12.767 715 HD3 PRO 90 HD2 PRO 90 -16.287 7.622 11.812 716 H ASP 91 H ASP 91 -13.203 6.625 13.892 717 HA ASP 91 HA ASP 91 -10.689 7.264 15.028 718 HB2 ASP 91 HB3 ASP 91 -12.524 4.891 15.241 719 HB3 ASP 91 HB2 ASP 91 -10.957 4.912 16.045 720 H GLN 92 H GLN 92 -11.554 5.484 12.222 721 HA GLN 92 HA GLN 92 -8.967 4.105 12.191 722 HB2 GLN 92 HB3 GLN 92 -11.383 3.778 10.406 723 HB3 GLN 92 HB2 GLN 92 -9.896 2.853 10.268 724 HG2 GLN 92 HG3 GLN 92 -10.615 1.401 11.767 725 HG3 GLN 92 HG2 GLN 92 -10.840 2.687 12.952 726 HE21 GLN 92 HE21 GLN 92 -12.366 0.226 11.559 727 HE22 GLN 92 HE22 GLN 92 -13.994 0.800 11.577 728 H GLU 93 H GLU 93 -7.665 4.144 10.268 729 HA GLU 93 HA GLU 93 -7.936 6.659 8.757 730 HB2 GLU 93 HB3 GLU 93 -5.697 5.513 10.224 731 HB3 GLU 93 HB2 GLU 93 -5.271 5.883 8.559 732 HG2 GLU 93 HG3 GLU 93 -6.314 8.179 9.008 733 HG3 GLU 93 HG2 GLU 93 -6.211 7.738 10.712 734 H LEU 94 H LEU 94 -6.960 6.619 6.575 735 HA LEU 94 HA LEU 94 -7.521 4.046 5.287 736 HB2 LEU 94 HB3 LEU 94 -7.672 6.893 4.441 737 HB3 LEU 94 HB2 LEU 94 -7.304 5.701 3.209 738 HG LEU 94 HG LEU 94 -9.383 4.520 3.687 739 HD11 LEU 94 HD11 LEU 94 -10.930 5.182 5.316 740 HD12 LEU 94 HD12 LEU 94 -10.122 6.727 5.582 741 HD13 LEU 94 HD13 LEU 94 -9.369 5.231 6.135 742 HD21 LEU 94 HD21 LEU 94 -10.159 7.397 3.443 743 HD22 LEU 94 HD22 LEU 94 -10.793 5.989 2.591 744 HD23 LEU 94 HD23 LEU 94 -9.201 6.626 2.179 745 H VAL 95 H VAL 95 -5.951 2.862 4.414 746 HA VAL 95 HA VAL 95 -3.397 4.151 3.748 747 HB VAL 95 HB VAL 95 -3.577 1.490 5.158 748 HG11 VAL 95 HG11 VAL 95 -1.410 3.079 3.952 749 HG12 VAL 95 HG12 VAL 95 -1.544 1.338 4.195 750 HG13 VAL 95 HG13 VAL 95 -1.060 2.380 5.533 751 HG21 VAL 95 HG21 VAL 95 -4.279 3.528 6.524 752 HG22 VAL 95 HG22 VAL 95 -2.598 4.047 6.392 753 HG23 VAL 95 HG23 VAL 95 -2.990 2.521 7.184 754 H ILE 96 H ILE 96 -3.047 3.836 1.655 755 HA ILE 96 HA ILE 96 -4.301 1.666 0.227 756 HB ILE 96 HB ILE 96 -2.428 3.855 -0.689 757 HG12 ILE 96 HG13 ILE 96 -4.410 4.755 -1.796 758 HG13 ILE 96 HG12 ILE 96 -5.369 3.391 -1.234 759 HG21 ILE 96 HG21 ILE 96 -3.822 1.758 -2.350 760 HG22 ILE 96 HG22 ILE 96 -2.085 1.890 -2.081 761 HG23 ILE 96 HG23 ILE 96 -2.934 3.145 -2.982 762 HD11 ILE 96 HD11 ILE 96 -4.005 5.267 0.662 763 HD12 ILE 96 HD12 ILE 96 -5.319 4.135 0.983 764 HD13 ILE 96 HD13 ILE 96 -5.615 5.579 0.014 765 H ALA 97 H ALA 97 -3.421 -0.235 -0.282 766 HA ALA 97 HA ALA 97 -0.552 -0.618 0.275 767 HB1 ALA 97 HB1 ALA 97 -2.320 -2.981 0.146 768 HB2 ALA 97 HB2 ALA 97 -2.556 -1.890 1.512 769 HB3 ALA 97 HB3 ALA 97 -0.977 -2.622 1.232 770 H GLY 98 H GLY 98 -2.992 -0.787 -2.146 771 HA2 GLY 98 HA3 GLY 98 -1.341 -0.986 -4.313 772 HA3 GLY 98 HA2 GLY 98 -1.632 -2.657 -3.853 773 H GLY 99 H GLY 99 -4.154 -1.908 -6.392 774 HA2 GLY 99 HA3 GLY 99 -1.357 -2.507 -5.948 775 HA3 GLY 99 HA2 GLY 99 -2.234 -2.643 -7.462 776 H ALA 100 H ALA 100 -0.586 -1.658 -8.631 777 HA ALA 100 HA ALA 100 0.634 0.781 -8.008 778 HB1 ALA 100 HB1 ALA 100 1.327 -0.942 -9.748 779 HB2 ALA 100 HB2 ALA 100 1.517 0.756 -10.183 780 HB3 ALA 100 HB3 ALA 100 0.155 -0.169 -10.816 781 H GLN 101 H GLN 101 -2.318 0.073 -9.825 782 HA GLN 101 HA GLN 101 -2.750 2.716 -10.740 783 HB2 GLN 101 HB3 GLN 101 -4.000 0.209 -11.031 784 HB3 GLN 101 HB2 GLN 101 -5.224 1.287 -10.375 785 HG2 GLN 101 HG3 GLN 101 -3.614 2.342 -12.607 786 HG3 GLN 101 HG2 GLN 101 -4.720 1.022 -12.988 787 HE21 GLN 101 HE21 GLN 101 -4.486 4.267 -11.683 788 HE22 GLN 101 HE22 GLN 101 -6.130 4.709 -11.976 789 H ILE 102 H ILE 102 -3.619 1.009 -7.802 790 HA ILE 102 HA ILE 102 -5.455 2.946 -6.828 791 HB ILE 102 HB ILE 102 -3.815 0.978 -5.227 792 HG12 ILE 102 HG13 ILE 102 -5.148 -0.079 -7.046 793 HG13 ILE 102 HG12 ILE 102 -5.683 -0.548 -5.436 794 HG21 ILE 102 HG21 ILE 102 -4.839 2.763 -3.895 795 HG22 ILE 102 HG22 ILE 102 -5.567 1.193 -3.555 796 HG23 ILE 102 HG23 ILE 102 -6.416 2.357 -4.573 797 HD11 ILE 102 HD11 ILE 102 -7.653 0.614 -5.607 798 HD12 ILE 102 HD12 ILE 102 -7.415 0.069 -7.267 799 HD13 ILE 102 HD13 ILE 102 -7.017 1.727 -6.817 800 H PHE 103 H PHE 103 -1.980 2.499 -6.539 801 HA PHE 103 HA PHE 103 -1.518 4.418 -4.526 802 HB2 PHE 103 HB3 PHE 103 0.243 3.298 -6.706 803 HB3 PHE 103 HB2 PHE 103 0.830 4.460 -5.522 804 HD1 PHE 103 HD2 PHE 103 -0.435 3.549 -3.055 805 HD2 PHE 103 HD1 PHE 103 1.299 1.307 -6.228 806 HE1 PHE 103 HE2 PHE 103 0.043 1.711 -1.491 807 HE2 PHE 103 HE1 PHE 103 1.779 -0.535 -4.670 808 HZ PHE 103 HZ PHE 103 1.152 -0.334 -2.298 809 H THR 104 H THR 104 -1.589 4.622 -8.053 810 HA THR 104 HA THR 104 -0.725 7.270 -8.317 811 HB THR 104 HB THR 104 -2.705 5.889 -10.126 812 HG1 THR 104 HG1 THR 104 -1.010 4.882 -11.080 813 HG21 THR 104 HG21 THR 104 -1.969 7.238 -11.841 814 HG22 THR 104 HG22 THR 104 -0.476 7.665 -11.004 815 HG23 THR 104 HG23 THR 104 -2.013 8.348 -10.471 816 H ALA 105 H ALA 105 -4.068 6.005 -8.273 817 HA ALA 105 HA ALA 105 -5.444 8.365 -8.547 818 HB1 ALA 105 HB1 ALA 105 -7.101 7.113 -6.865 819 HB2 ALA 105 HB2 ALA 105 -6.042 5.764 -7.276 820 HB3 ALA 105 HB3 ALA 105 -6.900 6.632 -8.550 821 H PHE 106 H PHE 106 -4.659 6.884 -5.362 822 HA PHE 106 HA PHE 106 -5.411 9.263 -3.996 823 HB2 PHE 106 HB3 PHE 106 -3.982 6.762 -3.091 824 HB3 PHE 106 HB2 PHE 106 -4.425 8.076 -2.006 825 HD1 PHE 106 HD2 PHE 106 -5.838 5.613 -4.394 826 HD2 PHE 106 HD1 PHE 106 -6.558 8.173 -1.071 827 HE1 PHE 106 HE2 PHE 106 -8.074 4.622 -4.121 828 HE2 PHE 106 HE1 PHE 106 -8.795 7.186 -0.791 829 HZ PHE 106 HZ PHE 106 -9.556 5.409 -2.318 830 H LYS 107 H LYS 107 -2.585 8.363 -5.660 831 HA LYS 107 HA LYS 107 -0.483 9.341 -4.217 832 HB2 LYS 107 HB3 LYS 107 0.693 9.393 -6.177 833 HB3 LYS 107 HB2 LYS 107 -0.701 8.479 -6.729 834 HG2 LYS 107 HG3 LYS 107 -1.674 10.725 -7.453 835 HG3 LYS 107 HG2 LYS 107 -0.045 11.363 -7.218 836 HD2 LYS 107 HD3 LYS 107 0.817 9.677 -8.794 837 HD3 LYS 107 HD2 LYS 107 -0.831 9.100 -9.055 838 HE2 LYS 107 HE3 LYS 107 -1.484 11.185 -10.019 839 HE3 LYS 107 HE2 LYS 107 0.043 11.937 -9.562 840 HZ1 LYS 107 HZ1 LYS 107 1.099 11.052 -11.315 841 HZ2 LYS 107 HZ2 LYS 107 -0.452 10.907 -11.973 842 HZ3 LYS 107 HZ3 LYS 107 0.276 9.577 -11.225 843 H ASP 108 H ASP 108 -2.970 11.170 -5.868 844 HA ASP 108 HA ASP 108 -1.727 13.715 -5.213 845 HB2 ASP 108 HB3 ASP 108 -3.966 12.816 -6.933 846 HB3 ASP 108 HB2 ASP 108 -4.138 14.413 -6.210 847 H ASP 109 H ASP 109 -4.541 11.786 -4.302 848 HA ASP 109 HA ASP 109 -5.431 13.772 -2.384 849 HB2 ASP 109 HB3 ASP 109 -6.665 11.695 -3.806 850 HB3 ASP 109 HB2 ASP 109 -6.739 11.208 -2.116 851 H VAL 110 H VAL 110 -2.890 11.841 -2.218 852 HA VAL 110 HA VAL 110 -3.373 10.593 0.349 853 HB VAL 110 HB VAL 110 -1.988 9.449 -1.326 854 HG11 VAL 110 HG11 VAL 110 -0.919 11.870 -1.876 855 HG12 VAL 110 HG12 VAL 110 -0.184 10.335 -2.338 856 HG13 VAL 110 HG13 VAL 110 0.356 11.167 -0.880 857 HG21 VAL 110 HG21 VAL 110 -0.411 8.603 0.167 858 HG22 VAL 110 HG22 VAL 110 -1.670 9.248 1.219 859 HG23 VAL 110 HG23 VAL 110 -0.184 10.162 0.960 860 H ASP 111 H ASP 111 -1.996 10.962 2.206 861 HA ASP 111 HA ASP 111 -0.985 13.725 2.361 862 HB2 ASP 111 HB3 ASP 111 -2.817 12.230 4.178 863 HB3 ASP 111 HB2 ASP 111 -1.675 13.358 4.901 864 H THR 112 H THR 112 -0.687 10.405 3.537 865 HA THR 112 HA THR 112 2.012 11.071 4.512 866 HB THR 112 HB THR 112 0.281 8.763 5.409 867 HG1 THR 112 HG1 THR 112 -0.637 10.683 6.115 868 HG21 THR 112 HG21 THR 112 3.006 9.652 6.089 869 HG22 THR 112 HG22 THR 112 2.282 8.044 6.140 870 HG23 THR 112 HG23 THR 112 1.967 9.194 7.439 871 H LEU 113 H LEU 113 3.669 9.457 4.222 872 HA LEU 113 HA LEU 113 3.137 7.460 2.152 873 HB2 LEU 113 HB3 LEU 113 4.334 9.884 1.614 874 HB3 LEU 113 HB2 LEU 113 5.702 8.812 1.830 875 HG LEU 113 HG LEU 113 4.866 7.350 0.067 876 HD11 LEU 113 HD11 LEU 113 2.792 7.423 -0.759 877 HD12 LEU 113 HD12 LEU 113 2.833 9.177 -0.937 878 HD13 LEU 113 HD13 LEU 113 2.405 8.457 0.615 879 HD21 LEU 113 HD21 LEU 113 4.764 9.380 -1.714 880 HD22 LEU 113 HD22 LEU 113 6.252 8.768 -0.992 881 HD23 LEU 113 HD23 LEU 113 5.467 10.198 -0.319 882 H LEU 114 H LEU 114 4.015 5.565 2.620 883 HA LEU 114 HA LEU 114 6.396 5.436 4.331 884 HB2 LEU 114 HB3 LEU 114 3.956 3.682 4.649 885 HB3 LEU 114 HB2 LEU 114 5.441 3.559 5.572 886 HG LEU 114 HG LEU 114 3.909 6.124 5.633 887 HD11 LEU 114 HD11 LEU 114 2.547 3.856 6.133 888 HD12 LEU 114 HD12 LEU 114 2.248 5.384 6.961 889 HD13 LEU 114 HD13 LEU 114 3.256 4.152 7.720 890 HD21 LEU 114 HD21 LEU 114 6.245 5.393 6.738 891 HD22 LEU 114 HD22 LEU 114 5.139 4.901 8.020 892 HD23 LEU 114 HD23 LEU 114 5.154 6.574 7.463 893 H VAL 115 H VAL 115 7.917 4.482 3.130 894 HA VAL 115 HA VAL 115 7.088 2.236 1.404 895 HB VAL 115 HB VAL 115 8.840 2.887 -0.193 896 HG11 VAL 115 HG11 VAL 115 6.519 3.642 -0.489 897 HG12 VAL 115 HG12 VAL 115 7.683 4.792 -1.148 898 HG13 VAL 115 HG13 VAL 115 6.900 5.118 0.398 899 HG21 VAL 115 HG21 VAL 115 9.106 5.406 1.441 900 HG22 VAL 115 HG22 VAL 115 9.994 4.984 -0.023 901 HG23 VAL 115 HG23 VAL 115 10.266 4.078 1.466 902 H THR 116 H THR 116 8.598 0.593 1.015 903 HA THR 116 HA THR 116 10.804 0.427 2.962 904 HB THR 116 HB THR 116 8.942 -1.772 2.033 905 HG1 THR 116 HG1 THR 116 8.316 -1.819 4.175 906 HG21 THR 116 HG21 THR 116 11.465 -1.911 3.631 907 HG22 THR 116 HG22 THR 116 10.953 -2.905 2.267 908 HG23 THR 116 HG23 THR 116 10.174 -3.095 3.839 909 H ARG 117 H ARG 117 12.486 0.927 1.626 910 HA ARG 117 HA ARG 117 12.654 -0.288 -1.008 911 HB2 ARG 117 HB3 ARG 117 13.327 2.153 -0.260 912 HB3 ARG 117 HB2 ARG 117 14.851 1.374 0.141 913 HG2 ARG 117 HG3 ARG 117 15.468 1.259 -1.992 914 HG3 ARG 117 HG2 ARG 117 13.900 0.627 -2.495 915 HD2 ARG 117 HD3 ARG 117 13.572 2.592 -3.495 916 HD3 ARG 117 HD2 ARG 117 13.371 3.269 -1.880 917 HE ARG 117 HE ARG 117 15.623 3.609 -3.645 918 HH11 ARG 117 HH11 ARG 117 14.514 3.746 -0.337 919 HH12 ARG 117 HH12 ARG 117 15.760 4.837 0.166 920 HH21 ARG 117 HH21 ARG 117 17.262 5.044 -2.982 921 HH22 ARG 117 HH22 ARG 117 17.319 5.575 -1.335 922 H LEU 118 H LEU 118 13.291 -2.345 -1.032 923 HA LEU 118 HA LEU 118 14.975 -3.540 0.900 924 HB2 LEU 118 HB3 LEU 118 13.623 -4.329 -1.567 925 HB3 LEU 118 HB2 LEU 118 15.163 -5.139 -1.348 926 HG LEU 118 HG LEU 118 14.374 -5.846 0.930 927 HD11 LEU 118 HD11 LEU 118 12.627 -4.647 1.680 928 HD12 LEU 118 HD12 LEU 118 11.676 -5.833 0.785 929 HD13 LEU 118 HD13 LEU 118 12.052 -4.272 0.056 930 HD21 LEU 118 HD21 LEU 118 13.604 -7.771 0.061 931 HD22 LEU 118 HD22 LEU 118 14.046 -7.025 -1.474 932 HD23 LEU 118 HD23 LEU 118 12.375 -6.965 -0.914 933 H ALA 119 H ALA 119 17.133 -4.261 0.708 934 HA ALA 119 HA ALA 119 18.860 -2.429 -0.650 935 HB1 ALA 119 HB1 ALA 119 20.518 -3.259 0.651 936 HB2 ALA 119 HB2 ALA 119 19.985 -4.929 0.458 937 HB3 ALA 119 HB3 ALA 119 19.152 -3.862 1.589 938 H GLY 120 H GLY 120 18.124 -5.888 -1.013 939 HA2 GLY 120 HA3 GLY 120 19.894 -6.444 -3.102 940 HA3 GLY 120 HA2 GLY 120 18.400 -7.314 -2.788 941 H SER 121 H SER 121 19.656 -6.577 -5.333 942 HA SER 121 HA SER 121 17.736 -4.661 -6.434 943 HB2 SER 121 HB3 SER 121 20.469 -5.354 -7.031 944 HB3 SER 121 HB2 SER 121 19.474 -5.551 -8.473 945 HG SER 121 HG SER 121 18.765 -3.414 -8.206 946 H PHE 122 H PHE 122 15.978 -5.336 -7.455 947 HA PHE 122 HA PHE 122 15.985 -8.029 -8.649 948 HB2 PHE 122 HB3 PHE 122 13.696 -6.693 -7.188 949 HB3 PHE 122 HB2 PHE 122 13.615 -8.252 -8.001 950 HD1 PHE 122 HD2 PHE 122 15.320 -6.440 -5.252 951 HD2 PHE 122 HD1 PHE 122 14.209 -10.209 -6.885 952 HE1 PHE 122 HE2 PHE 122 16.066 -7.550 -3.187 953 HE2 PHE 122 HE1 PHE 122 14.952 -11.326 -4.823 954 HZ PHE 122 HZ PHE 122 15.883 -9.996 -2.970 955 H GLU 123 H GLU 123 14.304 -8.315 -10.338 956 HA GLU 123 HA GLU 123 13.692 -5.805 -11.745 957 HB2 GLU 123 HB3 GLU 123 14.291 -6.822 -13.871 958 HB3 GLU 123 HB2 GLU 123 15.666 -6.860 -12.776 959 HG2 GLU 123 HG3 GLU 123 14.392 -9.269 -12.319 960 HG3 GLU 123 HG2 GLU 123 14.250 -9.034 -14.060 961 H GLY 124 H GLY 124 11.712 -5.677 -12.671 962 HA2 GLY 124 HA3 GLY 124 10.122 -8.062 -13.112 963 HA3 GLY 124 HA2 GLY 124 9.544 -7.016 -11.823 964 H ASP 125 H ASP 125 7.691 -6.266 -12.727 965 HA ASP 125 HA ASP 125 8.005 -4.397 -14.938 966 HB2 ASP 125 HB3 ASP 125 6.182 -6.797 -15.001 967 HB3 ASP 125 HB2 ASP 125 5.878 -5.371 -15.988 968 H THR 126 H THR 126 7.487 -4.171 -12.076 969 HA THR 126 HA THR 126 5.097 -2.520 -12.259 970 HB THR 126 HB THR 126 5.309 -4.355 -9.899 971 HG1 THR 126 HG1 THR 126 4.123 -4.973 -12.397 972 HG21 THR 126 HG21 THR 126 2.917 -4.100 -9.792 973 HG22 THR 126 HG22 THR 126 2.922 -3.159 -11.284 974 HG23 THR 126 HG23 THR 126 3.688 -2.514 -9.832 975 H LYS 127 H LYS 127 6.016 -0.623 -11.784 976 HA LYS 127 HA LYS 127 7.609 -0.447 -9.308 977 HB2 LYS 127 HB3 LYS 127 8.636 1.610 -10.429 978 HB3 LYS 127 HB2 LYS 127 9.129 0.036 -11.039 979 HG2 LYS 127 HG3 LYS 127 6.812 1.191 -12.408 980 HG3 LYS 127 HG2 LYS 127 8.303 2.119 -12.573 981 HD2 LYS 127 HD3 LYS 127 8.824 -0.694 -12.908 982 HD3 LYS 127 HD2 LYS 127 7.547 -0.168 -14.006 983 HE2 LYS 127 HE3 LYS 127 8.931 1.207 -15.177 984 HE3 LYS 127 HE2 LYS 127 9.938 1.567 -13.776 985 HZ1 LYS 127 HZ1 LYS 127 11.199 0.264 -15.298 986 HZ2 LYS 127 HZ2 LYS 127 9.983 -0.905 -15.416 987 HZ3 LYS 127 HZ3 LYS 127 10.838 -0.719 -13.969 988 H MET 128 H MET 128 7.535 1.764 -8.306 989 HA MET 128 HA MET 128 4.888 2.487 -7.733 990 HB2 MET 128 HB3 MET 128 6.890 2.868 -6.264 991 HB3 MET 128 HB2 MET 128 7.338 4.205 -7.314 992 HG2 MET 128 HG3 MET 128 6.177 4.931 -5.277 993 HG3 MET 128 HG2 MET 128 5.327 5.391 -6.750 994 HE1 MET 128 HE1 MET 128 2.635 5.585 -5.273 995 HE2 MET 128 HE2 MET 128 4.097 5.798 -4.309 996 HE3 MET 128 HE3 MET 128 2.832 4.699 -3.761 997 H ILE 129 H ILE 129 3.967 4.704 -7.989 998 HA ILE 129 HA ILE 129 4.370 5.605 -10.754 999 HB ILE 129 HB ILE 129 2.127 6.816 -10.292 1000 HG12 ILE 129 HG13 ILE 129 0.692 5.720 -8.639 1001 HG13 ILE 129 HG12 ILE 129 2.022 4.673 -8.156 1002 HG21 ILE 129 HG21 ILE 129 1.592 5.256 -11.781 1003 HG22 ILE 129 HG22 ILE 129 1.147 4.215 -10.429 1004 HG23 ILE 129 HG23 ILE 129 2.770 4.125 -11.114 1005 HD11 ILE 129 HD11 ILE 129 3.119 6.363 -7.048 1006 HD12 ILE 129 HD12 ILE 129 1.427 6.755 -6.740 1007 HD13 ILE 129 HD13 ILE 129 2.323 7.631 -7.980 1008 HA PRO 130 HA PRO 130 6.074 9.539 -9.791 1009 HB2 PRO 130 HB3 PRO 130 3.830 10.764 -11.319 1010 HB3 PRO 130 HB2 PRO 130 5.573 10.978 -11.513 1011 HG2 PRO 130 HG3 PRO 130 4.191 9.486 -13.230 1012 HG3 PRO 130 HG2 PRO 130 5.816 9.003 -12.706 1013 HD2 PRO 130 HD3 PRO 130 3.157 7.926 -11.879 1014 HD3 PRO 130 HD2 PRO 130 4.697 7.075 -12.118 1015 H LEU 131 H LEU 131 5.889 11.155 -8.295 1016 HA LEU 131 HA LEU 131 3.255 11.813 -7.210 1017 HB2 LEU 131 HB3 LEU 131 5.397 11.324 -5.212 1018 HB3 LEU 131 HB2 LEU 131 3.661 11.159 -5.053 1019 HG LEU 131 HG LEU 131 5.050 9.196 -6.800 1020 HD11 LEU 131 HD11 LEU 131 5.950 7.917 -5.087 1021 HD12 LEU 131 HD12 LEU 131 5.052 8.779 -3.837 1022 HD13 LEU 131 HD13 LEU 131 6.411 9.561 -4.644 1023 HD21 LEU 131 HD21 LEU 131 2.743 9.180 -4.871 1024 HD22 LEU 131 HD22 LEU 131 3.395 7.709 -5.592 1025 HD23 LEU 131 HD23 LEU 131 2.706 8.965 -6.620 1026 H ASN 132 H ASN 132 3.201 13.791 -6.021 1027 HA ASN 132 HA ASN 132 5.091 15.734 -6.957 1028 HB2 ASN 132 HB3 ASN 132 2.470 15.757 -5.820 1029 HB3 ASN 132 HB2 ASN 132 3.495 16.801 -4.842 1030 HD21 ASN 132 HD21 ASN 132 3.984 18.768 -5.574 1031 HD22 ASN 132 HD22 ASN 132 3.586 19.370 -7.143 1032 H TRP 133 H TRP 133 6.954 14.612 -6.027 1033 HA TRP 133 HA TRP 133 7.424 14.189 -3.344 1034 HB2 TRP 133 HB3 TRP 133 9.374 14.928 -5.526 1035 HB3 TRP 133 HB2 TRP 133 9.844 14.339 -3.933 1036 HD1 TRP 133 HD1 TRP 133 8.248 13.175 -7.205 1037 HE1 TRP 133 HE1 TRP 133 8.233 10.599 -7.251 1038 HE3 TRP 133 HE3 TRP 133 9.840 12.268 -2.432 1039 HZ2 TRP 133 HZ2 TRP 133 8.830 8.468 -5.499 1040 HZ3 TRP 133 HZ3 TRP 133 10.094 9.934 -1.697 1041 HH2 TRP 133 HH2 TRP 133 9.598 8.075 -3.199 1042 H ASP 134 H ASP 134 8.062 17.204 -5.197 1043 HA ASP 134 HA ASP 134 9.363 18.598 -3.189 1044 HB2 ASP 134 HB3 ASP 134 8.580 19.167 -5.730 1045 HB3 ASP 134 HB2 ASP 134 7.466 20.174 -4.811 1046 H ASP 135 H ASP 135 5.887 18.284 -3.804 1047 HA ASP 135 HA ASP 135 5.132 20.016 -1.664 1048 HB2 ASP 135 HB3 ASP 135 3.754 18.318 -3.644 1049 HB3 ASP 135 HB2 ASP 135 2.892 18.547 -2.126 1050 H PHE 136 H PHE 136 6.546 17.055 -1.534 1051 HA PHE 136 HA PHE 136 5.205 16.404 1.004 1052 HB2 PHE 136 HB3 PHE 136 6.094 14.628 -1.234 1053 HB3 PHE 136 HB2 PHE 136 6.134 14.009 0.414 1054 HD1 PHE 136 HD2 PHE 136 3.750 16.051 -1.613 1055 HD2 PHE 136 HD1 PHE 136 4.342 12.691 0.929 1056 HE1 PHE 136 HE2 PHE 136 1.351 15.525 -1.758 1057 HE2 PHE 136 HE1 PHE 136 1.944 12.157 0.789 1058 HZ PHE 136 HZ PHE 136 0.445 13.576 -0.555 1059 H THR 137 H THR 137 6.460 16.221 2.747 1060 HA THR 137 HA THR 137 9.377 16.346 2.347 1061 HB THR 137 HB THR 137 7.692 17.467 4.594 1062 HG1 THR 137 HG1 THR 137 8.083 19.386 3.700 1063 HG21 THR 137 HG21 THR 137 10.666 17.355 4.257 1064 HG22 THR 137 HG22 THR 137 9.692 16.905 5.657 1065 HG23 THR 137 HG23 THR 137 9.876 18.603 5.219 1066 H LYS 138 H LYS 138 10.725 15.172 3.722 1067 HA LYS 138 HA LYS 138 9.732 12.629 4.508 1068 HB2 LYS 138 HB3 LYS 138 12.141 13.442 3.762 1069 HB3 LYS 138 HB2 LYS 138 12.361 13.626 5.497 1070 HG2 LYS 138 HG3 LYS 138 12.862 11.476 5.598 1071 HG3 LYS 138 HG2 LYS 138 11.192 11.113 5.165 1072 HD2 LYS 138 HD3 LYS 138 12.616 9.959 3.629 1073 HD3 LYS 138 HD2 LYS 138 11.855 11.296 2.767 1074 HE2 LYS 138 HE3 LYS 138 13.889 12.639 3.088 1075 HE3 LYS 138 HE2 LYS 138 14.647 11.274 3.907 1076 HZ1 LYS 138 HZ1 LYS 138 14.049 11.638 1.063 1077 HZ2 LYS 138 HZ2 LYS 138 14.004 10.068 1.688 1078 HZ3 LYS 138 HZ3 LYS 138 15.423 10.982 1.800 1079 H VAL 139 H VAL 139 8.720 12.122 6.328 1080 HA VAL 139 HA VAL 139 8.809 13.956 8.588 1081 HB VAL 139 HB VAL 139 7.262 11.422 8.754 1082 HG11 VAL 139 HG11 VAL 139 7.302 13.125 10.554 1083 HG12 VAL 139 HG12 VAL 139 5.686 12.804 9.927 1084 HG13 VAL 139 HG13 VAL 139 6.545 14.266 9.442 1085 HG21 VAL 139 HG21 VAL 139 5.406 12.912 7.548 1086 HG22 VAL 139 HG22 VAL 139 6.434 11.779 6.674 1087 HG23 VAL 139 HG23 VAL 139 6.831 13.497 6.688 1088 H SER 140 H SER 140 9.862 10.735 7.686 1089 HA SER 140 HA SER 140 11.713 10.679 9.880 1090 HB2 SER 140 HB3 SER 140 9.149 9.548 10.324 1091 HB3 SER 140 HB2 SER 140 10.287 8.210 10.170 1092 HG SER 140 HG SER 140 10.042 10.095 12.151 1093 H SER 141 H SER 141 13.020 8.652 9.887 1094 HA SER 141 HA SER 141 12.927 7.038 7.489 1095 HB2 SER 141 HB3 SER 141 15.138 7.624 6.689 1096 HB3 SER 141 HB2 SER 141 14.163 9.090 6.787 1097 HG SER 141 HG SER 141 16.074 8.209 8.693 1098 H ARG 142 H ARG 142 13.434 5.033 8.036 1099 HA ARG 142 HA ARG 142 15.360 4.589 10.214 1100 HB2 ARG 142 HB3 ARG 142 12.878 4.246 10.826 1101 HB3 ARG 142 HB2 ARG 142 12.961 2.818 9.803 1102 HG2 ARG 142 HG3 ARG 142 14.049 1.636 11.349 1103 HG3 ARG 142 HG2 ARG 142 15.137 2.970 11.735 1104 HD2 ARG 142 HD3 ARG 142 13.984 3.449 13.574 1105 HD3 ARG 142 HD2 ARG 142 12.483 3.567 12.656 1106 HE ARG 142 HE ARG 142 13.254 0.860 13.162 1107 HH11 ARG 142 HH11 ARG 142 11.675 3.649 14.541 1108 HH12 ARG 142 HH12 ARG 142 10.709 2.718 15.635 1109 HH21 ARG 142 HH21 ARG 142 11.985 -0.368 14.602 1110 HH22 ARG 142 HH22 ARG 142 10.886 0.437 15.671 1111 H THR 143 H THR 143 16.686 2.771 10.004 1112 HA THR 143 HA THR 143 16.489 1.363 7.424 1113 HB THR 143 HB THR 143 19.105 2.016 8.765 1114 HG1 THR 143 HG1 THR 143 17.995 3.960 8.236 1115 HG21 THR 143 HG21 THR 143 19.287 1.978 5.959 1116 HG22 THR 143 HG22 THR 143 18.389 0.539 6.442 1117 HG23 THR 143 HG23 THR 143 19.989 0.847 7.117 1118 H VAL 144 H VAL 144 15.790 -0.609 7.968 1119 HA VAL 144 HA VAL 144 17.002 -1.962 10.276 1120 HB VAL 144 HB VAL 144 14.610 -2.876 8.677 1121 HG11 VAL 144 HG11 VAL 144 14.417 -4.591 10.124 1122 HG12 VAL 144 HG12 VAL 144 14.947 -3.627 11.502 1123 HG13 VAL 144 HG13 VAL 144 16.137 -4.304 10.390 1124 HG21 VAL 144 HG21 VAL 144 14.666 -1.272 11.232 1125 HG22 VAL 144 HG22 VAL 144 13.227 -1.963 10.485 1126 HG23 VAL 144 HG23 VAL 144 14.130 -0.697 9.654 1127 H GLU 145 H GLU 145 18.383 -3.609 10.002 1128 HA GLU 145 HA GLU 145 18.578 -4.820 7.323 1129 HB2 GLU 145 HB3 GLU 145 21.070 -5.097 7.931 1130 HB3 GLU 145 HB2 GLU 145 20.509 -3.513 7.418 1131 HG2 GLU 145 HG3 GLU 145 20.841 -2.578 9.440 1132 HG3 GLU 145 HG2 GLU 145 20.447 -4.059 10.314 1133 H ASP 146 H ASP 146 19.025 -6.996 7.207 1134 HA ASP 146 HA ASP 146 18.761 -8.471 9.741 1135 HB2 ASP 146 HB3 ASP 146 17.632 -8.870 7.029 1136 HB3 ASP 146 HB2 ASP 146 18.147 -10.328 7.872 1137 H THR 147 H THR 147 19.565 -10.945 9.094 1138 HA THR 147 HA THR 147 22.358 -10.794 9.159 1139 HB THR 147 HB THR 147 21.196 -12.712 10.066 1140 HG1 THR 147 HG1 THR 147 22.444 -14.351 9.100 1141 HG21 THR 147 HG21 THR 147 20.416 -13.395 7.242 1142 HG22 THR 147 HG22 THR 147 19.325 -12.869 8.524 1143 HG23 THR 147 HG23 THR 147 20.170 -14.411 8.662 1144 H ASN 148 H ASN 148 20.147 -11.546 6.499 1145 HA ASN 148 HA ASN 148 22.309 -11.833 4.609 1146 HB2 ASN 148 HB3 ASN 148 19.422 -12.311 4.636 1147 HB3 ASN 148 HB2 ASN 148 19.995 -11.629 3.116 1148 HD21 ASN 148 HD21 ASN 148 19.137 -13.847 2.514 1149 HD22 ASN 148 HD22 ASN 148 20.292 -15.131 2.492 1150 HA PRO 149 HA PRO 149 22.686 -7.494 3.680 1151 HB2 PRO 149 HB3 PRO 149 23.553 -8.436 1.006 1152 HB3 PRO 149 HB2 PRO 149 24.399 -7.405 2.164 1153 HG2 PRO 149 HG3 PRO 149 25.153 -9.934 1.769 1154 HG3 PRO 149 HG2 PRO 149 25.195 -9.201 3.382 1155 HD2 PRO 149 HD3 PRO 149 23.210 -11.110 2.223 1156 HD3 PRO 149 HD2 PRO 149 23.889 -11.043 3.863 1157 H ALA 150 H ALA 150 21.139 -9.746 1.476 1158 HA ALA 150 HA ALA 150 19.819 -7.718 -0.065 1159 HB1 ALA 150 HB1 ALA 150 19.789 -10.689 0.010 1160 HB2 ALA 150 HB2 ALA 150 20.088 -9.593 -1.339 1161 HB3 ALA 150 HB3 ALA 150 18.441 -9.855 -0.763 1162 H LEU 151 H LEU 151 19.165 -9.317 2.912 1163 HA LEU 151 HA LEU 151 16.313 -8.790 2.793 1164 HB2 LEU 151 HB3 LEU 151 18.106 -10.077 4.830 1165 HB3 LEU 151 HB2 LEU 151 16.444 -9.667 5.208 1166 HG LEU 151 HG LEU 151 17.445 -11.677 3.204 1167 HD11 LEU 151 HD11 LEU 151 15.287 -12.261 5.124 1168 HD12 LEU 151 HD12 LEU 151 16.887 -11.988 5.814 1169 HD13 LEU 151 HD13 LEU 151 16.651 -13.252 4.607 1170 HD21 LEU 151 HD21 LEU 151 14.692 -10.485 3.463 1171 HD22 LEU 151 HD22 LEU 151 15.014 -12.025 2.666 1172 HD23 LEU 151 HD23 LEU 151 15.720 -10.539 2.031 1173 H THR 152 H THR 152 18.661 -6.715 3.045 1174 HA THR 152 HA THR 152 17.861 -5.342 5.477 1175 HB THR 152 HB THR 152 19.838 -4.513 3.340 1176 HG1 THR 152 HG1 THR 152 20.140 -5.930 5.764 1177 HG21 THR 152 HG21 THR 152 20.781 -3.229 5.378 1178 HG22 THR 152 HG22 THR 152 19.134 -3.355 5.997 1179 HG23 THR 152 HG23 THR 152 19.440 -2.544 4.460 1180 H HIS 153 H HIS 153 16.421 -3.726 5.560 1181 HA HIS 153 HA HIS 153 15.627 -2.436 3.038 1182 HB2 HIS 153 HB3 HIS 153 13.507 -2.829 5.073 1183 HB3 HIS 153 HB2 HIS 153 13.403 -2.860 3.317 1184 HD1 HIS 153 HD1 HIS 153 12.646 -5.014 5.842 1185 HD2 HIS 153 HD2 HIS 153 15.191 -5.412 2.583 1186 HE1 HIS 153 HE1 HIS 153 12.901 -7.489 5.486 1187 HE2 HIS 153 HE2 HIS 153 14.380 -7.706 3.459 1188 H THR 154 H THR 154 14.443 -0.382 3.375 1189 HA THR 154 HA THR 154 15.155 0.945 5.897 1190 HB THR 154 HB THR 154 15.600 2.102 3.138 1191 HG1 THR 154 HG1 THR 154 17.715 1.767 3.495 1192 HG21 THR 154 HG21 THR 154 16.457 4.029 4.108 1193 HG22 THR 154 HG22 THR 154 16.562 3.293 5.707 1194 HG23 THR 154 HG23 THR 154 14.988 3.708 5.028 1195 H TYR 155 H TYR 155 13.430 1.839 6.789 1196 HA TYR 155 HA TYR 155 11.049 2.311 5.174 1197 HB2 TYR 155 HB3 TYR 155 11.599 2.072 8.110 1198 HB3 TYR 155 HB2 TYR 155 10.135 2.886 7.568 1199 HD1 TYR 155 HD1 TYR 155 8.363 1.643 6.446 1200 HD2 TYR 155 HD2 TYR 155 11.880 -0.316 7.822 1201 HE1 TYR 155 HE1 TYR 155 7.242 -0.532 6.198 1202 HE2 TYR 155 HE2 TYR 155 10.770 -2.496 7.576 1203 HH TYR 155 HH TYR 155 8.146 -3.238 7.602 1204 H GLU 156 H GLU 156 10.095 4.299 4.892 1205 HA GLU 156 HA GLU 156 11.389 6.628 6.106 1206 HB2 GLU 156 HB3 GLU 156 10.907 6.286 3.142 1207 HB3 GLU 156 HB2 GLU 156 11.395 7.790 3.911 1208 HG2 GLU 156 HG3 GLU 156 13.526 7.195 3.898 1209 HG3 GLU 156 HG2 GLU 156 13.163 5.645 4.655 1210 H VAL 157 H VAL 157 10.068 8.366 6.455 1211 HA VAL 157 HA VAL 157 7.217 7.954 5.846 1212 HB VAL 157 HB VAL 157 8.139 9.821 8.000 1213 HG11 VAL 157 HG11 VAL 157 5.796 8.209 8.515 1214 HG12 VAL 157 HG12 VAL 157 5.663 9.060 6.977 1215 HG13 VAL 157 HG13 VAL 157 5.965 9.963 8.461 1216 HG21 VAL 157 HG21 VAL 157 7.989 8.000 9.642 1217 HG22 VAL 157 HG22 VAL 157 9.298 7.737 8.489 1218 HG23 VAL 157 HG23 VAL 157 7.787 6.842 8.328 1219 H TRP 158 H TRP 158 5.997 9.670 5.153 1220 HA TRP 158 HA TRP 158 7.310 12.205 4.540 1221 HB2 TRP 158 HB3 TRP 158 5.865 10.739 2.343 1222 HB3 TRP 158 HB2 TRP 158 6.806 12.214 2.213 1223 HD1 TRP 158 HD1 TRP 158 7.478 8.497 3.160 1224 HE1 TRP 158 HE1 TRP 158 9.773 7.854 2.184 1225 HE3 TRP 158 HE3 TRP 158 8.798 13.008 1.159 1226 HZ2 TRP 158 HZ2 TRP 158 11.865 9.097 0.749 1227 HZ3 TRP 158 HZ3 TRP 158 10.961 13.199 -0.003 1228 HH2 TRP 158 HH2 TRP 158 12.462 11.283 -0.201 1229 H GLN 159 H GLN 159 5.992 13.929 4.567 1230 HA GLN 159 HA GLN 159 3.090 13.511 4.523 1231 HB2 GLN 159 HB3 GLN 159 4.707 14.584 6.781 1232 HB3 GLN 159 HB2 GLN 159 3.166 15.360 6.446 1233 HG2 GLN 159 HG3 GLN 159 1.996 13.280 6.742 1234 HG3 GLN 159 HG2 GLN 159 3.518 12.411 6.930 1235 HE21 GLN 159 HE21 GLN 159 1.954 15.289 8.306 1236 HE22 GLN 159 HE22 GLN 159 2.311 14.906 9.952 1237 H LYS 160 H LYS 160 2.078 14.981 3.278 1238 HA LYS 160 HA LYS 160 3.456 16.858 1.761 1239 HB2 LYS 160 HB3 LYS 160 1.289 15.941 1.106 1240 HB3 LYS 160 HB2 LYS 160 0.516 16.762 2.454 1241 HG2 LYS 160 HG3 LYS 160 1.074 18.922 1.474 1242 HG3 LYS 160 HG2 LYS 160 1.877 18.109 0.130 1243 HD2 LYS 160 HD3 LYS 160 -0.157 18.440 -0.835 1244 HD3 LYS 160 HD2 LYS 160 -0.488 16.902 -0.036 1245 HE2 LYS 160 HE3 LYS 160 -0.991 18.903 1.871 1246 HE3 LYS 160 HE2 LYS 160 -1.718 19.465 0.366 1247 HZ1 LYS 160 HZ1 LYS 160 -2.168 16.716 1.347 1248 HZ2 LYS 160 HZ2 LYS 160 -3.095 17.613 0.253 1249 HZ3 LYS 160 HZ3 LYS 160 -3.115 18.006 1.898 1250 H LYS 161 H LYS 161 3.676 19.075 1.849 1251 HA LYS 161 HA LYS 161 3.848 20.208 4.465 1252 HB2 LYS 161 HB3 LYS 161 4.996 20.723 1.980 1253 HB3 LYS 161 HB2 LYS 161 4.004 22.139 2.295 1254 HG2 LYS 161 HG3 LYS 161 5.269 22.808 4.063 1255 HG3 LYS 161 HG2 LYS 161 5.748 21.163 4.486 1256 HD2 LYS 161 HD3 LYS 161 7.702 22.174 3.656 1257 HD3 LYS 161 HD2 LYS 161 7.104 21.176 2.329 1258 HE2 LYS 161 HE3 LYS 161 7.569 23.135 1.225 1259 HE3 LYS 161 HE2 LYS 161 5.870 23.376 1.631 1260 HZ1 LYS 161 HZ1 LYS 161 6.717 25.332 2.364 1261 HZ2 LYS 161 HZ2 LYS 161 8.244 24.693 2.710 1262 HZ3 LYS 161 HZ3 LYS 161 6.957 24.427 3.774 1263 H ALA 162 H ALA 162 2.661 21.882 5.368 1264 HA ALA 162 HA ALA 162 0.795 23.080 5.877 1265 HB1 ALA 162 HB1 ALA 162 1.028 24.609 4.216 1266 HB2 ALA 162 HB2 ALA 162 -0.477 23.869 3.669 1267 HB3 ALA 162 HB3 ALA 162 1.057 23.388 2.944 1268 H51A NDP 170 H51A NDP 170 -5.216 -0.450 -9.587 1269 H52A NDP 170 H52A NDP 170 -5.581 -2.104 -9.085 1270 H4B NDP 170 H4B NDP 170 -6.943 -2.362 -11.208 1271 H3B NDP 170 H3B NDP 170 -6.281 0.569 -11.547 1272 HO3A NDP 170 HO3A NDP 170 -6.632 -1.682 -13.278 1273 H2B NDP 170 H2B NDP 170 -8.499 0.874 -12.396 1274 H1B NDP 170 H1B NDP 170 -9.763 -0.588 -10.430 1275 H8A NDP 170 H8A NDP 170 -6.696 1.228 -9.123 1276 H61A NDP 170 H61A NDP 170 -10.596 5.892 -7.874 1277 H62A NDP 170 H62A NDP 170 -8.941 5.338 -7.758 1278 H2A NDP 170 H2A NDP 170 -12.849 2.781 -10.189 1279 H51N NDP 170 H51N NDP 170 -0.107 -3.125 -9.565 1280 H52N NDP 170 H52N NDP 170 -1.067 -3.962 -8.333 1281 H4D NDP 170 H4D NDP 170 1.196 -5.247 -9.920 1282 H3D NDP 170 H3D NDP 170 -0.517 -6.293 -7.654 1283 HO3N NDP 170 HO3N NDP 170 0.031 -6.915 -10.274 1284 H2D NDP 170 H2D NDP 170 1.409 -7.508 -6.909 1285 HO2N NDP 170 HO2N NDP 170 2.768 -8.263 -8.304 1286 H1D NDP 170 H1D NDP 170 3.194 -5.418 -7.231 1287 H2N NDP 170 H2N NDP 170 3.565 -5.106 -4.892 1288 H71N NDP 170 H71N NDP 170 5.215 -4.555 -2.175 1289 H72N NDP 170 H72N NDP 170 4.856 -5.221 -3.747 1290 H41N NDP 170 H41N NDP 170 0.441 -3.584 -2.939 1291 H42N NDP 170 H42N NDP 170 0.336 -5.341 -2.574 1292 H5N NDP 170 H5N NDP 170 -1.347 -4.671 -4.284 1293 H6N NDP 170 H6N NDP 170 -0.468 -5.203 -6.565 Start of MODEL 11 1 H1 THR 1 HT1 THR 1 -5.783 8.879 5.220 2 H2 THR 1 HT2 THR 1 -4.472 9.943 5.524 3 H3 THR 1 HT3 THR 1 -4.293 8.258 5.794 4 HA THR 1 HA THR 1 -4.804 7.975 3.380 5 HB THR 1 HB THR 1 -3.859 10.246 2.280 6 HG1 THR 1 HG1 THR 1 -3.772 11.432 4.159 7 HG21 THR 1 HG21 THR 1 -5.805 9.624 1.310 8 HG22 THR 1 HG22 THR 1 -6.401 10.981 2.265 9 HG23 THR 1 HG23 THR 1 -6.613 9.331 2.850 10 H ALA 2 H ALA 2 -3.062 6.671 4.382 11 HA ALA 2 HA ALA 2 -0.409 7.792 3.751 12 HB1 ALA 2 HB1 ALA 2 -0.963 7.306 6.212 13 HB2 ALA 2 HB2 ALA 2 0.558 6.690 5.565 14 HB3 ALA 2 HB3 ALA 2 -0.820 5.607 5.763 15 H PHE 3 H PHE 3 1.010 6.535 2.593 16 HA PHE 3 HA PHE 3 -0.155 4.135 1.362 17 HB2 PHE 3 HB3 PHE 3 2.013 6.022 0.444 18 HB3 PHE 3 HB2 PHE 3 1.681 4.491 -0.354 19 HD1 PHE 3 HD1 PHE 3 -1.414 5.537 0.739 20 HD2 PHE 3 HD2 PHE 3 1.561 6.528 -2.141 21 HE1 PHE 3 HE1 PHE 3 -3.124 6.630 -0.649 22 HE2 PHE 3 HE2 PHE 3 -0.146 7.623 -3.531 23 HZ PHE 3 HZ PHE 3 -2.488 7.673 -2.784 24 H LEU 4 H LEU 4 0.608 2.204 1.899 25 HA LEU 4 HA LEU 4 3.354 2.018 2.943 26 HB2 LEU 4 HB3 LEU 4 1.811 1.779 4.792 27 HB3 LEU 4 HB2 LEU 4 0.896 0.566 3.916 28 HG LEU 4 HG LEU 4 2.782 -0.980 4.037 29 HD11 LEU 4 HD11 LEU 4 4.140 1.369 5.307 30 HD12 LEU 4 HD12 LEU 4 4.708 0.324 4.004 31 HD13 LEU 4 HD13 LEU 4 4.654 -0.281 5.660 32 HD21 LEU 4 HD21 LEU 4 2.417 0.054 6.818 33 HD22 LEU 4 HD22 LEU 4 2.464 -1.611 6.238 34 HD23 LEU 4 HD23 LEU 4 1.047 -0.609 5.928 35 H TRP 5 H TRP 5 4.552 0.911 1.539 36 HA TRP 5 HA TRP 5 3.700 -1.680 0.634 37 HB2 TRP 5 HB3 TRP 5 3.537 -1.314 -1.663 38 HB3 TRP 5 HB2 TRP 5 2.709 0.081 -0.986 39 HD1 TRP 5 HD1 TRP 5 5.841 -0.895 -2.928 40 HE1 TRP 5 HE1 TRP 5 6.933 1.234 -3.874 41 HE3 TRP 5 HE3 TRP 5 2.985 2.609 -0.543 42 HZ2 TRP 5 HZ2 TRP 5 6.626 4.030 -3.639 43 HZ3 TRP 5 HZ3 TRP 5 3.449 4.991 -0.962 44 HH2 TRP 5 HH2 TRP 5 5.230 5.684 -2.479 45 H ALA 6 H ALA 6 5.393 -2.854 -0.497 46 HA ALA 6 HA ALA 6 8.047 -1.920 0.345 47 HB1 ALA 6 HB1 ALA 6 8.638 -4.376 -0.200 48 HB2 ALA 6 HB2 ALA 6 6.893 -4.629 -0.197 49 HB3 ALA 6 HB3 ALA 6 7.699 -4.029 1.252 50 H GLN 7 H GLN 7 9.818 -1.927 -1.074 51 HA GLN 7 HA GLN 7 9.349 -2.527 -3.880 52 HB2 GLN 7 HB3 GLN 7 10.272 -0.252 -4.526 53 HB3 GLN 7 HB2 GLN 7 8.625 -0.280 -3.911 54 HG2 GLN 7 HG3 GLN 7 10.388 0.086 -1.716 55 HG3 GLN 7 HG2 GLN 7 10.830 1.227 -2.985 56 HE21 GLN 7 HE21 GLN 7 8.216 0.106 -0.936 57 HE22 GLN 7 HE22 GLN 7 7.272 1.550 -1.026 58 H ASP 8 H ASP 8 11.314 -2.476 -5.179 59 HA ASP 8 HA ASP 8 13.602 -3.304 -3.575 60 HB2 ASP 8 HB3 ASP 8 14.519 -4.205 -5.631 61 HB3 ASP 8 HB2 ASP 8 12.844 -4.716 -5.467 62 H ARG 9 H ARG 9 15.742 -2.751 -5.130 63 HA ARG 9 HA ARG 9 16.405 -0.148 -4.399 64 HB2 ARG 9 HB3 ARG 9 17.653 -2.308 -5.941 65 HB3 ARG 9 HB2 ARG 9 18.200 -0.698 -6.390 66 HG2 ARG 9 HG3 ARG 9 18.200 -1.775 -3.579 67 HG3 ARG 9 HG2 ARG 9 19.596 -1.782 -4.660 68 HD2 ARG 9 HD3 ARG 9 19.100 0.767 -4.862 69 HD3 ARG 9 HD2 ARG 9 18.213 0.527 -3.358 70 HE ARG 9 HE ARG 9 20.599 -0.609 -2.829 71 HH11 ARG 9 HH11 ARG 9 19.702 2.508 -4.116 72 HH12 ARG 9 HH12 ARG 9 21.089 3.315 -3.466 73 HH21 ARG 9 HH21 ARG 9 22.424 0.451 -1.972 74 HH22 ARG 9 HH22 ARG 9 22.634 2.148 -2.249 75 H ASP 10 H ASP 10 14.892 -1.300 -7.324 76 HA ASP 10 HA ASP 10 15.405 1.207 -8.712 77 HB2 ASP 10 HB3 ASP 10 13.743 -1.164 -9.592 78 HB3 ASP 10 HB2 ASP 10 14.263 0.181 -10.603 79 H GLY 11 H GLY 11 12.810 -0.475 -7.103 80 HA2 GLY 11 HA3 GLY 11 11.238 1.193 -6.002 81 HA3 GLY 11 HA2 GLY 11 11.021 1.815 -7.631 82 H LEU 12 H LEU 12 11.420 -1.489 -7.811 83 HA LEU 12 HA LEU 12 8.950 -2.107 -8.832 84 HB2 LEU 12 HB3 LEU 12 11.202 -3.487 -8.503 85 HB3 LEU 12 HB2 LEU 12 10.312 -4.157 -7.152 86 HG LEU 12 HG LEU 12 8.582 -4.992 -8.643 87 HD11 LEU 12 HD11 LEU 12 9.772 -4.612 -11.190 88 HD12 LEU 12 HD12 LEU 12 9.628 -3.033 -10.419 89 HD13 LEU 12 HD13 LEU 12 8.204 -4.053 -10.615 90 HD21 LEU 12 HD21 LEU 12 10.550 -6.143 -10.263 91 HD22 LEU 12 HD22 LEU 12 9.895 -6.775 -8.754 92 HD23 LEU 12 HD23 LEU 12 11.347 -5.776 -8.734 93 H ILE 13 H ILE 13 7.499 -3.890 -7.720 94 HA ILE 13 HA ILE 13 7.067 -3.485 -4.913 95 HB ILE 13 HB ILE 13 4.781 -2.736 -5.026 96 HG12 ILE 13 HG13 ILE 13 4.879 -2.022 -7.904 97 HG13 ILE 13 HG12 ILE 13 4.650 -3.726 -7.540 98 HG21 ILE 13 HG21 ILE 13 5.136 -0.459 -5.615 99 HG22 ILE 13 HG22 ILE 13 6.430 -0.887 -6.734 100 HG23 ILE 13 HG23 ILE 13 6.663 -1.089 -4.998 101 HD11 ILE 13 HD11 ILE 13 2.927 -1.461 -6.578 102 HD12 ILE 13 HD12 ILE 13 2.709 -3.160 -6.160 103 HD13 ILE 13 HD13 ILE 13 2.524 -2.630 -7.832 104 H GLY 14 H GLY 14 6.135 -4.913 -7.964 105 HA2 GLY 14 HA3 GLY 14 5.680 -7.449 -6.629 106 HA3 GLY 14 HA2 GLY 14 4.292 -6.767 -7.463 107 H LYS 15 H LYS 15 4.868 -9.071 -8.394 108 HA LYS 15 HA LYS 15 6.212 -8.558 -10.944 109 HB2 LYS 15 HB3 LYS 15 6.875 -11.117 -10.720 110 HB3 LYS 15 HB2 LYS 15 7.908 -9.843 -10.090 111 HG2 LYS 15 HG3 LYS 15 7.803 -11.505 -8.428 112 HG3 LYS 15 HG2 LYS 15 6.778 -10.183 -7.866 113 HD2 LYS 15 HD3 LYS 15 5.584 -12.186 -7.443 114 HD3 LYS 15 HD2 LYS 15 4.823 -11.442 -8.850 115 HE2 LYS 15 HE3 LYS 15 5.488 -13.093 -10.249 116 HE3 LYS 15 HE2 LYS 15 7.018 -13.334 -9.407 117 HZ1 LYS 15 HZ1 LYS 15 5.332 -14.230 -7.574 118 HZ2 LYS 15 HZ2 LYS 15 5.994 -15.223 -8.772 119 HZ3 LYS 15 HZ3 LYS 15 4.435 -14.596 -8.962 120 H ASP 16 H ASP 16 3.674 -8.234 -10.971 121 HA ASP 16 HA ASP 16 1.836 -8.873 -12.181 122 HB2 ASP 16 HB3 ASP 16 3.585 -10.477 -13.329 123 HB3 ASP 16 HB2 ASP 16 2.754 -11.714 -12.390 124 H GLY 17 H GLY 17 2.214 -9.078 -9.294 125 HA2 GLY 17 HA3 GLY 17 -0.251 -10.241 -8.597 126 HA3 GLY 17 HA2 GLY 17 1.033 -11.375 -8.204 127 H HIS 18 H HIS 18 2.979 -10.124 -7.079 128 HA HIS 18 HA HIS 18 2.397 -7.913 -5.431 129 HB2 HIS 18 HB3 HIS 18 2.144 -8.995 -3.265 130 HB3 HIS 18 HB2 HIS 18 0.866 -9.531 -4.350 131 HD1 HIS 18 HD1 HIS 18 1.332 -11.962 -5.487 132 HD2 HIS 18 HD2 HIS 18 3.527 -11.017 -2.087 133 HE1 HIS 18 HE1 HIS 18 2.213 -14.154 -4.625 134 HE2 HIS 18 HE2 HIS 18 3.458 -13.567 -2.514 135 H LEU 19 H LEU 19 3.977 -8.352 -3.245 136 HA LEU 19 HA LEU 19 6.574 -8.145 -4.334 137 HB2 LEU 19 HB3 LEU 19 7.318 -8.156 -1.960 138 HB3 LEU 19 HB2 LEU 19 6.074 -6.975 -2.318 139 HG LEU 19 HG LEU 19 4.540 -9.041 -1.476 140 HD11 LEU 19 HD11 LEU 19 7.026 -9.983 -0.878 141 HD12 LEU 19 HD12 LEU 19 5.536 -10.459 -0.063 142 HD13 LEU 19 HD13 LEU 19 6.561 -9.203 0.633 143 HD21 LEU 19 HD21 LEU 19 4.621 -6.620 -0.741 144 HD22 LEU 19 HD22 LEU 19 5.826 -7.121 0.446 145 HD23 LEU 19 HD23 LEU 19 4.198 -7.799 0.501 146 HA PRO 20 HA PRO 20 7.264 -12.596 -4.405 147 HB2 PRO 20 HB3 PRO 20 9.417 -12.590 -5.991 148 HB3 PRO 20 HB2 PRO 20 7.804 -12.242 -6.626 149 HG2 PRO 20 HG3 PRO 20 10.003 -10.345 -5.903 150 HG3 PRO 20 HG2 PRO 20 8.930 -10.325 -7.313 151 HD2 PRO 20 HD3 PRO 20 8.560 -8.781 -5.068 152 HD3 PRO 20 HD2 PRO 20 7.257 -9.263 -6.171 153 H TRP 21 H TRP 21 8.952 -10.242 -2.764 154 HA TRP 21 HA TRP 21 11.171 -11.995 -2.020 155 HB2 TRP 21 HB3 TRP 21 11.917 -9.953 -0.699 156 HB3 TRP 21 HB2 TRP 21 11.904 -9.783 -2.451 157 HD1 TRP 21 HD1 TRP 21 9.465 -9.002 0.475 158 HE1 TRP 21 HE1 TRP 21 8.304 -6.765 -0.046 159 HE3 TRP 21 HE3 TRP 21 11.557 -8.048 -4.090 160 HZ2 TRP 21 HZ2 TRP 21 8.274 -4.853 -2.123 161 HZ3 TRP 21 HZ3 TRP 21 10.907 -5.995 -5.279 162 HH2 TRP 21 HH2 TRP 21 9.299 -4.433 -4.315 163 H HIS 22 H HIS 22 11.493 -12.780 0.026 164 HA HIS 22 HA HIS 22 9.128 -12.989 1.679 165 HB2 HIS 22 HB3 HIS 22 10.725 -14.904 1.153 166 HB3 HIS 22 HB2 HIS 22 11.854 -14.143 2.270 167 HD1 HIS 22 HD1 HIS 22 11.488 -14.536 4.731 168 HD2 HIS 22 HD2 HIS 22 8.324 -15.881 2.398 169 HE1 HIS 22 HE1 HIS 22 10.009 -15.840 6.292 170 HE2 HIS 22 HE2 HIS 22 8.152 -16.724 4.837 171 H LEU 23 H LEU 23 8.789 -11.043 2.671 172 HA LEU 23 HA LEU 23 10.933 -10.064 4.439 173 HB2 LEU 23 HB3 LEU 23 9.204 -8.717 2.575 174 HB3 LEU 23 HB2 LEU 23 8.935 -8.091 4.190 175 HG LEU 23 HG LEU 23 11.496 -7.838 4.306 176 HD11 LEU 23 HD11 LEU 23 12.762 -8.056 2.458 177 HD12 LEU 23 HD12 LEU 23 11.481 -7.502 1.381 178 HD13 LEU 23 HD13 LEU 23 11.484 -9.166 1.967 179 HD21 LEU 23 HD21 LEU 23 10.487 -5.809 4.301 180 HD22 LEU 23 HD22 LEU 23 9.501 -6.179 2.887 181 HD23 LEU 23 HD23 LEU 23 11.195 -5.735 2.687 182 HA PRO 24 HA PRO 24 7.776 -11.912 7.285 183 HB2 PRO 24 HB3 PRO 24 10.161 -11.693 9.046 184 HB3 PRO 24 HB2 PRO 24 9.053 -13.049 8.813 185 HG2 PRO 24 HG3 PRO 24 11.503 -13.093 7.766 186 HG3 PRO 24 HG2 PRO 24 10.118 -13.761 6.883 187 HD2 PRO 24 HD3 PRO 24 11.556 -11.173 6.481 188 HD3 PRO 24 HD2 PRO 24 10.862 -12.279 5.278 189 H ASP 25 H ASP 25 10.229 -9.461 8.117 190 HA ASP 25 HA ASP 25 8.846 -8.286 10.235 191 HB2 ASP 25 HB3 ASP 25 10.320 -6.286 9.675 192 HB3 ASP 25 HB2 ASP 25 11.146 -7.793 10.034 193 H ASP 26 H ASP 26 8.747 -7.662 6.765 194 HA ASP 26 HA ASP 26 7.180 -5.301 6.933 195 HB2 ASP 26 HB3 ASP 26 8.585 -6.279 4.944 196 HB3 ASP 26 HB2 ASP 26 7.081 -7.105 4.543 197 H LEU 27 H LEU 27 6.343 -8.678 6.187 198 HA LEU 27 HA LEU 27 3.577 -8.265 5.921 199 HB2 LEU 27 HB3 LEU 27 4.829 -10.806 6.934 200 HB3 LEU 27 HB2 LEU 27 3.347 -10.623 6.016 201 HG LEU 27 HG LEU 27 5.784 -9.667 4.658 202 HD11 LEU 27 HD11 LEU 27 5.384 -12.613 4.659 203 HD12 LEU 27 HD12 LEU 27 6.290 -11.880 5.983 204 HD13 LEU 27 HD13 LEU 27 6.834 -11.668 4.319 205 HD21 LEU 27 HD21 LEU 27 4.602 -11.220 2.899 206 HD22 LEU 27 HD22 LEU 27 3.964 -9.620 3.276 207 HD23 LEU 27 HD23 LEU 27 3.236 -11.053 4.001 208 H HIS 28 H HIS 28 5.405 -9.582 8.684 209 HA HIS 28 HA HIS 28 3.288 -9.783 10.471 210 HB2 HIS 28 HB3 HIS 28 6.246 -9.440 10.803 211 HB3 HIS 28 HB2 HIS 28 5.201 -9.380 12.219 212 HD1 HIS 28 HD1 HIS 28 3.712 -11.591 12.620 213 HD2 HIS 28 HD2 HIS 28 6.873 -11.953 9.948 214 HE1 HIS 28 HE1 HIS 28 4.109 -14.062 12.380 215 HE2 HIS 28 HE2 HIS 28 6.083 -14.254 10.826 216 H TYR 29 H TYR 29 5.582 -7.084 10.080 217 HA TYR 29 HA TYR 29 4.456 -5.403 12.012 218 HB2 TYR 29 HB3 TYR 29 6.687 -5.092 10.917 219 HB3 TYR 29 HB2 TYR 29 5.850 -4.533 9.473 220 HD1 TYR 29 HD1 TYR 29 5.523 -3.817 13.133 221 HD2 TYR 29 HD2 TYR 29 6.030 -2.255 9.209 222 HE1 TYR 29 HE1 TYR 29 5.492 -1.533 14.045 223 HE2 TYR 29 HE2 TYR 29 6.002 0.033 10.109 224 HH TYR 29 HH TYR 29 6.485 1.155 12.304 225 H PHE 30 H PHE 30 3.520 -6.075 8.724 226 HA PHE 30 HA PHE 30 1.940 -3.840 8.181 227 HB2 PHE 30 HB3 PHE 30 2.583 -6.127 6.832 228 HB3 PHE 30 HB2 PHE 30 0.880 -6.400 7.183 229 HD1 PHE 30 HD1 PHE 30 -0.599 -4.175 6.761 230 HD2 PHE 30 HD2 PHE 30 3.054 -5.164 4.816 231 HE1 PHE 30 HE1 PHE 30 -1.222 -2.733 4.867 232 HE2 PHE 30 HE2 PHE 30 2.438 -3.723 2.919 233 HZ PHE 30 HZ PHE 30 0.298 -2.505 2.943 234 H ARG 31 H ARG 31 0.835 -7.028 9.348 235 HA ARG 31 HA ARG 31 -1.798 -6.209 9.896 236 HB2 ARG 31 HB3 ARG 31 -0.123 -8.565 10.474 237 HB3 ARG 31 HB2 ARG 31 -1.434 -8.294 11.613 238 HG2 ARG 31 HG3 ARG 31 -2.903 -8.069 9.494 239 HG3 ARG 31 HG2 ARG 31 -1.565 -8.892 8.690 240 HD2 ARG 31 HD3 ARG 31 -3.293 -10.463 9.447 241 HD3 ARG 31 HD2 ARG 31 -1.743 -10.751 10.237 242 HE ARG 31 HE ARG 31 -3.510 -9.045 11.733 243 HH11 ARG 31 HH11 ARG 31 -2.601 -12.348 11.069 244 HH12 ARG 31 HH12 ARG 31 -3.205 -12.949 12.577 245 HH21 ARG 31 HH21 ARG 31 -4.304 -9.833 13.716 246 HH22 ARG 31 HH22 ARG 31 -4.172 -11.521 14.080 247 H ALA 32 H ALA 32 1.139 -6.100 11.795 248 HA ALA 32 HA ALA 32 -0.059 -5.615 14.312 249 HB1 ALA 32 HB1 ALA 32 2.050 -5.503 15.103 250 HB2 ALA 32 HB2 ALA 32 2.594 -4.433 13.811 251 HB3 ALA 32 HB3 ALA 32 2.452 -6.166 13.519 252 H GLN 33 H GLN 33 0.701 -3.560 11.602 253 HA GLN 33 HA GLN 33 0.201 -1.144 13.159 254 HB2 GLN 33 HB3 GLN 33 1.617 -1.782 10.709 255 HB3 GLN 33 HB2 GLN 33 0.527 -0.422 10.481 256 HG2 GLN 33 HG3 GLN 33 1.994 -0.162 12.946 257 HG3 GLN 33 HG2 GLN 33 3.083 -0.377 11.576 258 HE21 GLN 33 HE21 GLN 33 2.945 1.110 9.825 259 HE22 GLN 33 HE22 GLN 33 2.336 2.707 10.077 260 H THR 34 H THR 34 -1.347 -3.207 10.827 261 HA THR 34 HA THR 34 -3.475 -1.270 10.351 262 HB THR 34 HB THR 34 -4.366 -3.103 8.842 263 HG1 THR 34 HG1 THR 34 -1.811 -4.250 9.221 264 HG21 THR 34 HG21 THR 34 -2.496 -2.906 7.156 265 HG22 THR 34 HG22 THR 34 -1.649 -1.933 8.358 266 HG23 THR 34 HG23 THR 34 -3.207 -1.398 7.728 267 H VAL 35 H VAL 35 -3.215 -2.257 13.018 268 HA VAL 35 HA VAL 35 -5.363 -4.194 13.349 269 HB VAL 35 HB VAL 35 -3.829 -2.794 15.536 270 HG11 VAL 35 HG11 VAL 35 -4.864 -4.165 16.988 271 HG12 VAL 35 HG12 VAL 35 -4.816 -5.539 15.883 272 HG13 VAL 35 HG13 VAL 35 -6.070 -4.311 15.710 273 HG21 VAL 35 HG21 VAL 35 -3.175 -5.409 14.179 274 HG22 VAL 35 HG22 VAL 35 -2.353 -4.741 15.589 275 HG23 VAL 35 HG23 VAL 35 -2.255 -3.912 14.036 276 H GLY 36 H GLY 36 -7.362 -3.404 13.161 277 HA2 GLY 36 HA3 GLY 36 -9.247 -2.261 13.890 278 HA3 GLY 36 HA2 GLY 36 -8.227 -1.332 14.978 279 H LYS 37 H LYS 37 -7.348 -1.525 11.636 280 HA LYS 37 HA LYS 37 -8.376 1.207 11.224 281 HB2 LYS 37 HB3 LYS 37 -5.709 0.020 10.485 282 HB3 LYS 37 HB2 LYS 37 -6.334 1.458 9.690 283 HG2 LYS 37 HG3 LYS 37 -6.635 2.207 12.243 284 HG3 LYS 37 HG2 LYS 37 -5.263 1.110 12.416 285 HD2 LYS 37 HD3 LYS 37 -5.002 2.903 10.134 286 HD3 LYS 37 HD2 LYS 37 -5.138 3.762 11.669 287 HE2 LYS 37 HE3 LYS 37 -3.177 2.905 12.480 288 HE3 LYS 37 HE2 LYS 37 -3.297 1.432 11.518 289 HZ1 LYS 37 HZ1 LYS 37 -2.544 2.544 9.613 290 HZ2 LYS 37 HZ2 LYS 37 -1.526 3.083 10.852 291 HZ3 LYS 37 HZ3 LYS 37 -2.776 4.076 10.293 292 H ILE 38 H ILE 38 -8.010 1.665 8.661 293 HA ILE 38 HA ILE 38 -9.317 -0.585 7.273 294 HB ILE 38 HB ILE 38 -9.861 1.903 5.944 295 HG12 ILE 38 HG13 ILE 38 -11.019 1.817 8.726 296 HG13 ILE 38 HG12 ILE 38 -9.571 2.743 8.352 297 HG21 ILE 38 HG21 ILE 38 -11.048 -0.407 6.003 298 HG22 ILE 38 HG22 ILE 38 -12.003 1.062 5.806 299 HG23 ILE 38 HG23 ILE 38 -11.910 0.276 7.382 300 HD11 ILE 38 HD11 ILE 38 -11.083 4.381 8.048 301 HD12 ILE 38 HD12 ILE 38 -12.384 3.258 7.650 302 HD13 ILE 38 HD13 ILE 38 -11.175 3.674 6.435 303 H MET 39 H MET 39 -8.416 -1.283 5.436 304 HA MET 39 HA MET 39 -6.247 0.340 4.270 305 HB2 MET 39 HB3 MET 39 -5.300 -1.603 5.322 306 HB3 MET 39 HB2 MET 39 -6.476 -2.658 4.555 307 HG2 MET 39 HG3 MET 39 -5.371 -1.640 2.361 308 HG3 MET 39 HG2 MET 39 -4.012 -1.437 3.463 309 HE1 MET 39 HE1 MET 39 -6.545 -4.563 3.928 310 HE2 MET 39 HE2 MET 39 -6.032 -5.454 2.495 311 HE3 MET 39 HE3 MET 39 -6.748 -3.852 2.327 312 H VAL 40 H VAL 40 -6.452 0.898 2.203 313 HA VAL 40 HA VAL 40 -8.729 -0.077 0.686 314 HB VAL 40 HB VAL 40 -6.678 1.980 -0.137 315 HG11 VAL 40 HG11 VAL 40 -8.471 0.725 -1.713 316 HG12 VAL 40 HG12 VAL 40 -7.920 2.379 -1.976 317 HG13 VAL 40 HG13 VAL 40 -9.444 2.080 -1.141 318 HG21 VAL 40 HG21 VAL 40 -9.395 2.667 0.906 319 HG22 VAL 40 HG22 VAL 40 -7.941 3.662 0.824 320 HG23 VAL 40 HG23 VAL 40 -8.066 2.380 2.028 321 H VAL 41 H VAL 41 -8.630 -1.559 -0.887 322 HA VAL 41 HA VAL 41 -5.976 -2.257 -1.952 323 HB VAL 41 HB VAL 41 -7.146 -3.908 -0.315 324 HG11 VAL 41 HG11 VAL 41 -8.359 -5.590 -2.096 325 HG12 VAL 41 HG12 VAL 41 -8.953 -4.014 -2.608 326 HG13 VAL 41 HG13 VAL 41 -9.189 -4.546 -0.946 327 HG21 VAL 41 HG21 VAL 41 -5.507 -5.215 -1.007 328 HG22 VAL 41 HG22 VAL 41 -5.330 -4.197 -2.436 329 HG23 VAL 41 HG23 VAL 41 -6.390 -5.606 -2.482 330 H GLY 42 H GLY 42 -5.857 -2.931 -4.131 331 HA2 GLY 42 HA3 GLY 42 -7.916 -1.738 -5.798 332 HA3 GLY 42 HA2 GLY 42 -6.357 -2.338 -6.339 333 H ARG 43 H ARG 43 -8.453 -2.909 -7.902 334 HA ARG 43 HA ARG 43 -9.938 -5.192 -7.318 335 HB2 ARG 43 HB3 ARG 43 -10.382 -3.700 -9.240 336 HB3 ARG 43 HB2 ARG 43 -8.939 -4.323 -10.031 337 HG2 ARG 43 HG3 ARG 43 -10.164 -6.636 -9.600 338 HG3 ARG 43 HG2 ARG 43 -11.585 -5.591 -9.633 339 HD2 ARG 43 HD3 ARG 43 -9.474 -5.713 -11.784 340 HD3 ARG 43 HD2 ARG 43 -11.025 -6.549 -11.841 341 HE ARG 43 HE ARG 43 -11.024 -3.644 -11.523 342 HH11 ARG 43 HH11 ARG 43 -11.586 -6.423 -13.572 343 HH12 ARG 43 HH12 ARG 43 -12.519 -5.532 -14.725 344 HH21 ARG 43 HH21 ARG 43 -12.243 -2.486 -13.044 345 HH22 ARG 43 HH22 ARG 43 -12.891 -3.299 -14.428 346 H ARG 44 H ARG 44 -7.036 -5.027 -9.386 347 HA ARG 44 HA ARG 44 -6.641 -7.811 -9.495 348 HB2 ARG 44 HB3 ARG 44 -4.628 -5.579 -9.824 349 HB3 ARG 44 HB2 ARG 44 -4.385 -7.249 -10.320 350 HG2 ARG 44 HG3 ARG 44 -6.658 -5.615 -11.388 351 HG3 ARG 44 HG2 ARG 44 -5.046 -5.540 -12.102 352 HD2 ARG 44 HD3 ARG 44 -5.499 -7.370 -13.271 353 HD3 ARG 44 HD2 ARG 44 -5.682 -8.272 -11.767 354 HE ARG 44 HE ARG 44 -8.079 -7.099 -12.010 355 HH11 ARG 44 HH11 ARG 44 -6.146 -8.922 -14.276 356 HH12 ARG 44 HH12 ARG 44 -7.515 -9.529 -15.145 357 HH21 ARG 44 HH21 ARG 44 -9.879 -7.897 -13.154 358 HH22 ARG 44 HH22 ARG 44 -9.634 -8.948 -14.509 359 H THR 45 H THR 45 -6.035 -5.504 -7.052 360 HA THR 45 HA THR 45 -3.902 -6.874 -5.735 361 HB THR 45 HB THR 45 -5.641 -5.024 -4.208 362 HG1 THR 45 HG1 THR 45 -4.300 -4.305 -6.575 363 HG21 THR 45 HG21 THR 45 -3.418 -5.835 -3.403 364 HG22 THR 45 HG22 THR 45 -3.606 -4.082 -3.449 365 HG23 THR 45 HG23 THR 45 -2.686 -4.904 -4.709 366 H TYR 46 H TYR 46 -7.377 -6.440 -4.922 367 HA TYR 46 HA TYR 46 -7.446 -8.020 -2.664 368 HB2 TYR 46 HB3 TYR 46 -9.813 -8.218 -2.952 369 HB3 TYR 46 HB2 TYR 46 -9.353 -6.638 -3.569 370 HD1 TYR 46 HD2 TYR 46 -9.763 -10.131 -4.871 371 HD2 TYR 46 HD1 TYR 46 -10.378 -5.968 -5.531 372 HE1 TYR 46 HE2 TYR 46 -10.856 -10.639 -6.997 373 HE2 TYR 46 HE1 TYR 46 -11.494 -6.477 -7.660 374 HH TYR 46 HH TYR 46 -12.288 -9.736 -8.602 375 H GLU 47 H GLU 47 -7.616 -9.027 -6.043 376 HA GLU 47 HA GLU 47 -8.029 -11.797 -5.412 377 HB2 GLU 47 HB3 GLU 47 -8.083 -10.162 -7.747 378 HB3 GLU 47 HB2 GLU 47 -6.961 -11.483 -8.040 379 HG2 GLU 47 HG3 GLU 47 -9.427 -12.370 -6.791 380 HG3 GLU 47 HG2 GLU 47 -9.693 -11.562 -8.335 381 H SER 48 H SER 48 -5.335 -9.706 -5.689 382 HA SER 48 HA SER 48 -3.476 -11.983 -5.790 383 HB2 SER 48 HB3 SER 48 -3.115 -9.058 -6.431 384 HB3 SER 48 HB2 SER 48 -1.748 -10.152 -6.225 385 HG SER 48 HG SER 48 -3.868 -10.698 -8.016 386 H PHE 49 H PHE 49 -5.033 -10.828 -3.422 387 HA PHE 49 HA PHE 49 -2.781 -10.054 -1.712 388 HB2 PHE 49 HB3 PHE 49 -5.347 -9.045 -1.899 389 HB3 PHE 49 HB2 PHE 49 -5.421 -10.057 -0.461 390 HD1 PHE 49 HD1 PHE 49 -3.584 -7.252 -2.029 391 HD2 PHE 49 HD2 PHE 49 -4.478 -9.347 1.565 392 HE1 PHE 49 HE1 PHE 49 -2.510 -5.466 -0.726 393 HE2 PHE 49 HE2 PHE 49 -3.406 -7.565 2.877 394 HZ PHE 49 HZ PHE 49 -2.418 -5.619 1.730 395 HA PRO 50 HA PRO 50 -2.650 -14.315 -0.289 396 HB2 PRO 50 HB3 PRO 50 -1.006 -13.103 1.861 397 HB3 PRO 50 HB2 PRO 50 -0.626 -14.439 0.770 398 HG2 PRO 50 HG3 PRO 50 0.500 -12.043 0.447 399 HG3 PRO 50 HG2 PRO 50 0.021 -13.028 -0.948 400 HD2 PRO 50 HD3 PRO 50 -1.339 -10.650 0.253 401 HD3 PRO 50 HD2 PRO 50 -1.143 -11.095 -1.455 402 H LYS 51 H LYS 51 -3.521 -11.528 1.637 403 HA LYS 51 HA LYS 51 -5.037 -13.305 3.438 404 HB2 LYS 51 HB3 LYS 51 -3.005 -11.827 4.305 405 HB3 LYS 51 HB2 LYS 51 -4.241 -10.578 4.339 406 HG2 LYS 51 HG3 LYS 51 -4.358 -11.417 6.472 407 HG3 LYS 51 HG2 LYS 51 -5.617 -12.345 5.655 408 HD2 LYS 51 HD3 LYS 51 -4.466 -14.290 5.804 409 HD3 LYS 51 HD2 LYS 51 -2.902 -13.502 5.591 410 HE2 LYS 51 HE3 LYS 51 -3.124 -12.621 7.922 411 HE3 LYS 51 HE2 LYS 51 -4.565 -13.621 8.101 412 HZ1 LYS 51 HZ1 LYS 51 -3.055 -15.077 8.890 413 HZ2 LYS 51 HZ2 LYS 51 -1.763 -14.400 8.034 414 HZ3 LYS 51 HZ3 LYS 51 -2.843 -15.440 7.251 415 H ARG 52 H ARG 52 -6.827 -13.148 1.989 416 HA ARG 52 HA ARG 52 -8.191 -10.540 2.098 417 HB2 ARG 52 HB3 ARG 52 -9.365 -11.370 -0.017 418 HB3 ARG 52 HB2 ARG 52 -7.689 -10.862 -0.169 419 HG2 ARG 52 HG3 ARG 52 -6.924 -13.099 -0.283 420 HG3 ARG 52 HG2 ARG 52 -8.496 -13.732 0.209 421 HD2 ARG 52 HD3 ARG 52 -9.292 -13.667 -1.878 422 HD3 ARG 52 HD2 ARG 52 -8.643 -12.053 -2.165 423 HE ARG 52 HE ARG 52 -6.832 -13.002 -3.193 424 HH11 ARG 52 HH11 ARG 52 -8.516 -15.463 -1.380 425 HH12 ARG 52 HH12 ARG 52 -7.562 -16.761 -2.016 426 HH21 ARG 52 HH21 ARG 52 -5.575 -14.707 -4.030 427 HH22 ARG 52 HH22 ARG 52 -5.892 -16.332 -3.520 428 HA PRO 53 HA PRO 53 -9.268 -9.692 3.223 429 HB2 PRO 53 HB3 PRO 53 -10.831 -9.148 5.332 430 HB3 PRO 53 HB2 PRO 53 -11.472 -9.205 3.687 431 HG2 PRO 53 HG3 PRO 53 -11.800 -11.129 5.904 432 HG3 PRO 53 HG2 PRO 53 -12.857 -10.814 4.518 433 HD2 PRO 53 HD3 PRO 53 -10.961 -12.930 4.832 434 HD3 PRO 53 HD2 PRO 53 -11.966 -12.573 3.415 435 H LEU 54 H LEU 54 -8.138 -8.576 4.938 436 HA LEU 54 HA LEU 54 -6.395 -10.264 6.419 437 HB2 LEU 54 HB3 LEU 54 -6.815 -7.287 6.356 438 HB3 LEU 54 HB2 LEU 54 -5.640 -8.039 7.418 439 HG LEU 54 HG LEU 54 -5.328 -8.935 4.671 440 HD11 LEU 54 HD11 LEU 54 -5.220 -7.044 3.501 441 HD12 LEU 54 HD12 LEU 54 -4.356 -6.201 4.787 442 HD13 LEU 54 HD13 LEU 54 -6.116 -6.295 4.823 443 HD21 LEU 54 HD21 LEU 54 -3.693 -9.211 6.506 444 HD22 LEU 54 HD22 LEU 54 -3.460 -7.463 6.525 445 HD23 LEU 54 HD23 LEU 54 -3.018 -8.397 5.095 446 HA PRO 55 HA PRO 55 -8.933 -10.698 10.051 447 HB2 PRO 55 HB3 PRO 55 -6.521 -11.481 11.504 448 HB3 PRO 55 HB2 PRO 55 -7.931 -12.451 11.075 449 HG2 PRO 55 HG3 PRO 55 -5.512 -12.818 9.927 450 HG3 PRO 55 HG2 PRO 55 -7.034 -13.107 9.065 451 HD2 PRO 55 HD3 PRO 55 -5.190 -10.751 8.919 452 HD3 PRO 55 HD2 PRO 55 -6.048 -11.596 7.613 453 H GLU 56 H GLU 56 -9.275 -9.807 12.092 454 HA GLU 56 HA GLU 56 -9.386 -8.068 13.552 455 HB2 GLU 56 HB3 GLU 56 -6.595 -9.020 13.535 456 HB3 GLU 56 HB2 GLU 56 -6.848 -7.447 14.279 457 HG2 GLU 56 HG3 GLU 56 -7.478 -8.467 16.131 458 HG3 GLU 56 HG2 GLU 56 -8.878 -9.105 15.270 459 H ARG 57 H ARG 57 -9.184 -7.296 10.700 460 HA ARG 57 HA ARG 57 -8.608 -4.502 11.188 461 HB2 ARG 57 HB3 ARG 57 -6.960 -4.174 9.577 462 HB3 ARG 57 HB2 ARG 57 -6.473 -5.672 10.350 463 HG2 ARG 57 HG3 ARG 57 -6.173 -6.178 8.136 464 HG3 ARG 57 HG2 ARG 57 -7.800 -6.795 8.418 465 HD2 ARG 57 HD3 ARG 57 -7.271 -5.315 6.319 466 HD3 ARG 57 HD2 ARG 57 -8.791 -5.136 7.188 467 HE ARG 57 HE ARG 57 -8.146 -3.033 7.828 468 HH11 ARG 57 HH11 ARG 57 -5.376 -4.740 6.567 469 HH12 ARG 57 HH12 ARG 57 -4.353 -3.343 6.584 470 HH21 ARG 57 HH21 ARG 57 -6.802 -1.198 7.857 471 HH22 ARG 57 HH22 ARG 57 -5.162 -1.332 7.317 472 H THR 58 H THR 58 -9.378 -3.088 9.450 473 HA THR 58 HA THR 58 -11.784 -4.209 8.239 474 HB THR 58 HB THR 58 -10.978 -1.316 8.121 475 HG1 THR 58 HG1 THR 58 -12.046 -2.731 10.319 476 HG21 THR 58 HG21 THR 58 -13.547 -1.194 8.586 477 HG22 THR 58 HG22 THR 58 -13.527 -2.829 7.926 478 HG23 THR 58 HG23 THR 58 -12.933 -1.480 6.958 479 H ASN 59 H ASN 59 -11.768 -4.881 6.204 480 HA ASN 59 HA ASN 59 -9.610 -4.034 4.435 481 HB2 ASN 59 HB3 ASN 59 -11.630 -6.263 4.317 482 HB3 ASN 59 HB2 ASN 59 -10.617 -5.850 2.936 483 HD21 ASN 59 HD21 ASN 59 -10.301 -6.439 6.418 484 HD22 ASN 59 HD22 ASN 59 -8.864 -7.390 6.301 485 H VAL 60 H VAL 60 -9.918 -3.201 2.387 486 HA VAL 60 HA VAL 60 -12.615 -2.325 1.651 487 HB VAL 60 HB VAL 60 -10.199 -0.512 1.777 488 HG11 VAL 60 HG11 VAL 60 -12.310 1.096 1.161 489 HG12 VAL 60 HG12 VAL 60 -12.678 -0.350 0.221 490 HG13 VAL 60 HG13 VAL 60 -11.138 0.480 -0.004 491 HG21 VAL 60 HG21 VAL 60 -12.800 -0.563 3.291 492 HG22 VAL 60 HG22 VAL 60 -11.707 0.821 3.279 493 HG23 VAL 60 HG23 VAL 60 -11.166 -0.722 3.937 494 H VAL 61 H VAL 61 -13.027 -2.728 -0.433 495 HA VAL 61 HA VAL 61 -10.757 -3.385 -2.183 496 HB VAL 61 HB VAL 61 -13.630 -4.304 -2.248 497 HG11 VAL 61 HG11 VAL 61 -12.312 -5.775 -4.157 498 HG12 VAL 61 HG12 VAL 61 -11.681 -4.148 -4.411 499 HG13 VAL 61 HG13 VAL 61 -13.420 -4.439 -4.468 500 HG21 VAL 61 HG21 VAL 61 -12.672 -6.514 -1.932 501 HG22 VAL 61 HG22 VAL 61 -12.149 -5.429 -0.644 502 HG23 VAL 61 HG23 VAL 61 -11.045 -5.833 -1.959 503 H LEU 62 H LEU 62 -10.514 -2.445 -4.149 504 HA LEU 62 HA LEU 62 -12.464 -0.371 -4.907 505 HB2 LEU 62 HB3 LEU 62 -10.287 0.491 -3.958 506 HB3 LEU 62 HB2 LEU 62 -9.488 -0.211 -5.350 507 HG LEU 62 HG LEU 62 -10.904 1.249 -6.816 508 HD11 LEU 62 HD11 LEU 62 -12.129 3.062 -5.893 509 HD12 LEU 62 HD12 LEU 62 -11.561 2.700 -4.263 510 HD13 LEU 62 HD13 LEU 62 -12.675 1.598 -5.076 511 HD21 LEU 62 HD21 LEU 62 -8.769 2.095 -4.994 512 HD22 LEU 62 HD22 LEU 62 -9.706 3.418 -5.688 513 HD23 LEU 62 HD23 LEU 62 -8.901 2.258 -6.745 514 H THR 63 H THR 63 -13.521 -1.483 -6.486 515 HA THR 63 HA THR 63 -11.940 -2.234 -8.842 516 HB THR 63 HB THR 63 -12.610 -4.276 -7.642 517 HG1 THR 63 HG1 THR 63 -14.267 -4.144 -9.906 518 HG21 THR 63 HG21 THR 63 -14.666 -4.774 -6.923 519 HG22 THR 63 HG22 THR 63 -15.450 -4.015 -8.308 520 HG23 THR 63 HG23 THR 63 -14.898 -3.026 -6.957 521 H HIS 64 H HIS 64 -12.807 -1.645 -10.803 522 HA HIS 64 HA HIS 64 -14.671 0.459 -10.862 523 HB2 HIS 64 HB3 HIS 64 -13.734 -1.334 -13.110 524 HB3 HIS 64 HB2 HIS 64 -14.627 0.166 -13.325 525 HD1 HIS 64 HD1 HIS 64 -13.348 2.376 -12.944 526 HD2 HIS 64 HD2 HIS 64 -11.021 -1.035 -12.484 527 HE1 HIS 64 HE1 HIS 64 -10.967 3.184 -12.926 528 HE2 HIS 64 HE2 HIS 64 -9.575 1.093 -12.749 529 H GLN 65 H GLN 65 -15.045 -2.997 -11.186 530 HA GLN 65 HA GLN 65 -17.476 -3.233 -12.438 531 HB2 GLN 65 HB3 GLN 65 -16.134 -4.834 -10.292 532 HB3 GLN 65 HB2 GLN 65 -17.770 -5.246 -10.788 533 HG2 GLN 65 HG3 GLN 65 -17.118 -5.933 -12.870 534 HG3 GLN 65 HG2 GLN 65 -15.685 -4.906 -12.880 535 HE21 GLN 65 HE21 GLN 65 -13.968 -5.525 -11.318 536 HE22 GLN 65 HE22 GLN 65 -13.672 -7.209 -11.076 537 H GLU 66 H GLU 66 -19.506 -2.703 -11.995 538 HA GLU 66 HA GLU 66 -20.103 -1.319 -9.528 539 HB2 GLU 66 HB3 GLU 66 -22.273 -0.851 -10.555 540 HB3 GLU 66 HB2 GLU 66 -20.960 -0.453 -11.655 541 HG2 GLU 66 HG3 GLU 66 -21.445 -2.963 -12.444 542 HG3 GLU 66 HG2 GLU 66 -23.049 -2.526 -11.858 543 H ASP 67 H ASP 67 -20.865 -4.370 -11.070 544 HA ASP 67 HA ASP 67 -22.663 -5.106 -8.895 545 HB2 ASP 67 HB3 ASP 67 -22.106 -6.164 -11.623 546 HB3 ASP 67 HB2 ASP 67 -22.705 -7.292 -10.410 547 H TYR 68 H TYR 68 -19.596 -4.897 -8.708 548 HA TYR 68 HA TYR 68 -18.693 -7.579 -8.311 549 HB2 TYR 68 HB3 TYR 68 -17.173 -5.657 -8.808 550 HB3 TYR 68 HB2 TYR 68 -17.499 -5.034 -7.193 551 HD1 TYR 68 HD1 TYR 68 -15.958 -7.808 -9.080 552 HD2 TYR 68 HD2 TYR 68 -16.422 -5.958 -5.277 553 HE1 TYR 68 HE1 TYR 68 -14.155 -9.216 -8.182 554 HE2 TYR 68 HE2 TYR 68 -14.617 -7.361 -4.370 555 HH TYR 68 HH TYR 68 -12.599 -8.605 -5.312 556 H GLN 69 H GLN 69 -18.263 -8.642 -6.338 557 HA GLN 69 HA GLN 69 -19.634 -7.529 -3.985 558 HB2 GLN 69 HB3 GLN 69 -19.727 -10.453 -4.704 559 HB3 GLN 69 HB2 GLN 69 -20.671 -9.607 -3.486 560 HG2 GLN 69 HG3 GLN 69 -20.904 -9.142 -6.449 561 HG3 GLN 69 HG2 GLN 69 -21.952 -10.208 -5.514 562 HE21 GLN 69 HE21 GLN 69 -22.167 -7.507 -7.017 563 HE22 GLN 69 HE22 GLN 69 -23.103 -6.540 -5.933 564 H ALA 70 H ALA 70 -17.984 -7.090 -2.652 565 HA ALA 70 HA ALA 70 -15.834 -9.068 -2.354 566 HB1 ALA 70 HB1 ALA 70 -15.774 -6.361 -1.087 567 HB2 ALA 70 HB2 ALA 70 -15.440 -6.539 -2.809 568 HB3 ALA 70 HB3 ALA 70 -14.437 -7.376 -1.625 569 H GLN 71 H GLN 71 -16.699 -10.573 -0.986 570 HA GLN 71 HA GLN 71 -18.193 -9.890 1.342 571 HB2 GLN 71 HB3 GLN 71 -17.011 -12.415 0.250 572 HB3 GLN 71 HB2 GLN 71 -17.610 -12.381 1.902 573 HG2 GLN 71 HG3 GLN 71 -19.595 -12.889 1.056 574 HG3 GLN 71 HG2 GLN 71 -19.656 -11.231 0.460 575 HE21 GLN 71 HE21 GLN 71 -17.791 -14.067 -0.563 576 HE22 GLN 71 HE22 GLN 71 -18.347 -14.058 -2.198 577 H GLY 72 H GLY 72 -17.452 -9.182 3.222 578 HA2 GLY 72 HA3 GLY 72 -16.068 -9.475 5.153 579 HA3 GLY 72 HA2 GLY 72 -14.785 -10.048 4.102 580 H ALA 73 H ALA 73 -15.396 -7.700 2.221 581 HA ALA 73 HA ALA 73 -14.196 -5.579 3.870 582 HB1 ALA 73 HB1 ALA 73 -13.400 -6.313 1.055 583 HB2 ALA 73 HB2 ALA 73 -12.473 -6.679 2.510 584 HB3 ALA 73 HB3 ALA 73 -12.724 -5.003 2.022 585 H VAL 74 H VAL 74 -14.281 -3.410 2.649 586 HA VAL 74 HA VAL 74 -17.031 -2.979 1.850 587 HB VAL 74 HB VAL 74 -14.892 -0.864 1.842 588 HG11 VAL 74 HG11 VAL 74 -17.844 -0.963 1.837 589 HG12 VAL 74 HG12 VAL 74 -16.744 0.193 1.088 590 HG13 VAL 74 HG13 VAL 74 -17.100 0.305 2.811 591 HG21 VAL 74 HG21 VAL 74 -14.516 -1.630 3.981 592 HG22 VAL 74 HG22 VAL 74 -16.175 -2.194 4.186 593 HG23 VAL 74 HG23 VAL 74 -15.814 -0.470 4.261 594 H VAL 75 H VAL 75 -17.745 -2.338 -0.159 595 HA VAL 75 HA VAL 75 -15.773 -2.595 -2.330 596 HB VAL 75 HB VAL 75 -18.760 -3.000 -2.502 597 HG11 VAL 75 HG11 VAL 75 -18.535 -3.270 -4.712 598 HG12 VAL 75 HG12 VAL 75 -17.046 -4.200 -4.538 599 HG13 VAL 75 HG13 VAL 75 -16.992 -2.437 -4.524 600 HG21 VAL 75 HG21 VAL 75 -18.507 -5.202 -2.070 601 HG22 VAL 75 HG22 VAL 75 -17.081 -4.649 -1.192 602 HG23 VAL 75 HG23 VAL 75 -16.919 -5.277 -2.832 603 H VAL 76 H VAL 76 -15.502 -1.053 -3.801 604 HA VAL 76 HA VAL 76 -17.435 1.058 -4.199 605 HB VAL 76 HB VAL 76 -15.887 2.898 -3.773 606 HG11 VAL 76 HG11 VAL 76 -16.133 2.979 -1.449 607 HG12 VAL 76 HG12 VAL 76 -15.951 1.233 -1.278 608 HG13 VAL 76 HG13 VAL 76 -17.420 1.901 -1.988 609 HG21 VAL 76 HG21 VAL 76 -13.937 1.617 -2.137 610 HG22 VAL 76 HG22 VAL 76 -13.701 2.589 -3.592 611 HG23 VAL 76 HG23 VAL 76 -13.940 0.847 -3.724 612 H HIS 77 H HIS 77 -16.580 2.606 -5.967 613 HA HIS 77 HA HIS 77 -14.750 1.158 -7.759 614 HB2 HIS 77 HB3 HIS 77 -17.091 2.555 -8.965 615 HB3 HIS 77 HB2 HIS 77 -16.194 1.156 -9.547 616 HD1 HIS 77 HD1 HIS 77 -16.521 -0.812 -7.287 617 HD2 HIS 77 HD2 HIS 77 -19.610 1.631 -8.609 618 HE1 HIS 77 HE1 HIS 77 -18.641 -1.964 -6.575 619 HE2 HIS 77 HE2 HIS 77 -20.497 -0.509 -7.461 620 H ASP 78 H ASP 78 -15.643 4.146 -6.377 621 HA ASP 78 HA ASP 78 -13.785 5.506 -8.209 622 HB2 ASP 78 HB3 ASP 78 -16.561 6.252 -7.476 623 HB3 ASP 78 HB2 ASP 78 -15.386 7.561 -7.549 624 H VAL 79 H VAL 79 -12.990 7.612 -7.279 625 HA VAL 79 HA VAL 79 -11.864 7.116 -4.726 626 HB VAL 79 HB VAL 79 -11.106 9.583 -5.024 627 HG11 VAL 79 HG11 VAL 79 -10.240 7.217 -6.629 628 HG12 VAL 79 HG12 VAL 79 -9.468 7.955 -5.225 629 HG13 VAL 79 HG13 VAL 79 -9.413 8.767 -6.790 630 HG21 VAL 79 HG21 VAL 79 -11.524 10.682 -6.937 631 HG22 VAL 79 HG22 VAL 79 -12.896 9.581 -7.059 632 HG23 VAL 79 HG23 VAL 79 -11.399 9.221 -7.917 633 H ALA 80 H ALA 80 -14.410 9.233 -5.916 634 HA ALA 80 HA ALA 80 -14.800 10.657 -3.503 635 HB1 ALA 80 HB1 ALA 80 -15.745 11.746 -5.295 636 HB2 ALA 80 HB2 ALA 80 -17.167 10.982 -4.584 637 HB3 ALA 80 HB3 ALA 80 -16.392 10.262 -5.994 638 H ALA 81 H ALA 81 -16.319 7.767 -4.867 639 HA ALA 81 HA ALA 81 -18.304 7.348 -2.975 640 HB1 ALA 81 HB1 ALA 81 -16.797 4.992 -4.001 641 HB2 ALA 81 HB2 ALA 81 -17.636 6.028 -5.156 642 HB3 ALA 81 HB3 ALA 81 -18.537 5.245 -3.858 643 H VAL 82 H VAL 82 -15.139 5.693 -3.004 644 HA VAL 82 HA VAL 82 -15.226 4.563 -0.516 645 HB VAL 82 HB VAL 82 -13.426 4.413 -2.388 646 HG11 VAL 82 HG11 VAL 82 -12.856 6.951 -1.733 647 HG12 VAL 82 HG12 VAL 82 -11.680 5.840 -2.429 648 HG13 VAL 82 HG13 VAL 82 -11.716 6.108 -0.686 649 HG21 VAL 82 HG21 VAL 82 -11.963 3.297 -0.928 650 HG22 VAL 82 HG22 VAL 82 -13.558 3.156 -0.188 651 HG23 VAL 82 HG23 VAL 82 -12.399 4.332 0.431 652 H PHE 83 H PHE 83 -14.549 7.924 -1.313 653 HA PHE 83 HA PHE 83 -13.431 8.678 1.157 654 HB2 PHE 83 HB3 PHE 83 -14.633 10.086 -1.153 655 HB3 PHE 83 HB2 PHE 83 -14.647 10.967 0.370 656 HD1 PHE 83 HD2 PHE 83 -12.141 10.170 1.608 657 HD2 PHE 83 HD1 PHE 83 -13.007 11.059 -2.462 658 HE1 PHE 83 HE2 PHE 83 -9.793 10.814 1.254 659 HE2 PHE 83 HE1 PHE 83 -10.660 11.705 -2.824 660 HZ PHE 83 HZ PHE 83 -9.050 11.584 -0.964 661 H ALA 84 H ALA 84 -16.779 8.454 0.059 662 HA ALA 84 HA ALA 84 -17.977 9.683 2.290 663 HB1 ALA 84 HB1 ALA 84 -19.190 7.439 0.685 664 HB2 ALA 84 HB2 ALA 84 -19.106 9.103 0.109 665 HB3 ALA 84 HB3 ALA 84 -20.026 8.719 1.563 666 H TYR 85 H TYR 85 -16.973 6.386 1.635 667 HA TYR 85 HA TYR 85 -18.046 5.186 3.942 668 HB2 TYR 85 HB3 TYR 85 -17.147 3.336 3.047 669 HB3 TYR 85 HB2 TYR 85 -16.457 4.342 1.784 670 HD1 TYR 85 HD1 TYR 85 -15.666 3.332 5.311 671 HD2 TYR 85 HD2 TYR 85 -14.217 4.111 1.393 672 HE1 TYR 85 HE1 TYR 85 -13.404 2.673 6.022 673 HE2 TYR 85 HE2 TYR 85 -11.952 3.457 2.090 674 HH TYR 85 HH TYR 85 -10.633 3.255 4.092 675 H ALA 86 H ALA 86 -14.676 6.258 3.382 676 HA ALA 86 HA ALA 86 -13.607 6.005 5.842 677 HB1 ALA 86 HB1 ALA 86 -11.954 7.419 5.177 678 HB2 ALA 86 HB2 ALA 86 -13.082 8.621 4.548 679 HB3 ALA 86 HB3 ALA 86 -12.737 7.163 3.617 680 H LYS 87 H LYS 87 -15.945 8.460 4.884 681 HA LYS 87 HA LYS 87 -15.718 10.096 7.182 682 HB2 LYS 87 HB3 LYS 87 -17.154 10.211 4.846 683 HB3 LYS 87 HB2 LYS 87 -18.413 9.852 6.019 684 HG2 LYS 87 HG3 LYS 87 -18.494 12.025 6.446 685 HG3 LYS 87 HG2 LYS 87 -16.914 11.858 7.215 686 HD2 LYS 87 HD3 LYS 87 -16.139 12.045 4.657 687 HD3 LYS 87 HD2 LYS 87 -17.637 12.975 4.572 688 HE2 LYS 87 HE3 LYS 87 -16.003 13.643 6.892 689 HE3 LYS 87 HE2 LYS 87 -15.179 13.932 5.360 690 HZ1 LYS 87 HZ1 LYS 87 -16.357 15.894 5.970 691 HZ2 LYS 87 HZ2 LYS 87 -17.796 15.040 6.214 692 HZ3 LYS 87 HZ3 LYS 87 -17.166 15.206 4.653 693 H GLN 88 H GLN 88 -17.853 7.423 6.352 694 HA GLN 88 HA GLN 88 -19.347 7.313 8.712 695 HB2 GLN 88 HB3 GLN 88 -19.511 5.982 6.418 696 HB3 GLN 88 HB2 GLN 88 -18.643 4.761 7.338 697 HG2 GLN 88 HG3 GLN 88 -20.394 4.607 8.938 698 HG3 GLN 88 HG2 GLN 88 -21.211 6.017 8.265 699 HE21 GLN 88 HE21 GLN 88 -21.819 5.783 5.915 700 HE22 GLN 88 HE22 GLN 88 -22.475 4.260 5.431 701 H HIS 89 H HIS 89 -16.078 6.495 8.133 702 HA HIS 89 HA HIS 89 -15.898 5.183 10.765 703 HB2 HIS 89 HB3 HIS 89 -14.648 4.571 8.146 704 HB3 HIS 89 HB2 HIS 89 -13.620 4.392 9.564 705 HD1 HIS 89 HD1 HIS 89 -15.453 3.123 11.574 706 HD2 HIS 89 HD2 HIS 89 -15.458 2.069 7.554 707 HE1 HIS 89 HE1 HIS 89 -16.434 0.809 11.488 708 HE2 HIS 89 HE2 HIS 89 -16.362 0.164 9.053 709 HA PRO 90 HA PRO 90 -13.575 9.196 10.943 710 HB2 PRO 90 HB3 PRO 90 -14.601 9.310 13.681 711 HB3 PRO 90 HB2 PRO 90 -14.790 10.472 12.366 712 HG2 PRO 90 HG3 PRO 90 -16.843 8.974 13.278 713 HG3 PRO 90 HG2 PRO 90 -16.709 9.476 11.583 714 HD2 PRO 90 HD3 PRO 90 -16.050 6.835 12.838 715 HD3 PRO 90 HD2 PRO 90 -16.868 7.179 11.299 716 H ASP 91 H ASP 91 -13.884 6.814 13.598 717 HA ASP 91 HA ASP 91 -11.389 7.484 14.766 718 HB2 ASP 91 HB3 ASP 91 -13.422 6.277 15.816 719 HB3 ASP 91 HB2 ASP 91 -12.731 4.818 15.111 720 H GLN 92 H GLN 92 -12.110 5.781 11.945 721 HA GLN 92 HA GLN 92 -9.662 4.176 12.114 722 HB2 GLN 92 HB3 GLN 92 -11.691 4.070 9.893 723 HB3 GLN 92 HB2 GLN 92 -10.500 2.857 10.340 724 HG2 GLN 92 HG3 GLN 92 -12.618 3.612 12.294 725 HG3 GLN 92 HG2 GLN 92 -13.012 2.541 10.950 726 HE21 GLN 92 HE21 GLN 92 -11.670 0.609 10.710 727 HE22 GLN 92 HE22 GLN 92 -11.065 -0.162 12.132 728 H GLU 93 H GLU 93 -8.102 4.228 10.440 729 HA GLU 93 HA GLU 93 -8.009 6.811 9.035 730 HB2 GLU 93 HB3 GLU 93 -5.711 4.953 9.667 731 HB3 GLU 93 HB2 GLU 93 -5.599 6.583 9.016 732 HG2 GLU 93 HG3 GLU 93 -6.724 7.357 11.150 733 HG3 GLU 93 HG2 GLU 93 -6.422 5.736 11.774 734 H LEU 94 H LEU 94 -7.043 6.858 6.895 735 HA LEU 94 HA LEU 94 -7.775 4.471 5.356 736 HB2 LEU 94 HB3 LEU 94 -8.371 7.147 4.994 737 HB3 LEU 94 HB2 LEU 94 -7.089 6.863 3.833 738 HG LEU 94 HG LEU 94 -8.700 4.719 3.357 739 HD11 LEU 94 HD11 LEU 94 -10.695 6.907 3.574 740 HD12 LEU 94 HD12 LEU 94 -10.289 6.003 5.033 741 HD13 LEU 94 HD13 LEU 94 -10.920 5.159 3.620 742 HD21 LEU 94 HD21 LEU 94 -8.078 5.773 1.456 743 HD22 LEU 94 HD22 LEU 94 -8.299 7.381 2.144 744 HD23 LEU 94 HD23 LEU 94 -9.696 6.463 1.581 745 H VAL 95 H VAL 95 -6.242 3.206 4.550 746 HA VAL 95 HA VAL 95 -3.636 4.367 3.864 747 HB VAL 95 HB VAL 95 -3.898 1.756 5.353 748 HG11 VAL 95 HG11 VAL 95 -1.661 1.519 5.155 749 HG12 VAL 95 HG12 VAL 95 -1.360 3.254 5.260 750 HG13 VAL 95 HG13 VAL 95 -1.895 2.543 3.737 751 HG21 VAL 95 HG21 VAL 95 -2.593 3.352 7.080 752 HG22 VAL 95 HG22 VAL 95 -4.339 3.103 7.114 753 HG23 VAL 95 HG23 VAL 95 -3.667 4.532 6.328 754 H ILE 96 H ILE 96 -2.957 3.761 1.910 755 HA ILE 96 HA ILE 96 -4.415 1.643 0.522 756 HB ILE 96 HB ILE 96 -2.543 3.785 -0.496 757 HG12 ILE 96 HG13 ILE 96 -4.530 4.637 -1.631 758 HG13 ILE 96 HG12 ILE 96 -5.485 3.297 -1.008 759 HG21 ILE 96 HG21 ILE 96 -3.927 1.601 -2.049 760 HG22 ILE 96 HG22 ILE 96 -2.188 1.785 -1.819 761 HG23 ILE 96 HG23 ILE 96 -3.084 2.978 -2.760 762 HD11 ILE 96 HD11 ILE 96 -5.424 4.133 1.178 763 HD12 ILE 96 HD12 ILE 96 -5.729 5.533 0.150 764 HD13 ILE 96 HD13 ILE 96 -4.114 5.252 0.802 765 H ALA 97 H ALA 97 -3.537 -0.264 -0.019 766 HA ALA 97 HA ALA 97 -0.698 -0.687 0.641 767 HB1 ALA 97 HB1 ALA 97 -2.444 -3.039 0.318 768 HB2 ALA 97 HB2 ALA 97 -2.805 -1.993 1.691 769 HB3 ALA 97 HB3 ALA 97 -1.199 -2.702 1.521 770 H GLY 98 H GLY 98 -3.111 -0.965 -1.852 771 HA2 GLY 98 HA3 GLY 98 -1.379 -0.971 -3.988 772 HA3 GLY 98 HA2 GLY 98 -1.595 -2.666 -3.581 773 H GLY 99 H GLY 99 -4.087 -1.879 -6.175 774 HA2 GLY 99 HA3 GLY 99 -1.282 -2.467 -5.676 775 HA3 GLY 99 HA2 GLY 99 -2.110 -2.545 -7.221 776 H ALA 100 H ALA 100 -0.431 -1.436 -8.256 777 HA ALA 100 HA ALA 100 0.580 1.062 -7.425 778 HB1 ALA 100 HB1 ALA 100 0.486 0.227 -10.300 779 HB2 ALA 100 HB2 ALA 100 1.527 -0.608 -9.147 780 HB3 ALA 100 HB3 ALA 100 1.740 1.118 -9.438 781 H GLN 101 H GLN 101 -2.176 0.154 -9.399 782 HA GLN 101 HA GLN 101 -2.718 2.749 -10.418 783 HB2 GLN 101 HB3 GLN 101 -3.872 0.120 -10.595 784 HB3 GLN 101 HB2 GLN 101 -5.138 1.298 -10.282 785 HG2 GLN 101 HG3 GLN 101 -3.183 2.018 -12.365 786 HG3 GLN 101 HG2 GLN 101 -4.258 0.670 -12.732 787 HE21 GLN 101 HE21 GLN 101 -4.777 3.653 -10.896 788 HE22 GLN 101 HE22 GLN 101 -6.091 4.225 -11.860 789 H ILE 102 H ILE 102 -3.586 1.030 -7.504 790 HA ILE 102 HA ILE 102 -5.625 2.827 -6.653 791 HB ILE 102 HB ILE 102 -3.943 1.017 -4.919 792 HG12 ILE 102 HG13 ILE 102 -4.977 -0.207 -6.812 793 HG13 ILE 102 HG12 ILE 102 -5.648 -0.684 -5.255 794 HG21 ILE 102 HG21 ILE 102 -5.865 1.057 -3.423 795 HG22 ILE 102 HG22 ILE 102 -6.716 2.133 -4.531 796 HG23 ILE 102 HG23 ILE 102 -5.257 2.688 -3.708 797 HD11 ILE 102 HD11 ILE 102 -6.997 1.420 -6.879 798 HD12 ILE 102 HD12 ILE 102 -7.671 0.330 -5.670 799 HD13 ILE 102 HD13 ILE 102 -7.224 -0.286 -7.261 800 H PHE 103 H PHE 103 -2.153 2.612 -6.190 801 HA PHE 103 HA PHE 103 -1.980 4.625 -4.190 802 HB2 PHE 103 HB3 PHE 103 -0.049 3.178 -5.944 803 HB3 PHE 103 HB2 PHE 103 0.487 4.675 -5.188 804 HD1 PHE 103 HD1 PHE 103 -0.797 4.580 -2.579 805 HD2 PHE 103 HD2 PHE 103 1.025 1.466 -4.835 806 HE1 PHE 103 HE1 PHE 103 -0.317 3.358 -0.498 807 HE2 PHE 103 HE2 PHE 103 1.507 0.238 -2.759 808 HZ PHE 103 HZ PHE 103 0.836 1.184 -0.586 809 H THR 104 H THR 104 -1.759 4.617 -7.711 810 HA THR 104 HA THR 104 -0.856 7.235 -8.082 811 HB THR 104 HB THR 104 -2.791 5.873 -9.939 812 HG1 THR 104 HG1 THR 104 -1.389 4.282 -9.789 813 HG21 THR 104 HG21 THR 104 -2.293 7.666 -11.157 814 HG22 THR 104 HG22 THR 104 -0.739 6.876 -11.424 815 HG23 THR 104 HG23 THR 104 -0.906 8.085 -10.150 816 H ALA 105 H ALA 105 -4.229 6.046 -8.249 817 HA ALA 105 HA ALA 105 -5.510 8.449 -8.609 818 HB1 ALA 105 HB1 ALA 105 -6.832 6.661 -6.681 819 HB2 ALA 105 HB2 ALA 105 -6.356 5.919 -8.208 820 HB3 ALA 105 HB3 ALA 105 -7.421 7.324 -8.205 821 H PHE 106 H PHE 106 -4.921 6.958 -5.392 822 HA PHE 106 HA PHE 106 -5.697 9.328 -4.045 823 HB2 PHE 106 HB3 PHE 106 -4.237 6.847 -3.126 824 HB3 PHE 106 HB2 PHE 106 -4.727 8.147 -2.045 825 HD1 PHE 106 HD2 PHE 106 -6.113 5.749 -4.538 826 HD2 PHE 106 HD1 PHE 106 -6.814 8.090 -1.053 827 HE1 PHE 106 HE2 PHE 106 -8.324 4.696 -4.282 828 HE2 PHE 106 HE1 PHE 106 -9.024 7.039 -0.791 829 HZ PHE 106 HZ PHE 106 -9.779 5.340 -2.408 830 H LYS 107 H LYS 107 -2.817 8.435 -5.651 831 HA LYS 107 HA LYS 107 -0.783 9.467 -4.135 832 HB2 LYS 107 HB3 LYS 107 0.505 9.498 -6.033 833 HB3 LYS 107 HB2 LYS 107 -0.806 8.467 -6.571 834 HG2 LYS 107 HG3 LYS 107 -0.999 9.801 -8.328 835 HG3 LYS 107 HG2 LYS 107 -1.639 11.032 -7.243 836 HD2 LYS 107 HD3 LYS 107 1.305 10.654 -7.722 837 HD3 LYS 107 HD2 LYS 107 0.306 11.714 -8.718 838 HE2 LYS 107 HE3 LYS 107 -0.406 12.805 -6.515 839 HE3 LYS 107 HE2 LYS 107 0.959 11.951 -5.796 840 HZ1 LYS 107 HZ1 LYS 107 2.123 13.085 -7.907 841 HZ2 LYS 107 HZ2 LYS 107 2.053 13.807 -6.380 842 HZ3 LYS 107 HZ3 LYS 107 0.936 14.243 -7.572 843 H ASP 108 H ASP 108 -3.264 11.200 -5.856 844 HA ASP 108 HA ASP 108 -2.050 13.784 -5.315 845 HB2 ASP 108 HB3 ASP 108 -3.626 12.949 -7.353 846 HB3 ASP 108 HB2 ASP 108 -4.846 13.641 -6.287 847 H ASP 109 H ASP 109 -4.708 11.758 -4.232 848 HA ASP 109 HA ASP 109 -5.613 13.758 -2.317 849 HB2 ASP 109 HB3 ASP 109 -6.641 11.200 -3.380 850 HB3 ASP 109 HB2 ASP 109 -7.058 11.550 -1.705 851 H VAL 110 H VAL 110 -3.001 11.915 -2.261 852 HA VAL 110 HA VAL 110 -3.304 10.675 0.338 853 HB VAL 110 HB VAL 110 -1.988 9.563 -1.416 854 HG11 VAL 110 HG11 VAL 110 -1.018 11.996 -2.041 855 HG12 VAL 110 HG12 VAL 110 -0.245 10.482 -2.510 856 HG13 VAL 110 HG13 VAL 110 0.323 11.360 -1.090 857 HG21 VAL 110 HG21 VAL 110 -1.526 9.361 1.104 858 HG22 VAL 110 HG22 VAL 110 -0.085 10.323 0.774 859 HG23 VAL 110 HG23 VAL 110 -0.303 8.761 -0.016 860 H ASP 111 H ASP 111 -1.779 11.078 2.094 861 HA ASP 111 HA ASP 111 -0.831 13.864 2.179 862 HB2 ASP 111 HB3 ASP 111 -2.995 13.163 3.534 863 HB3 ASP 111 HB2 ASP 111 -1.804 12.552 4.678 864 H THR 112 H THR 112 -0.439 10.565 3.395 865 HA THR 112 HA THR 112 2.295 11.277 4.233 866 HB THR 112 HB THR 112 0.593 8.997 5.257 867 HG1 THR 112 HG1 THR 112 -0.247 10.839 6.100 868 HG21 THR 112 HG21 THR 112 3.295 10.009 6.098 869 HG22 THR 112 HG22 THR 112 2.866 8.394 5.534 870 HG23 THR 112 HG23 THR 112 2.286 8.964 7.098 871 H LEU 113 H LEU 113 3.939 9.620 3.943 872 HA LEU 113 HA LEU 113 3.329 7.653 1.859 873 HB2 LEU 113 HB3 LEU 113 4.640 10.042 1.363 874 HB3 LEU 113 HB2 LEU 113 5.946 8.886 1.530 875 HG LEU 113 HG LEU 113 5.095 7.553 -0.274 876 HD11 LEU 113 HD11 LEU 113 3.003 9.024 -1.390 877 HD12 LEU 113 HD12 LEU 113 2.626 8.913 0.330 878 HD13 LEU 113 HD13 LEU 113 2.902 7.446 -0.608 879 HD21 LEU 113 HD21 LEU 113 5.936 10.232 -0.528 880 HD22 LEU 113 HD22 LEU 113 4.691 9.964 -1.747 881 HD23 LEU 113 HD23 LEU 113 6.111 8.920 -1.694 882 H LEU 114 H LEU 114 3.802 5.758 2.752 883 HA LEU 114 HA LEU 114 6.279 5.524 4.338 884 HB2 LEU 114 HB3 LEU 114 3.676 4.015 4.580 885 HB3 LEU 114 HB2 LEU 114 5.154 3.519 5.382 886 HG LEU 114 HG LEU 114 4.134 6.287 5.840 887 HD11 LEU 114 HD11 LEU 114 2.144 5.394 6.434 888 HD12 LEU 114 HD12 LEU 114 3.022 5.014 7.915 889 HD13 LEU 114 HD13 LEU 114 2.813 3.780 6.672 890 HD21 LEU 114 HD21 LEU 114 5.825 4.281 7.270 891 HD22 LEU 114 HD22 LEU 114 5.026 5.568 8.173 892 HD23 LEU 114 HD23 LEU 114 6.167 5.969 6.889 893 H VAL 115 H VAL 115 7.806 4.617 3.095 894 HA VAL 115 HA VAL 115 7.007 2.337 1.404 895 HB VAL 115 HB VAL 115 8.678 2.998 -0.244 896 HG11 VAL 115 HG11 VAL 115 7.420 4.667 -1.269 897 HG12 VAL 115 HG12 VAL 115 7.001 5.427 0.266 898 HG13 VAL 115 HG13 VAL 115 6.264 3.890 -0.188 899 HG21 VAL 115 HG21 VAL 115 10.284 4.124 1.145 900 HG22 VAL 115 HG22 VAL 115 9.110 5.372 1.564 901 HG23 VAL 115 HG23 VAL 115 9.717 5.250 -0.087 902 H THR 116 H THR 116 8.508 0.696 1.071 903 HA THR 116 HA THR 116 10.777 0.641 2.950 904 HB THR 116 HB THR 116 8.862 -1.582 2.217 905 HG1 THR 116 HG1 THR 116 8.447 -1.566 4.429 906 HG21 THR 116 HG21 THR 116 10.945 -2.676 2.314 907 HG22 THR 116 HG22 THR 116 10.178 -2.932 3.881 908 HG23 THR 116 HG23 THR 116 11.459 -1.731 3.713 909 H ARG 117 H ARG 117 12.411 1.090 1.548 910 HA ARG 117 HA ARG 117 12.515 -0.248 -1.030 911 HB2 ARG 117 HB3 ARG 117 13.334 2.241 -0.132 912 HB3 ARG 117 HB2 ARG 117 14.842 1.356 -0.320 913 HG2 ARG 117 HG3 ARG 117 13.966 0.723 -2.638 914 HG3 ARG 117 HG2 ARG 117 12.780 2.006 -2.393 915 HD2 ARG 117 HD3 ARG 117 15.371 2.981 -1.689 916 HD3 ARG 117 HD2 ARG 117 15.450 2.236 -3.286 917 HE ARG 117 HE ARG 117 13.222 4.023 -2.944 918 HH11 ARG 117 HH11 ARG 117 16.591 3.777 -3.821 919 HH12 ARG 117 HH12 ARG 117 16.579 5.226 -4.768 920 HH21 ARG 117 HH21 ARG 117 13.204 5.929 -4.189 921 HH22 ARG 117 HH22 ARG 117 14.656 6.449 -4.977 922 H LEU 118 H LEU 118 13.253 -2.257 -1.060 923 HA LEU 118 HA LEU 118 14.962 -3.386 0.888 924 HB2 LEU 118 HB3 LEU 118 13.799 -4.227 -1.702 925 HB3 LEU 118 HB2 LEU 118 15.249 -5.074 -1.198 926 HG LEU 118 HG LEU 118 14.155 -5.739 0.887 927 HD11 LEU 118 HD11 LEU 118 12.612 -4.187 1.517 928 HD12 LEU 118 HD12 LEU 118 11.540 -5.364 0.758 929 HD13 LEU 118 HD13 LEU 118 12.039 -3.924 -0.130 930 HD21 LEU 118 HD21 LEU 118 13.752 -6.798 -1.579 931 HD22 LEU 118 HD22 LEU 118 12.093 -6.543 -1.039 932 HD23 LEU 118 HD23 LEU 118 13.193 -7.526 -0.073 933 H ALA 119 H ALA 119 17.077 -4.467 0.265 934 HA ALA 119 HA ALA 119 18.811 -2.435 -0.880 935 HB1 ALA 119 HB1 ALA 119 20.033 -3.154 0.848 936 HB2 ALA 119 HB2 ALA 119 20.433 -4.538 -0.171 937 HB3 ALA 119 HB3 ALA 119 19.109 -4.650 0.989 938 H GLY 120 H GLY 120 17.945 -5.822 -1.443 939 HA2 GLY 120 HA3 GLY 120 19.688 -6.276 -3.605 940 HA3 GLY 120 HA2 GLY 120 18.220 -7.181 -3.269 941 H SER 121 H SER 121 19.360 -6.307 -5.819 942 HA SER 121 HA SER 121 17.376 -4.372 -6.760 943 HB2 SER 121 HB3 SER 121 18.769 -3.952 -8.578 944 HB3 SER 121 HB2 SER 121 19.935 -4.321 -7.308 945 HG SER 121 HG SER 121 20.000 -6.470 -8.131 946 H PHE 122 H PHE 122 15.513 -5.165 -7.453 947 HA PHE 122 HA PHE 122 15.506 -7.787 -8.796 948 HB2 PHE 122 HB3 PHE 122 13.226 -6.449 -7.327 949 HB3 PHE 122 HB2 PHE 122 13.202 -8.055 -8.048 950 HD1 PHE 122 HD2 PHE 122 15.206 -6.085 -5.593 951 HD2 PHE 122 HD1 PHE 122 13.534 -9.850 -6.662 952 HE1 PHE 122 HE2 PHE 122 16.015 -7.041 -3.475 953 HE2 PHE 122 HE1 PHE 122 14.339 -10.813 -4.546 954 HZ PHE 122 HZ PHE 122 15.582 -9.408 -2.950 955 H GLU 123 H GLU 123 13.768 -8.071 -10.422 956 HA GLU 123 HA GLU 123 13.026 -5.579 -11.783 957 HB2 GLU 123 HB3 GLU 123 13.687 -6.474 -13.944 958 HB3 GLU 123 HB2 GLU 123 15.069 -6.448 -12.858 959 HG2 GLU 123 HG3 GLU 123 14.026 -8.955 -12.459 960 HG3 GLU 123 HG2 GLU 123 13.769 -8.686 -14.182 961 H GLY 124 H GLY 124 11.041 -5.597 -12.745 962 HA2 GLY 124 HA3 GLY 124 9.644 -8.095 -13.205 963 HA3 GLY 124 HA2 GLY 124 8.990 -7.118 -11.899 964 H ASP 125 H ASP 125 7.109 -6.396 -12.713 965 HA ASP 125 HA ASP 125 7.261 -4.627 -15.034 966 HB2 ASP 125 HB3 ASP 125 5.696 -7.141 -14.859 967 HB3 ASP 125 HB2 ASP 125 4.874 -5.751 -15.563 968 H THR 126 H THR 126 6.983 -4.238 -12.139 969 HA THR 126 HA THR 126 4.631 -2.531 -12.233 970 HB THR 126 HB THR 126 4.986 -4.297 -9.830 971 HG1 THR 126 HG1 THR 126 3.323 -4.881 -12.048 972 HG21 THR 126 HG21 THR 126 3.494 -2.328 -9.680 973 HG22 THR 126 HG22 THR 126 2.672 -3.868 -9.431 974 HG23 THR 126 HG23 THR 126 2.515 -3.023 -10.971 975 H LYS 127 H LYS 127 5.623 -0.639 -11.923 976 HA LYS 127 HA LYS 127 7.435 -0.387 -9.609 977 HB2 LYS 127 HB3 LYS 127 7.481 0.988 -12.291 978 HB3 LYS 127 HB2 LYS 127 8.341 1.631 -10.899 979 HG2 LYS 127 HG3 LYS 127 9.685 -0.365 -10.752 980 HG3 LYS 127 HG2 LYS 127 8.763 -1.116 -12.056 981 HD2 LYS 127 HD3 LYS 127 9.498 0.783 -13.530 982 HD3 LYS 127 HD2 LYS 127 10.581 1.282 -12.229 983 HE2 LYS 127 HE3 LYS 127 11.920 -0.595 -12.450 984 HE3 LYS 127 HE2 LYS 127 10.653 -1.530 -13.243 985 HZ1 LYS 127 HZ1 LYS 127 11.191 -0.714 -15.250 986 HZ2 LYS 127 HZ2 LYS 127 12.688 -0.394 -14.533 987 HZ3 LYS 127 HZ3 LYS 127 11.536 0.836 -14.668 988 H MET 128 H MET 128 7.476 1.863 -8.683 989 HA MET 128 HA MET 128 4.849 2.638 -7.960 990 HB2 MET 128 HB3 MET 128 6.902 2.883 -6.530 991 HB3 MET 128 HB2 MET 128 7.388 4.225 -7.557 992 HG2 MET 128 HG3 MET 128 6.311 4.950 -5.474 993 HG3 MET 128 HG2 MET 128 5.449 5.489 -6.913 994 HE1 MET 128 HE1 MET 128 4.188 5.997 -4.621 995 HE2 MET 128 HE2 MET 128 2.943 4.931 -3.970 996 HE3 MET 128 HE3 MET 128 2.705 5.714 -5.533 997 H ILE 129 H ILE 129 4.019 4.891 -8.145 998 HA ILE 129 HA ILE 129 4.339 5.815 -10.905 999 HB ILE 129 HB ILE 129 2.244 7.102 -10.473 1000 HG12 ILE 129 HG13 ILE 129 1.137 5.762 -8.300 1001 HG13 ILE 129 HG12 ILE 129 2.767 6.157 -7.766 1002 HG21 ILE 129 HG21 ILE 129 2.590 4.363 -10.944 1003 HG22 ILE 129 HG22 ILE 129 1.191 5.357 -11.350 1004 HG23 ILE 129 HG23 ILE 129 1.242 4.492 -9.814 1005 HD11 ILE 129 HD11 ILE 129 1.168 7.879 -7.151 1006 HD12 ILE 129 HD12 ILE 129 0.763 8.114 -8.851 1007 HD13 ILE 129 HD13 ILE 129 2.383 8.493 -8.269 1008 HA PRO 130 HA PRO 130 6.455 9.562 -9.979 1009 HB2 PRO 130 HB3 PRO 130 4.910 11.400 -11.373 1010 HB3 PRO 130 HB2 PRO 130 6.195 10.411 -12.072 1011 HG2 PRO 130 HG3 PRO 130 3.240 9.977 -12.098 1012 HG3 PRO 130 HG2 PRO 130 4.430 9.687 -13.381 1013 HD2 PRO 130 HD3 PRO 130 3.428 7.671 -11.931 1014 HD3 PRO 130 HD2 PRO 130 5.127 7.677 -12.450 1015 H LEU 131 H LEU 131 6.411 11.288 -8.561 1016 HA LEU 131 HA LEU 131 3.853 12.178 -7.482 1017 HB2 LEU 131 HB3 LEU 131 5.883 11.504 -5.433 1018 HB3 LEU 131 HB2 LEU 131 4.134 11.460 -5.336 1019 HG LEU 131 HG LEU 131 5.559 9.410 -6.987 1020 HD11 LEU 131 HD11 LEU 131 5.627 9.680 -4.041 1021 HD12 LEU 131 HD12 LEU 131 6.783 8.930 -5.142 1022 HD13 LEU 131 HD13 LEU 131 5.305 8.075 -4.698 1023 HD21 LEU 131 HD21 LEU 131 3.184 8.987 -5.225 1024 HD22 LEU 131 HD22 LEU 131 3.632 8.169 -6.722 1025 HD23 LEU 131 HD23 LEU 131 2.993 9.812 -6.772 1026 H ASN 132 H ASN 132 4.018 14.105 -6.177 1027 HA ASN 132 HA ASN 132 6.132 15.854 -7.089 1028 HB2 ASN 132 HB3 ASN 132 3.465 16.216 -6.329 1029 HB3 ASN 132 HB2 ASN 132 4.395 16.988 -5.050 1030 HD21 ASN 132 HD21 ASN 132 4.663 19.060 -5.381 1031 HD22 ASN 132 HD22 ASN 132 4.884 19.834 -6.910 1032 H TRP 133 H TRP 133 7.861 14.709 -6.051 1033 HA TRP 133 HA TRP 133 8.075 14.222 -3.327 1034 HB2 TRP 133 HB3 TRP 133 10.251 14.820 -5.333 1035 HB3 TRP 133 HB2 TRP 133 10.524 14.150 -3.726 1036 HD1 TRP 133 HD1 TRP 133 9.005 13.223 -7.130 1037 HE1 TRP 133 HE1 TRP 133 8.820 10.660 -7.272 1038 HE3 TRP 133 HE3 TRP 133 10.368 12.039 -2.345 1039 HZ2 TRP 133 HZ2 TRP 133 9.208 8.432 -5.585 1040 HZ3 TRP 133 HZ3 TRP 133 10.436 9.669 -1.691 1041 HH2 TRP 133 HH2 TRP 133 9.867 7.904 -3.279 1042 H ASP 134 H ASP 134 8.751 17.213 -5.115 1043 HA ASP 134 HA ASP 134 10.147 18.560 -3.108 1044 HB2 ASP 134 HB3 ASP 134 8.527 19.378 -5.473 1045 HB3 ASP 134 HB2 ASP 134 8.927 20.614 -4.284 1046 H ASP 135 H ASP 135 6.669 18.296 -3.713 1047 HA ASP 135 HA ASP 135 5.927 20.045 -1.587 1048 HB2 ASP 135 HB3 ASP 135 4.535 18.317 -3.535 1049 HB3 ASP 135 HB2 ASP 135 3.679 18.585 -2.019 1050 H PHE 136 H PHE 136 7.258 17.017 -1.474 1051 HA PHE 136 HA PHE 136 5.984 16.466 1.127 1052 HB2 PHE 136 HB3 PHE 136 6.877 14.527 -1.007 1053 HB3 PHE 136 HB2 PHE 136 6.568 14.032 0.654 1054 HD1 PHE 136 HD1 PHE 136 4.217 14.777 1.594 1055 HD2 PHE 136 HD2 PHE 136 5.175 14.372 -2.532 1056 HE1 PHE 136 HE1 PHE 136 1.828 14.503 1.069 1057 HE2 PHE 136 HE2 PHE 136 2.788 14.103 -3.065 1058 HZ PHE 136 HZ PHE 136 1.111 14.169 -1.262 1059 H THR 137 H THR 137 7.303 16.255 2.825 1060 HA THR 137 HA THR 137 10.202 16.116 2.295 1061 HB THR 137 HB THR 137 8.634 17.701 4.308 1062 HG1 THR 137 HG1 THR 137 10.064 19.325 3.541 1063 HG21 THR 137 HG21 THR 137 10.703 18.290 5.461 1064 HG22 THR 137 HG22 THR 137 11.568 17.069 4.528 1065 HG23 THR 137 HG23 THR 137 10.305 16.583 5.660 1066 H LYS 138 H LYS 138 11.374 14.587 3.309 1067 HA LYS 138 HA LYS 138 10.045 12.417 4.541 1068 HB2 LYS 138 HB3 LYS 138 12.159 12.196 3.271 1069 HB3 LYS 138 HB2 LYS 138 12.996 13.047 4.563 1070 HG2 LYS 138 HG3 LYS 138 13.089 11.235 5.855 1071 HG3 LYS 138 HG2 LYS 138 11.428 10.773 5.494 1072 HD2 LYS 138 HD3 LYS 138 12.892 9.058 4.677 1073 HD3 LYS 138 HD2 LYS 138 12.201 9.914 3.298 1074 HE2 LYS 138 HE3 LYS 138 14.442 11.361 3.691 1075 HE3 LYS 138 HE2 LYS 138 14.989 9.782 4.252 1076 HZ1 LYS 138 HZ1 LYS 138 13.834 9.053 2.009 1077 HZ2 LYS 138 HZ2 LYS 138 15.443 9.573 2.057 1078 HZ3 LYS 138 HZ3 LYS 138 14.225 10.640 1.569 1079 H VAL 139 H VAL 139 9.297 12.308 6.529 1080 HA VAL 139 HA VAL 139 10.372 14.128 8.548 1081 HB VAL 139 HB VAL 139 8.401 13.267 9.925 1082 HG11 VAL 139 HG11 VAL 139 7.478 14.631 7.430 1083 HG12 VAL 139 HG12 VAL 139 8.616 15.430 8.515 1084 HG13 VAL 139 HG13 VAL 139 7.028 14.940 9.107 1085 HG21 VAL 139 HG21 VAL 139 7.464 12.297 7.228 1086 HG22 VAL 139 HG22 VAL 139 6.566 12.250 8.745 1087 HG23 VAL 139 HG23 VAL 139 8.004 11.253 8.541 1088 H SER 140 H SER 140 10.198 10.736 7.733 1089 HA SER 140 HA SER 140 11.940 10.192 10.030 1090 HB2 SER 140 HB3 SER 140 9.255 9.413 9.986 1091 HB3 SER 140 HB2 SER 140 10.153 7.954 9.572 1092 HG SER 140 HG SER 140 11.108 7.969 11.497 1093 H SER 141 H SER 141 13.396 8.499 9.749 1094 HA SER 141 HA SER 141 13.351 6.933 7.320 1095 HB2 SER 141 HB3 SER 141 15.814 8.597 7.766 1096 HB3 SER 141 HB2 SER 141 15.282 7.774 6.299 1097 HG SER 141 HG SER 141 14.286 10.156 7.446 1098 H ARG 142 H ARG 142 14.032 4.964 7.806 1099 HA ARG 142 HA ARG 142 16.180 4.610 9.762 1100 HB2 ARG 142 HB3 ARG 142 13.839 4.362 10.809 1101 HB3 ARG 142 HB2 ARG 142 13.722 2.876 9.877 1102 HG2 ARG 142 HG3 ARG 142 15.296 1.796 11.134 1103 HG3 ARG 142 HG2 ARG 142 16.114 3.291 11.594 1104 HD2 ARG 142 HD3 ARG 142 14.243 3.861 13.062 1105 HD3 ARG 142 HD2 ARG 142 13.421 2.372 12.598 1106 HE ARG 142 HE ARG 142 14.790 1.208 14.021 1107 HH11 ARG 142 HH11 ARG 142 16.109 4.402 13.535 1108 HH12 ARG 142 HH12 ARG 142 17.312 4.229 14.768 1109 HH21 ARG 142 HH21 ARG 142 16.372 0.978 15.643 1110 HH22 ARG 142 HH22 ARG 142 17.462 2.286 15.965 1111 H THR 143 H THR 143 17.440 2.773 9.442 1112 HA THR 143 HA THR 143 16.841 1.262 6.983 1113 HB THR 143 HB THR 143 19.602 1.855 8.049 1114 HG1 THR 143 HG1 THR 143 18.479 3.774 7.399 1115 HG21 THR 143 HG21 THR 143 20.014 0.186 6.582 1116 HG22 THR 143 HG22 THR 143 19.963 1.531 5.444 1117 HG23 THR 143 HG23 THR 143 18.552 0.493 5.645 1118 H VAL 144 H VAL 144 16.222 -0.718 7.506 1119 HA VAL 144 HA VAL 144 17.446 -2.050 9.820 1120 HB VAL 144 HB VAL 144 15.021 -2.954 8.265 1121 HG11 VAL 144 HG11 VAL 144 14.572 -4.264 10.313 1122 HG12 VAL 144 HG12 VAL 144 16.118 -3.722 10.967 1123 HG13 VAL 144 HG13 VAL 144 16.076 -4.726 9.517 1124 HG21 VAL 144 HG21 VAL 144 14.259 -0.949 9.127 1125 HG22 VAL 144 HG22 VAL 144 15.281 -1.057 10.561 1126 HG23 VAL 144 HG23 VAL 144 13.851 -2.079 10.418 1127 H GLU 145 H GLU 145 18.782 -3.748 9.556 1128 HA GLU 145 HA GLU 145 18.964 -4.933 6.864 1129 HB2 GLU 145 HB3 GLU 145 21.428 -5.342 7.546 1130 HB3 GLU 145 HB2 GLU 145 20.950 -3.737 7.010 1131 HG2 GLU 145 HG3 GLU 145 21.114 -2.833 9.115 1132 HG3 GLU 145 HG2 GLU 145 20.899 -4.390 9.915 1133 H ASP 146 H ASP 146 19.318 -7.115 6.696 1134 HA ASP 146 HA ASP 146 18.991 -8.657 9.185 1135 HB2 ASP 146 HB3 ASP 146 17.744 -8.875 6.504 1136 HB3 ASP 146 HB2 ASP 146 18.191 -10.396 7.272 1137 H THR 147 H THR 147 19.609 -11.155 8.419 1138 HA THR 147 HA THR 147 22.401 -11.194 8.391 1139 HB THR 147 HB THR 147 21.869 -13.671 7.517 1140 HG1 THR 147 HG1 THR 147 19.832 -14.118 7.496 1141 HG21 THR 147 HG21 THR 147 21.623 -12.461 10.205 1142 HG22 THR 147 HG22 THR 147 22.715 -13.714 9.616 1143 HG23 THR 147 HG23 THR 147 21.036 -14.110 9.986 1144 H ASN 148 H ASN 148 20.069 -11.656 5.770 1145 HA ASN 148 HA ASN 148 22.154 -11.987 3.798 1146 HB2 ASN 148 HB3 ASN 148 19.386 -12.574 3.947 1147 HB3 ASN 148 HB2 ASN 148 19.591 -11.435 2.619 1148 HD21 ASN 148 HD21 ASN 148 18.720 -13.848 1.974 1149 HD22 ASN 148 HD22 ASN 148 19.953 -14.786 1.211 1150 HA PRO 149 HA PRO 149 22.778 -7.646 3.081 1151 HB2 PRO 149 HB3 PRO 149 23.699 -7.840 0.491 1152 HB3 PRO 149 HB2 PRO 149 24.694 -8.094 1.928 1153 HG2 PRO 149 HG3 PRO 149 23.366 -10.107 0.161 1154 HG3 PRO 149 HG2 PRO 149 24.979 -10.152 0.899 1155 HD2 PRO 149 HD3 PRO 149 22.930 -11.555 1.916 1156 HD3 PRO 149 HD2 PRO 149 24.152 -10.805 2.964 1157 H ALA 150 H ALA 150 20.924 -9.669 0.902 1158 HA ALA 150 HA ALA 150 19.744 -7.430 -0.487 1159 HB1 ALA 150 HB1 ALA 150 19.631 -10.375 -0.703 1160 HB2 ALA 150 HB2 ALA 150 19.806 -9.148 -1.958 1161 HB3 ALA 150 HB3 ALA 150 18.219 -9.481 -1.266 1162 H LEU 151 H LEU 151 19.131 -9.085 2.428 1163 HA LEU 151 HA LEU 151 16.280 -8.550 2.407 1164 HB2 LEU 151 HB3 LEU 151 18.136 -9.852 4.375 1165 HB3 LEU 151 HB2 LEU 151 16.491 -9.437 4.814 1166 HG LEU 151 HG LEU 151 17.428 -11.461 2.799 1167 HD11 LEU 151 HD11 LEU 151 16.535 -13.018 4.186 1168 HD12 LEU 151 HD12 LEU 151 15.270 -11.937 4.770 1169 HD13 LEU 151 HD13 LEU 151 16.915 -11.785 5.388 1170 HD21 LEU 151 HD21 LEU 151 15.747 -10.684 1.494 1171 HD22 LEU 151 HD22 LEU 151 14.900 -9.925 2.842 1172 HD23 LEU 151 HD23 LEU 151 14.771 -11.666 2.587 1173 H THR 152 H THR 152 18.662 -6.492 2.624 1174 HA THR 152 HA THR 152 18.073 -5.152 5.100 1175 HB THR 152 HB THR 152 19.487 -3.862 2.785 1176 HG1 THR 152 HG1 THR 152 21.394 -4.905 3.528 1177 HG21 THR 152 HG21 THR 152 20.965 -3.451 5.045 1178 HG22 THR 152 HG22 THR 152 19.311 -3.416 5.655 1179 HG23 THR 152 HG23 THR 152 19.796 -2.323 4.359 1180 H HIS 153 H HIS 153 16.377 -3.879 5.441 1181 HA HIS 153 HA HIS 153 15.062 -2.646 3.109 1182 HB2 HIS 153 HB3 HIS 153 13.611 -3.015 5.693 1183 HB3 HIS 153 HB2 HIS 153 12.984 -3.004 4.049 1184 HD1 HIS 153 HD1 HIS 153 13.014 -5.235 6.608 1185 HD2 HIS 153 HD2 HIS 153 14.525 -5.498 2.748 1186 HE1 HIS 153 HE1 HIS 153 13.181 -7.696 6.117 1187 HE2 HIS 153 HE2 HIS 153 14.198 -7.829 3.817 1188 H THR 154 H THR 154 14.200 -0.540 3.330 1189 HA THR 154 HA THR 154 15.261 1.003 5.602 1190 HB THR 154 HB THR 154 15.198 1.921 2.720 1191 HG1 THR 154 HG1 THR 154 16.829 0.381 3.086 1192 HG21 THR 154 HG21 THR 154 16.866 3.300 4.711 1193 HG22 THR 154 HG22 THR 154 15.125 3.553 4.844 1194 HG23 THR 154 HG23 THR 154 15.960 3.939 3.339 1195 H TYR 155 H TYR 155 13.609 1.780 6.721 1196 HA TYR 155 HA TYR 155 11.051 2.269 5.409 1197 HB2 TYR 155 HB3 TYR 155 11.959 1.898 8.223 1198 HB3 TYR 155 HB2 TYR 155 10.510 2.861 7.953 1199 HD1 TYR 155 HD1 TYR 155 8.610 1.796 6.615 1200 HD2 TYR 155 HD2 TYR 155 11.853 -0.440 8.222 1201 HE1 TYR 155 HE1 TYR 155 7.273 -0.260 6.436 1202 HE2 TYR 155 HE2 TYR 155 10.526 -2.502 8.047 1203 HH TYR 155 HH TYR 155 7.543 -2.765 7.926 1204 H GLU 156 H GLU 156 10.370 4.233 4.840 1205 HA GLU 156 HA GLU 156 11.592 6.574 6.130 1206 HB2 GLU 156 HB3 GLU 156 11.125 6.211 3.167 1207 HB3 GLU 156 HB2 GLU 156 11.626 7.715 3.927 1208 HG2 GLU 156 HG3 GLU 156 13.709 6.762 4.600 1209 HG3 GLU 156 HG2 GLU 156 13.198 5.156 4.081 1210 H VAL 157 H VAL 157 10.269 8.285 6.509 1211 HA VAL 157 HA VAL 157 7.430 7.922 5.826 1212 HB VAL 157 HB VAL 157 8.554 9.496 8.145 1213 HG11 VAL 157 HG11 VAL 157 6.377 10.285 7.272 1214 HG12 VAL 157 HG12 VAL 157 6.260 9.635 8.907 1215 HG13 VAL 157 HG13 VAL 157 5.714 8.672 7.534 1216 HG21 VAL 157 HG21 VAL 157 8.782 6.915 8.140 1217 HG22 VAL 157 HG22 VAL 157 7.039 6.930 8.408 1218 HG23 VAL 157 HG23 VAL 157 8.114 7.715 9.563 1219 H TRP 158 H TRP 158 6.238 9.680 5.201 1220 HA TRP 158 HA TRP 158 7.618 12.194 4.621 1221 HB2 TRP 158 HB3 TRP 158 6.179 10.656 2.458 1222 HB3 TRP 158 HB2 TRP 158 6.911 12.244 2.283 1223 HD1 TRP 158 HD1 TRP 158 8.020 8.615 3.098 1224 HE1 TRP 158 HE1 TRP 158 10.391 8.284 2.155 1225 HE3 TRP 158 HE3 TRP 158 8.879 13.352 1.377 1226 HZ2 TRP 158 HZ2 TRP 158 12.364 9.826 0.852 1227 HZ3 TRP 158 HZ3 TRP 158 11.034 13.841 0.294 1228 HH2 TRP 158 HH2 TRP 158 12.739 12.113 0.038 1229 H GLN 159 H GLN 159 6.378 13.964 4.730 1230 HA GLN 159 HA GLN 159 3.462 13.675 4.739 1231 HB2 GLN 159 HB3 GLN 159 5.071 15.047 6.902 1232 HB3 GLN 159 HB2 GLN 159 3.323 15.152 6.739 1233 HG2 GLN 159 HG3 GLN 159 4.289 12.411 6.785 1234 HG3 GLN 159 HG2 GLN 159 4.709 13.316 8.238 1235 HE21 GLN 159 HE21 GLN 159 2.853 11.100 7.905 1236 HE22 GLN 159 HE22 GLN 159 1.316 11.672 8.448 1237 H LYS 160 H LYS 160 2.485 15.233 3.586 1238 HA LYS 160 HA LYS 160 3.935 17.098 2.095 1239 HB2 LYS 160 HB3 LYS 160 1.390 16.138 2.018 1240 HB3 LYS 160 HB2 LYS 160 1.110 17.769 2.611 1241 HG2 LYS 160 HG3 LYS 160 2.465 18.600 0.668 1242 HG3 LYS 160 HG2 LYS 160 2.438 16.950 0.042 1243 HD2 LYS 160 HD3 LYS 160 0.602 17.769 -1.031 1244 HD3 LYS 160 HD2 LYS 160 -0.167 17.240 0.467 1245 HE2 LYS 160 HE3 LYS 160 -0.978 19.417 0.070 1246 HE3 LYS 160 HE2 LYS 160 0.237 19.586 1.336 1247 HZ1 LYS 160 HZ1 LYS 160 1.744 20.536 -0.129 1248 HZ2 LYS 160 HZ2 LYS 160 0.275 21.229 -0.600 1249 HZ3 LYS 160 HZ3 LYS 160 0.942 19.965 -1.505 1250 H LYS 161 H LYS 161 4.248 19.290 2.262 1251 HA LYS 161 HA LYS 161 4.655 20.372 4.809 1252 HB2 LYS 161 HB3 LYS 161 5.110 21.158 2.120 1253 HB3 LYS 161 HB2 LYS 161 4.274 22.486 2.912 1254 HG2 LYS 161 HG3 LYS 161 6.375 23.079 3.462 1255 HG3 LYS 161 HG2 LYS 161 6.100 21.949 4.790 1256 HD2 LYS 161 HD3 LYS 161 7.320 21.132 2.162 1257 HD3 LYS 161 HD2 LYS 161 8.278 21.674 3.541 1258 HE2 LYS 161 HE3 LYS 161 6.273 19.479 3.869 1259 HE3 LYS 161 HE2 LYS 161 7.857 19.133 3.179 1260 HZ1 LYS 161 HZ1 LYS 161 7.444 18.980 5.740 1261 HZ2 LYS 161 HZ2 LYS 161 7.723 20.647 5.685 1262 HZ3 LYS 161 HZ3 LYS 161 8.910 19.574 5.139 1263 H ALA 162 H ALA 162 3.540 21.886 6.034 1264 HA ALA 162 HA ALA 162 1.725 22.897 6.962 1265 HB1 ALA 162 HB1 ALA 162 -0.035 23.620 5.078 1266 HB2 ALA 162 HB2 ALA 162 1.380 23.344 4.061 1267 HB3 ALA 162 HB3 ALA 162 1.460 24.502 5.389 1268 H51A NDP 170 H51A NDP 170 -5.073 -1.247 -9.473 1269 H52A NDP 170 H52A NDP 170 -5.661 -2.675 -8.617 1270 H4B NDP 170 H4B NDP 170 -7.090 -3.154 -10.695 1271 H3B NDP 170 H3B NDP 170 -6.130 -0.391 -11.461 1272 HO3A NDP 170 HO3A NDP 170 -5.345 -2.233 -12.612 1273 H2B NDP 170 H2B NDP 170 -8.328 0.038 -12.305 1274 H1B NDP 170 H1B NDP 170 -9.686 -1.025 -10.148 1275 H8A NDP 170 H8A NDP 170 -6.426 0.704 -9.212 1276 H61A NDP 170 H61A NDP 170 -9.939 5.753 -8.391 1277 H62A NDP 170 H62A NDP 170 -8.353 5.054 -8.155 1278 H2A NDP 170 H2A NDP 170 -12.527 2.524 -10.132 1279 H51N NDP 170 H51N NDP 170 -1.444 -4.147 -7.776 1280 H52N NDP 170 H52N NDP 170 -0.698 -3.237 -9.101 1281 H4D NDP 170 H4D NDP 170 0.777 -5.213 -9.568 1282 H3D NDP 170 H3D NDP 170 -0.614 -6.413 -7.161 1283 HO3N NDP 170 HO3N NDP 170 -0.103 -8.276 -8.612 1284 H2D NDP 170 H2D NDP 170 1.485 -7.429 -6.598 1285 HO2N NDP 170 HO2N NDP 170 3.032 -7.818 -7.993 1286 H1D NDP 170 H1D NDP 170 3.011 -5.166 -7.046 1287 H2N NDP 170 H2N NDP 170 3.527 -5.023 -4.698 1288 H71N NDP 170 H71N NDP 170 5.324 -4.543 -2.067 1289 H72N NDP 170 H72N NDP 170 4.877 -5.158 -3.635 1290 H41N NDP 170 H41N NDP 170 0.527 -3.545 -2.534 1291 H42N NDP 170 H42N NDP 170 0.425 -5.312 -2.214 1292 H5N NDP 170 H5N NDP 170 -1.339 -4.573 -3.811 1293 H6N NDP 170 H6N NDP 170 -0.592 -5.055 -6.149 Start of MODEL 12 1 H1 THR 1 HT1 THR 1 -5.075 8.132 5.981 2 H2 THR 1 HT2 THR 1 -5.972 9.495 5.447 3 H3 THR 1 HT3 THR 1 -4.386 9.699 6.069 4 HA THR 1 HA THR 1 -4.957 8.064 3.703 5 HB THR 1 HB THR 1 -4.173 10.154 2.462 6 HG1 THR 1 HG1 THR 1 -3.496 11.247 4.409 7 HG21 THR 1 HG21 THR 1 -6.502 11.350 3.015 8 HG22 THR 1 HG22 THR 1 -6.828 9.741 3.661 9 HG23 THR 1 HG23 THR 1 -6.355 9.935 1.973 10 H ALA 2 H ALA 2 -3.277 6.671 4.298 11 HA ALA 2 HA ALA 2 -0.596 7.858 4.072 12 HB1 ALA 2 HB1 ALA 2 0.121 6.010 5.714 13 HB2 ALA 2 HB2 ALA 2 -1.585 5.946 6.156 14 HB3 ALA 2 HB3 ALA 2 -0.677 7.443 6.360 15 H PHE 3 H PHE 3 0.919 6.654 2.967 16 HA PHE 3 HA PHE 3 -0.152 4.360 1.474 17 HB2 PHE 3 HB3 PHE 3 1.888 6.460 0.881 18 HB3 PHE 3 HB2 PHE 3 2.054 4.888 0.112 19 HD1 PHE 3 HD1 PHE 3 -1.252 6.263 0.868 20 HD2 PHE 3 HD2 PHE 3 1.774 5.814 -2.092 21 HE1 PHE 3 HE1 PHE 3 -2.855 6.945 -0.870 22 HE2 PHE 3 HE2 PHE 3 0.178 6.495 -3.834 23 HZ PHE 3 HZ PHE 3 -2.140 7.061 -3.224 24 H LEU 4 H LEU 4 0.843 2.381 1.527 25 HA LEU 4 HA LEU 4 3.429 2.124 2.831 26 HB2 LEU 4 HB3 LEU 4 1.977 1.926 4.711 27 HB3 LEU 4 HB2 LEU 4 0.901 0.848 3.844 28 HG LEU 4 HG LEU 4 2.848 -0.800 3.772 29 HD11 LEU 4 HD11 LEU 4 4.325 -0.349 5.898 30 HD12 LEU 4 HD12 LEU 4 3.959 1.335 5.524 31 HD13 LEU 4 HD13 LEU 4 4.766 0.321 4.327 32 HD21 LEU 4 HD21 LEU 4 2.160 -1.770 5.763 33 HD22 LEU 4 HD22 LEU 4 0.798 -0.736 5.332 34 HD23 LEU 4 HD23 LEU 4 1.947 -0.213 6.563 35 H TRP 5 H TRP 5 4.595 0.982 1.429 36 HA TRP 5 HA TRP 5 3.651 -1.590 0.540 37 HB2 TRP 5 HB3 TRP 5 3.565 -1.238 -1.770 38 HB3 TRP 5 HB2 TRP 5 2.745 0.171 -1.109 39 HD1 TRP 5 HD1 TRP 5 5.977 -0.847 -2.892 40 HE1 TRP 5 HE1 TRP 5 7.091 1.272 -3.839 41 HE3 TRP 5 HE3 TRP 5 2.949 2.670 -0.767 42 HZ2 TRP 5 HZ2 TRP 5 6.730 4.070 -3.701 43 HZ3 TRP 5 HZ3 TRP 5 3.398 5.048 -1.225 44 HH2 TRP 5 HH2 TRP 5 5.249 5.731 -2.660 45 H ALA 6 H ALA 6 5.312 -2.830 -0.592 46 HA ALA 6 HA ALA 6 7.988 -2.016 0.299 47 HB1 ALA 6 HB1 ALA 6 7.613 -4.109 1.181 48 HB2 ALA 6 HB2 ALA 6 8.446 -4.514 -0.320 49 HB3 ALA 6 HB3 ALA 6 6.691 -4.653 -0.220 50 H GLN 7 H GLN 7 9.751 -1.972 -1.093 51 HA GLN 7 HA GLN 7 9.337 -2.605 -3.903 52 HB2 GLN 7 HB3 GLN 7 10.221 -0.357 -4.590 53 HB3 GLN 7 HB2 GLN 7 8.607 -0.333 -3.894 54 HG2 GLN 7 HG3 GLN 7 10.480 0.020 -1.792 55 HG3 GLN 7 HG2 GLN 7 10.900 1.123 -3.101 56 HE21 GLN 7 HE21 GLN 7 8.318 0.108 -0.947 57 HE22 GLN 7 HE22 GLN 7 7.428 1.587 -1.013 58 H ASP 8 H ASP 8 11.339 -2.522 -5.172 59 HA ASP 8 HA ASP 8 13.594 -3.346 -3.517 60 HB2 ASP 8 HB3 ASP 8 14.542 -4.281 -5.539 61 HB3 ASP 8 HB2 ASP 8 12.861 -4.781 -5.405 62 H ARG 9 H ARG 9 15.757 -2.806 -5.056 63 HA ARG 9 HA ARG 9 16.402 -0.192 -4.345 64 HB2 ARG 9 HB3 ARG 9 17.720 -2.419 -5.530 65 HB3 ARG 9 HB2 ARG 9 18.104 -0.991 -6.481 66 HG2 ARG 9 HG3 ARG 9 18.523 -1.346 -3.521 67 HG3 ARG 9 HG2 ARG 9 19.767 -1.307 -4.772 68 HD2 ARG 9 HD3 ARG 9 19.911 0.891 -4.493 69 HD3 ARG 9 HD2 ARG 9 18.262 1.040 -5.099 70 HE ARG 9 HE ARG 9 18.404 0.382 -2.307 71 HH11 ARG 9 HH11 ARG 9 18.439 2.988 -4.629 72 HH12 ARG 9 HH12 ARG 9 17.884 4.173 -3.495 73 HH21 ARG 9 HH21 ARG 9 17.674 1.940 -0.814 74 HH22 ARG 9 HH22 ARG 9 17.450 3.579 -1.329 75 H ASP 10 H ASP 10 14.948 -1.386 -7.288 76 HA ASP 10 HA ASP 10 15.467 1.112 -8.689 77 HB2 ASP 10 HB3 ASP 10 13.999 -1.403 -9.501 78 HB3 ASP 10 HB2 ASP 10 14.157 0.013 -10.536 79 H GLY 11 H GLY 11 12.856 -0.570 -7.107 80 HA2 GLY 11 HA3 GLY 11 11.259 1.106 -6.044 81 HA3 GLY 11 HA2 GLY 11 11.059 1.700 -7.685 82 H LEU 12 H LEU 12 11.483 -1.601 -7.816 83 HA LEU 12 HA LEU 12 9.031 -2.245 -8.860 84 HB2 LEU 12 HB3 LEU 12 11.294 -3.604 -8.476 85 HB3 LEU 12 HB2 LEU 12 10.370 -4.282 -7.152 86 HG LEU 12 HG LEU 12 8.691 -5.131 -8.696 87 HD11 LEU 12 HD11 LEU 12 8.640 -3.441 -10.376 88 HD12 LEU 12 HD12 LEU 12 9.134 -4.941 -11.158 89 HD13 LEU 12 HD13 LEU 12 10.335 -3.706 -10.782 90 HD21 LEU 12 HD21 LEU 12 11.179 -5.941 -10.072 91 HD22 LEU 12 HD22 LEU 12 9.908 -6.924 -9.342 92 HD23 LEU 12 HD23 LEU 12 11.128 -6.159 -8.322 93 H ILE 13 H ILE 13 7.600 -4.050 -7.741 94 HA ILE 13 HA ILE 13 7.103 -3.591 -4.947 95 HB ILE 13 HB ILE 13 4.769 -2.948 -5.163 96 HG12 ILE 13 HG13 ILE 13 4.990 -2.174 -8.011 97 HG13 ILE 13 HG12 ILE 13 4.849 -3.899 -7.704 98 HG21 ILE 13 HG21 ILE 13 5.084 -0.658 -5.672 99 HG22 ILE 13 HG22 ILE 13 6.423 -1.012 -6.764 100 HG23 ILE 13 HG23 ILE 13 6.616 -1.247 -5.027 101 HD11 ILE 13 HD11 ILE 13 2.827 -3.364 -6.304 102 HD12 ILE 13 HD12 ILE 13 2.666 -3.104 -8.040 103 HD13 ILE 13 HD13 ILE 13 2.919 -1.731 -6.963 104 H GLY 14 H GLY 14 6.260 -5.121 -7.983 105 HA2 GLY 14 HA3 GLY 14 5.869 -7.637 -6.597 106 HA3 GLY 14 HA2 GLY 14 4.461 -7.014 -7.443 107 H LYS 15 H LYS 15 5.099 -9.315 -8.322 108 HA LYS 15 HA LYS 15 6.437 -8.831 -10.882 109 HB2 LYS 15 HB3 LYS 15 7.391 -11.151 -10.750 110 HB3 LYS 15 HB2 LYS 15 8.096 -10.005 -9.617 111 HG2 LYS 15 HG3 LYS 15 7.347 -11.118 -7.820 112 HG3 LYS 15 HG2 LYS 15 5.810 -11.528 -8.582 113 HD2 LYS 15 HD3 LYS 15 7.546 -13.021 -10.048 114 HD3 LYS 15 HD2 LYS 15 8.327 -13.040 -8.465 115 HE2 LYS 15 HE3 LYS 15 5.727 -13.500 -7.799 116 HE3 LYS 15 HE2 LYS 15 5.837 -14.307 -9.362 117 HZ1 LYS 15 HZ1 LYS 15 6.514 -15.458 -7.069 118 HZ2 LYS 15 HZ2 LYS 15 8.016 -14.818 -7.511 119 HZ3 LYS 15 HZ3 LYS 15 7.209 -15.878 -8.554 120 H ASP 16 H ASP 16 3.879 -8.569 -10.890 121 HA ASP 16 HA ASP 16 2.051 -9.266 -12.079 122 HB2 ASP 16 HB3 ASP 16 3.200 -12.046 -12.269 123 HB3 ASP 16 HB2 ASP 16 2.032 -11.270 -13.334 124 H GLY 17 H GLY 17 2.196 -9.235 -9.291 125 HA2 GLY 17 HA3 GLY 17 -0.142 -10.484 -8.529 126 HA3 GLY 17 HA2 GLY 17 1.141 -11.620 -8.138 127 H HIS 18 H HIS 18 3.107 -10.325 -7.056 128 HA HIS 18 HA HIS 18 2.508 -8.126 -5.397 129 HB2 HIS 18 HB3 HIS 18 2.314 -9.213 -3.229 130 HB3 HIS 18 HB2 HIS 18 1.030 -9.777 -4.291 131 HD1 HIS 18 HD1 HIS 18 1.273 -11.669 -2.197 132 HD2 HIS 18 HD2 HIS 18 4.016 -11.740 -5.318 133 HE1 HIS 18 HE1 HIS 18 2.274 -13.976 -2.160 134 HE2 HIS 18 HE2 HIS 18 3.870 -14.022 -4.109 135 H LEU 19 H LEU 19 4.133 -8.464 -3.268 136 HA LEU 19 HA LEU 19 6.706 -8.264 -4.409 137 HB2 LEU 19 HB3 LEU 19 7.489 -8.202 -2.041 138 HB3 LEU 19 HB2 LEU 19 6.253 -7.024 -2.436 139 HG LEU 19 HG LEU 19 4.718 -9.057 -1.493 140 HD11 LEU 19 HD11 LEU 19 5.721 -10.376 0.019 141 HD12 LEU 19 HD12 LEU 19 6.783 -9.090 0.591 142 HD13 LEU 19 HD13 LEU 19 7.189 -9.983 -0.875 143 HD21 LEU 19 HD21 LEU 19 4.189 -7.054 -0.576 144 HD22 LEU 19 HD22 LEU 19 5.875 -6.587 -0.352 145 HD23 LEU 19 HD23 LEU 19 5.112 -7.704 0.779 146 HA PRO 20 HA PRO 20 7.449 -12.709 -4.387 147 HB2 PRO 20 HB3 PRO 20 9.684 -12.687 -5.874 148 HB3 PRO 20 HB2 PRO 20 8.087 -12.420 -6.584 149 HG2 PRO 20 HG3 PRO 20 10.189 -10.423 -5.840 150 HG3 PRO 20 HG2 PRO 20 9.167 -10.486 -7.288 151 HD2 PRO 20 HD3 PRO 20 8.660 -8.873 -5.132 152 HD3 PRO 20 HD2 PRO 20 7.405 -9.472 -6.234 153 H TRP 21 H TRP 21 9.271 -10.239 -2.922 154 HA TRP 21 HA TRP 21 11.386 -11.999 -1.997 155 HB2 TRP 21 HB3 TRP 21 12.086 -9.922 -0.698 156 HB3 TRP 21 HB2 TRP 21 12.135 -9.802 -2.454 157 HD1 TRP 21 HD1 TRP 21 9.556 -8.959 0.333 158 HE1 TRP 21 HE1 TRP 21 8.441 -6.722 -0.282 159 HE3 TRP 21 HE3 TRP 21 11.907 -8.083 -4.118 160 HZ2 TRP 21 HZ2 TRP 21 8.541 -4.839 -2.383 161 HZ3 TRP 21 HZ3 TRP 21 11.338 -6.043 -5.371 162 HH2 TRP 21 HH2 TRP 21 9.690 -4.456 -4.521 163 H HIS 22 H HIS 22 11.655 -12.737 0.075 164 HA HIS 22 HA HIS 22 9.244 -12.914 1.665 165 HB2 HIS 22 HB3 HIS 22 11.463 -14.571 1.228 166 HB3 HIS 22 HB2 HIS 22 11.587 -14.075 2.912 167 HD1 HIS 22 HD1 HIS 22 10.629 -15.865 4.309 168 HD2 HIS 22 HD2 HIS 22 8.416 -15.271 0.843 169 HE1 HIS 22 HE1 HIS 22 8.679 -17.444 4.478 170 HE2 HIS 22 HE2 HIS 22 7.303 -16.997 2.415 171 H LEU 23 H LEU 23 8.923 -10.882 2.531 172 HA LEU 23 HA LEU 23 11.038 -9.775 4.231 173 HB2 LEU 23 HB3 LEU 23 9.039 -8.652 2.513 174 HB3 LEU 23 HB2 LEU 23 8.783 -8.062 4.143 175 HG LEU 23 HG LEU 23 11.166 -7.338 4.194 176 HD11 LEU 23 HD11 LEU 23 11.939 -7.057 1.630 177 HD12 LEU 23 HD12 LEU 23 11.107 -8.609 1.542 178 HD13 LEU 23 HD13 LEU 23 12.445 -8.389 2.669 179 HD21 LEU 23 HD21 LEU 23 8.996 -6.055 3.213 180 HD22 LEU 23 HD22 LEU 23 10.095 -5.946 1.838 181 HD23 LEU 23 HD23 LEU 23 10.583 -5.311 3.409 182 HA PRO 24 HA PRO 24 8.346 -11.818 7.373 183 HB2 PRO 24 HB3 PRO 24 10.343 -11.924 9.250 184 HB3 PRO 24 HB2 PRO 24 10.054 -13.179 8.041 185 HG2 PRO 24 HG3 PRO 24 12.049 -10.950 8.020 186 HG3 PRO 24 HG2 PRO 24 12.256 -12.643 7.533 187 HD2 PRO 24 HD3 PRO 24 11.913 -10.682 5.727 188 HD3 PRO 24 HD2 PRO 24 11.240 -12.307 5.480 189 H ASP 25 H ASP 25 10.779 -9.303 8.054 190 HA ASP 25 HA ASP 25 9.520 -8.250 10.319 191 HB2 ASP 25 HB3 ASP 25 10.905 -6.171 9.686 192 HB3 ASP 25 HB2 ASP 25 11.765 -7.655 10.062 193 H ASP 26 H ASP 26 8.881 -7.816 6.936 194 HA ASP 26 HA ASP 26 7.389 -5.376 7.272 195 HB2 ASP 26 HB3 ASP 26 8.621 -6.353 5.141 196 HB3 ASP 26 HB2 ASP 26 7.054 -7.106 4.862 197 H LEU 27 H LEU 27 6.546 -8.765 6.546 198 HA LEU 27 HA LEU 27 3.782 -8.474 6.478 199 HB2 LEU 27 HB3 LEU 27 5.179 -10.880 7.626 200 HB3 LEU 27 HB2 LEU 27 3.633 -10.825 6.802 201 HG LEU 27 HG LEU 27 5.907 -9.908 5.176 202 HD11 LEU 27 HD11 LEU 27 6.512 -12.040 6.723 203 HD12 LEU 27 HD12 LEU 27 7.155 -11.777 5.104 204 HD13 LEU 27 HD13 LEU 27 5.767 -12.838 5.340 205 HD21 LEU 27 HD21 LEU 27 3.831 -10.123 4.102 206 HD22 LEU 27 HD22 LEU 27 3.526 -11.702 4.825 207 HD23 LEU 27 HD23 LEU 27 4.768 -11.525 3.585 208 H HIS 28 H HIS 28 5.756 -9.568 9.240 209 HA HIS 28 HA HIS 28 3.755 -9.659 11.150 210 HB2 HIS 28 HB3 HIS 28 6.705 -9.353 11.204 211 HB3 HIS 28 HB2 HIS 28 5.846 -8.917 12.678 212 HD1 HIS 28 HD1 HIS 28 4.626 -10.836 13.946 213 HD2 HIS 28 HD2 HIS 28 6.790 -12.071 10.621 214 HE1 HIS 28 HE1 HIS 28 4.796 -13.337 14.145 215 HE2 HIS 28 HE2 HIS 28 6.019 -14.071 12.068 216 H TYR 29 H TYR 29 5.747 -6.922 10.129 217 HA TYR 29 HA TYR 29 4.716 -5.095 12.044 218 HB2 TYR 29 HB3 TYR 29 6.884 -4.810 10.834 219 HB3 TYR 29 HB2 TYR 29 5.974 -4.464 9.367 220 HD1 TYR 29 HD1 TYR 29 5.982 -3.326 12.932 221 HD2 TYR 29 HD2 TYR 29 5.787 -2.231 8.824 222 HE1 TYR 29 HE1 TYR 29 5.868 -0.955 13.576 223 HE2 TYR 29 HE2 TYR 29 5.673 0.143 9.458 224 HH TYR 29 HH TYR 29 6.387 1.254 12.558 225 H PHE 30 H PHE 30 3.790 -6.019 8.792 226 HA PHE 30 HA PHE 30 1.957 -3.933 8.296 227 HB2 PHE 30 HB3 PHE 30 2.982 -5.807 6.734 228 HB3 PHE 30 HB2 PHE 30 1.507 -6.663 7.167 229 HD1 PHE 30 HD1 PHE 30 -0.707 -5.591 6.665 230 HD2 PHE 30 HD2 PHE 30 2.972 -4.094 5.138 231 HE1 PHE 30 HE1 PHE 30 -1.936 -4.344 4.936 232 HE2 PHE 30 HE2 PHE 30 1.750 -2.842 3.408 233 HZ PHE 30 HZ PHE 30 -0.707 -2.966 3.306 234 H ARG 31 H ARG 31 1.327 -7.315 9.245 235 HA ARG 31 HA ARG 31 -1.413 -6.974 9.735 236 HB2 ARG 31 HB3 ARG 31 0.514 -9.066 9.960 237 HB3 ARG 31 HB2 ARG 31 -0.406 -9.007 11.457 238 HG2 ARG 31 HG3 ARG 31 -1.868 -8.934 8.866 239 HG3 ARG 31 HG2 ARG 31 -1.206 -10.465 9.440 240 HD2 ARG 31 HD3 ARG 31 -2.783 -8.793 11.332 241 HD3 ARG 31 HD2 ARG 31 -3.645 -9.691 10.083 242 HE ARG 31 HE ARG 31 -2.530 -10.756 12.446 243 HH11 ARG 31 HH11 ARG 31 -2.923 -11.490 9.057 244 HH12 ARG 31 HH12 ARG 31 -2.892 -13.205 9.297 245 HH21 ARG 31 HH21 ARG 31 -2.488 -13.011 12.763 246 HH22 ARG 31 HH22 ARG 31 -2.645 -14.068 11.400 247 H ALA 32 H ALA 32 1.376 -6.264 11.681 248 HA ALA 32 HA ALA 32 -0.036 -6.102 14.172 249 HB1 ALA 32 HB1 ALA 32 2.405 -6.595 13.959 250 HB2 ALA 32 HB2 ALA 32 2.014 -5.310 15.102 251 HB3 ALA 32 HB3 ALA 32 2.648 -4.908 13.506 252 H GLN 33 H GLN 33 0.997 -3.805 11.698 253 HA GLN 33 HA GLN 33 0.066 -1.529 13.214 254 HB2 GLN 33 HB3 GLN 33 1.686 -1.977 10.863 255 HB3 GLN 33 HB2 GLN 33 0.470 -0.747 10.547 256 HG2 GLN 33 HG3 GLN 33 1.591 -0.205 13.086 257 HG3 GLN 33 HG2 GLN 33 2.918 -0.518 11.969 258 HE21 GLN 33 HE21 GLN 33 2.425 0.556 9.716 259 HE22 GLN 33 HE22 GLN 33 1.994 2.226 9.810 260 H THR 34 H THR 34 -1.174 -3.661 10.767 261 HA THR 34 HA THR 34 -3.396 -1.905 10.124 262 HB THR 34 HB THR 34 -4.077 -3.721 8.593 263 HG1 THR 34 HG1 THR 34 -1.728 -5.039 9.458 264 HG21 THR 34 HG21 THR 34 -1.966 -3.800 7.191 265 HG22 THR 34 HG22 THR 34 -1.236 -2.790 8.439 266 HG23 THR 34 HG23 THR 34 -2.640 -2.210 7.543 267 H VAL 35 H VAL 35 -3.098 -2.990 12.873 268 HA VAL 35 HA VAL 35 -5.321 -4.854 13.097 269 HB VAL 35 HB VAL 35 -3.729 -3.628 15.348 270 HG11 VAL 35 HG11 VAL 35 -5.597 -4.565 16.324 271 HG12 VAL 35 HG12 VAL 35 -4.467 -5.919 16.357 272 HG13 VAL 35 HG13 VAL 35 -5.718 -5.844 15.115 273 HG21 VAL 35 HG21 VAL 35 -3.237 -6.298 14.042 274 HG22 VAL 35 HG22 VAL 35 -2.277 -5.518 15.300 275 HG23 VAL 35 HG23 VAL 35 -2.312 -4.844 13.671 276 H GLY 36 H GLY 36 -7.287 -3.988 12.948 277 HA2 GLY 36 HA3 GLY 36 -9.130 -2.828 13.771 278 HA3 GLY 36 HA2 GLY 36 -8.059 -1.936 14.841 279 H LYS 37 H LYS 37 -7.298 -2.118 11.464 280 HA LYS 37 HA LYS 37 -8.254 0.650 11.125 281 HB2 LYS 37 HB3 LYS 37 -5.721 -0.572 10.015 282 HB3 LYS 37 HB2 LYS 37 -6.296 1.056 9.683 283 HG2 LYS 37 HG3 LYS 37 -6.175 1.456 12.183 284 HG3 LYS 37 HG2 LYS 37 -5.279 -0.062 12.275 285 HD2 LYS 37 HD3 LYS 37 -3.453 0.791 11.170 286 HD3 LYS 37 HD2 LYS 37 -4.407 2.001 10.308 287 HE2 LYS 37 HE3 LYS 37 -4.548 3.388 12.215 288 HE3 LYS 37 HE2 LYS 37 -3.968 2.109 13.281 289 HZ1 LYS 37 HZ1 LYS 37 -1.915 2.317 11.610 290 HZ2 LYS 37 HZ2 LYS 37 -2.036 3.210 13.041 291 HZ3 LYS 37 HZ3 LYS 37 -2.472 3.914 11.566 292 H ILE 38 H ILE 38 -7.934 1.121 8.550 293 HA ILE 38 HA ILE 38 -9.299 -1.080 7.151 294 HB ILE 38 HB ILE 38 -10.080 1.284 5.847 295 HG12 ILE 38 HG13 ILE 38 -11.037 1.594 8.648 296 HG13 ILE 38 HG12 ILE 38 -9.429 2.202 8.277 297 HG21 ILE 38 HG21 ILE 38 -11.268 -0.931 6.229 298 HG22 ILE 38 HG22 ILE 38 -12.261 0.526 6.271 299 HG23 ILE 38 HG23 ILE 38 -11.783 -0.257 7.775 300 HD11 ILE 38 HD11 ILE 38 -11.258 3.883 8.100 301 HD12 ILE 38 HD12 ILE 38 -11.887 2.965 6.733 302 HD13 ILE 38 HD13 ILE 38 -10.285 3.696 6.641 303 H MET 39 H MET 39 -8.103 -1.835 5.562 304 HA MET 39 HA MET 39 -6.086 -0.102 4.328 305 HB2 MET 39 HB3 MET 39 -5.196 -2.141 5.233 306 HB3 MET 39 HB2 MET 39 -6.411 -3.102 4.406 307 HG2 MET 39 HG3 MET 39 -5.352 -2.130 2.250 308 HG3 MET 39 HG2 MET 39 -3.986 -1.759 3.300 309 HE1 MET 39 HE1 MET 39 -6.244 -5.035 3.923 310 HE2 MET 39 HE2 MET 39 -5.639 -5.995 2.573 311 HE3 MET 39 HE3 MET 39 -6.490 -4.481 2.266 312 H VAL 40 H VAL 40 -6.158 0.487 2.244 313 HA VAL 40 HA VAL 40 -8.500 -0.286 0.677 314 HB VAL 40 HB VAL 40 -6.412 1.780 -0.016 315 HG11 VAL 40 HG11 VAL 40 -8.919 0.845 -1.245 316 HG12 VAL 40 HG12 VAL 40 -7.501 1.592 -1.980 317 HG13 VAL 40 HG13 VAL 40 -8.709 2.595 -1.176 318 HG21 VAL 40 HG21 VAL 40 -7.316 2.521 2.033 319 HG22 VAL 40 HG22 VAL 40 -8.948 2.027 1.582 320 HG23 VAL 40 HG23 VAL 40 -8.191 3.404 0.782 321 H VAL 41 H VAL 41 -8.412 -1.625 -1.023 322 HA VAL 41 HA VAL 41 -5.786 -2.206 -2.203 323 HB VAL 41 HB VAL 41 -6.833 -3.976 -0.541 324 HG11 VAL 41 HG11 VAL 41 -8.137 -4.739 -3.151 325 HG12 VAL 41 HG12 VAL 41 -8.974 -4.165 -1.709 326 HG13 VAL 41 HG13 VAL 41 -8.112 -5.702 -1.674 327 HG21 VAL 41 HG21 VAL 41 -5.033 -4.073 -2.755 328 HG22 VAL 41 HG22 VAL 41 -5.890 -5.609 -2.628 329 HG23 VAL 41 HG23 VAL 41 -4.993 -4.982 -1.245 330 H GLY 42 H GLY 42 -5.797 -2.871 -4.401 331 HA2 GLY 42 HA3 GLY 42 -7.977 -1.700 -5.907 332 HA3 GLY 42 HA2 GLY 42 -6.470 -2.320 -6.563 333 H ARG 43 H ARG 43 -8.569 -2.909 -8.027 334 HA ARG 43 HA ARG 43 -10.107 -5.131 -7.332 335 HB2 ARG 43 HB3 ARG 43 -10.586 -3.670 -9.259 336 HB3 ARG 43 HB2 ARG 43 -9.180 -4.325 -10.089 337 HG2 ARG 43 HG3 ARG 43 -10.441 -6.611 -9.574 338 HG3 ARG 43 HG2 ARG 43 -11.836 -5.532 -9.609 339 HD2 ARG 43 HD3 ARG 43 -9.764 -5.751 -11.789 340 HD3 ARG 43 HD2 ARG 43 -11.335 -6.551 -11.804 341 HE ARG 43 HE ARG 43 -11.346 -3.661 -11.496 342 HH11 ARG 43 HH11 ARG 43 -11.698 -6.394 -13.647 343 HH12 ARG 43 HH12 ARG 43 -12.562 -5.493 -14.845 344 HH21 ARG 43 HH21 ARG 43 -12.472 -2.483 -13.076 345 HH22 ARG 43 HH22 ARG 43 -13.001 -3.274 -14.523 346 H ARG 44 H ARG 44 -7.286 -5.089 -9.508 347 HA ARG 44 HA ARG 44 -6.991 -7.876 -9.626 348 HB2 ARG 44 HB3 ARG 44 -4.925 -5.707 -10.036 349 HB3 ARG 44 HB2 ARG 44 -4.721 -7.392 -10.495 350 HG2 ARG 44 HG3 ARG 44 -6.978 -5.721 -11.550 351 HG3 ARG 44 HG2 ARG 44 -5.390 -5.753 -12.318 352 HD2 ARG 44 HD3 ARG 44 -6.558 -7.381 -13.486 353 HD3 ARG 44 HD2 ARG 44 -5.679 -8.320 -12.279 354 HE ARG 44 HE ARG 44 -8.242 -7.603 -11.312 355 HH11 ARG 44 HH11 ARG 44 -6.659 -9.778 -13.536 356 HH12 ARG 44 HH12 ARG 44 -7.896 -10.985 -13.432 357 HH21 ARG 44 HH21 ARG 44 -9.871 -9.190 -11.174 358 HH22 ARG 44 HH22 ARG 44 -9.720 -10.651 -12.092 359 H THR 45 H THR 45 -6.196 -5.644 -7.155 360 HA THR 45 HA THR 45 -4.105 -7.232 -5.981 361 HB THR 45 HB THR 45 -5.581 -5.072 -4.517 362 HG1 THR 45 HG1 THR 45 -5.116 -3.751 -6.063 363 HG21 THR 45 HG21 THR 45 -3.802 -6.140 -3.299 364 HG22 THR 45 HG22 THR 45 -3.325 -4.498 -3.731 365 HG23 THR 45 HG23 THR 45 -2.684 -5.870 -4.636 366 H TYR 46 H TYR 46 -7.507 -6.489 -5.100 367 HA TYR 46 HA TYR 46 -7.619 -7.962 -2.763 368 HB2 TYR 46 HB3 TYR 46 -9.990 -7.966 -2.952 369 HB3 TYR 46 HB2 TYR 46 -9.443 -6.470 -3.692 370 HD1 TYR 46 HD2 TYR 46 -10.162 -9.997 -4.752 371 HD2 TYR 46 HD1 TYR 46 -10.524 -5.847 -5.633 372 HE1 TYR 46 HE2 TYR 46 -11.406 -10.543 -6.785 373 HE2 TYR 46 HE1 TYR 46 -11.786 -6.392 -7.667 374 HH TYR 46 HH TYR 46 -12.068 -8.266 -9.218 375 H GLU 47 H GLU 47 -7.973 -9.078 -6.096 376 HA GLU 47 HA GLU 47 -8.482 -11.803 -5.291 377 HB2 GLU 47 HB3 GLU 47 -8.706 -10.269 -7.689 378 HB3 GLU 47 HB2 GLU 47 -7.694 -11.667 -8.022 379 HG2 GLU 47 HG3 GLU 47 -10.208 -12.112 -6.525 380 HG3 GLU 47 HG2 GLU 47 -10.325 -11.738 -8.243 381 H SER 48 H SER 48 -5.750 -9.841 -5.924 382 HA SER 48 HA SER 48 -4.002 -12.177 -6.236 383 HB2 SER 48 HB3 SER 48 -3.469 -9.227 -6.631 384 HB3 SER 48 HB2 SER 48 -2.242 -10.484 -6.787 385 HG SER 48 HG SER 48 -2.976 -10.897 -8.702 386 H PHE 49 H PHE 49 -5.311 -11.015 -3.679 387 HA PHE 49 HA PHE 49 -2.855 -10.595 -2.127 388 HB2 PHE 49 HB3 PHE 49 -5.088 -9.099 -2.088 389 HB3 PHE 49 HB2 PHE 49 -5.508 -10.267 -0.839 390 HD1 PHE 49 HD1 PHE 49 -3.063 -7.679 -1.821 391 HD2 PHE 49 HD2 PHE 49 -4.495 -10.205 1.293 392 HE1 PHE 49 HE1 PHE 49 -1.721 -6.422 -0.187 393 HE2 PHE 49 HE2 PHE 49 -3.157 -8.950 2.931 394 HZ PHE 49 HZ PHE 49 -1.768 -7.055 2.192 395 HA PRO 50 HA PRO 50 -3.240 -14.900 -0.884 396 HB2 PRO 50 HB3 PRO 50 -1.303 -14.002 1.181 397 HB3 PRO 50 HB2 PRO 50 -1.199 -15.356 0.050 398 HG2 PRO 50 HG3 PRO 50 0.247 -13.150 -0.327 399 HG3 PRO 50 HG2 PRO 50 -0.477 -14.014 -1.697 400 HD2 PRO 50 HD3 PRO 50 -1.361 -11.486 -0.367 401 HD3 PRO 50 HD2 PRO 50 -1.376 -11.921 -2.088 402 H LYS 51 H LYS 51 -3.741 -12.087 1.090 403 HA LYS 51 HA LYS 51 -5.309 -13.730 2.966 404 HB2 LYS 51 HB3 LYS 51 -3.514 -11.382 3.558 405 HB3 LYS 51 HB2 LYS 51 -4.755 -11.923 4.680 406 HG2 LYS 51 HG3 LYS 51 -2.531 -13.668 3.649 407 HG3 LYS 51 HG2 LYS 51 -2.483 -12.786 5.177 408 HD2 LYS 51 HD3 LYS 51 -3.844 -14.253 6.203 409 HD3 LYS 51 HD2 LYS 51 -4.894 -14.410 4.794 410 HE2 LYS 51 HE3 LYS 51 -2.621 -15.648 3.936 411 HE3 LYS 51 HE2 LYS 51 -2.622 -16.053 5.652 412 HZ1 LYS 51 HZ1 LYS 51 -4.439 -16.895 3.546 413 HZ2 LYS 51 HZ2 LYS 51 -5.155 -16.551 5.039 414 HZ3 LYS 51 HZ3 LYS 51 -3.935 -17.718 4.936 415 H ARG 52 H ARG 52 -6.990 -13.200 1.326 416 HA ARG 52 HA ARG 52 -8.151 -10.548 1.862 417 HB2 ARG 52 HB3 ARG 52 -9.256 -10.790 -0.392 418 HB3 ARG 52 HB2 ARG 52 -7.514 -10.557 -0.423 419 HG2 ARG 52 HG3 ARG 52 -7.303 -12.383 -1.648 420 HG3 ARG 52 HG2 ARG 52 -7.978 -13.341 -0.330 421 HD2 ARG 52 HD3 ARG 52 -10.253 -12.396 -1.303 422 HD3 ARG 52 HD2 ARG 52 -9.288 -12.270 -2.774 423 HE ARG 52 HE ARG 52 -8.838 -14.806 -1.837 424 HH11 ARG 52 HH11 ARG 52 -11.649 -12.962 -2.774 425 HH12 ARG 52 HH12 ARG 52 -12.539 -14.351 -3.300 426 HH21 ARG 52 HH21 ARG 52 -10.007 -16.634 -2.528 427 HH22 ARG 52 HH22 ARG 52 -11.608 -16.436 -3.160 428 HA PRO 53 HA PRO 53 -9.319 -9.742 2.949 429 HB2 PRO 53 HB3 PRO 53 -10.950 -9.372 5.021 430 HB3 PRO 53 HB2 PRO 53 -11.552 -9.274 3.362 431 HG2 PRO 53 HG3 PRO 53 -11.863 -11.452 5.365 432 HG3 PRO 53 HG2 PRO 53 -12.993 -10.901 4.116 433 HD2 PRO 53 HD3 PRO 53 -11.266 -13.123 3.957 434 HD3 PRO 53 HD2 PRO 53 -12.175 -12.394 2.620 435 H LEU 54 H LEU 54 -8.155 -8.928 4.777 436 HA LEU 54 HA LEU 54 -6.610 -10.892 6.135 437 HB2 LEU 54 HB3 LEU 54 -6.760 -7.904 6.216 438 HB3 LEU 54 HB2 LEU 54 -5.827 -8.764 7.426 439 HG LEU 54 HG LEU 54 -5.285 -9.451 4.593 440 HD11 LEU 54 HD11 LEU 54 -4.025 -7.544 4.103 441 HD12 LEU 54 HD12 LEU 54 -4.084 -6.966 5.767 442 HD13 LEU 54 HD13 LEU 54 -5.533 -6.913 4.764 443 HD21 LEU 54 HD21 LEU 54 -3.138 -8.793 6.486 444 HD22 LEU 54 HD22 LEU 54 -3.329 -10.185 5.420 445 HD23 LEU 54 HD23 LEU 54 -4.175 -10.136 6.967 446 HA PRO 55 HA PRO 55 -9.218 -11.459 9.680 447 HB2 PRO 55 HB3 PRO 55 -6.888 -12.377 11.178 448 HB3 PRO 55 HB2 PRO 55 -8.281 -13.298 10.607 449 HG2 PRO 55 HG3 PRO 55 -5.799 -13.599 9.565 450 HG3 PRO 55 HG2 PRO 55 -7.277 -13.833 8.614 451 HD2 PRO 55 HD3 PRO 55 -5.433 -11.473 8.703 452 HD3 PRO 55 HD2 PRO 55 -6.228 -12.233 7.307 453 H GLU 56 H GLU 56 -9.618 -10.685 11.760 454 HA GLU 56 HA GLU 56 -9.760 -9.008 13.293 455 HB2 GLU 56 HB3 GLU 56 -7.088 -10.176 13.419 456 HB3 GLU 56 HB2 GLU 56 -7.157 -8.556 14.099 457 HG2 GLU 56 HG3 GLU 56 -9.177 -10.614 14.880 458 HG3 GLU 56 HG2 GLU 56 -7.579 -10.591 15.625 459 H ARG 57 H ARG 57 -9.375 -8.098 10.510 460 HA ARG 57 HA ARG 57 -8.706 -5.360 11.170 461 HB2 ARG 57 HB3 ARG 57 -6.972 -5.027 9.655 462 HB3 ARG 57 HB2 ARG 57 -6.587 -6.586 10.363 463 HG2 ARG 57 HG3 ARG 57 -6.208 -6.983 8.139 464 HG3 ARG 57 HG2 ARG 57 -7.873 -7.538 8.312 465 HD2 ARG 57 HD3 ARG 57 -7.238 -6.008 6.314 466 HD3 ARG 57 HD2 ARG 57 -8.734 -5.712 7.190 467 HE ARG 57 HE ARG 57 -7.849 -3.746 8.021 468 HH11 ARG 57 HH11 ARG 57 -5.387 -5.530 6.304 469 HH12 ARG 57 HH12 ARG 57 -4.289 -4.194 6.244 470 HH21 ARG 57 HH21 ARG 57 -6.404 -1.996 7.947 471 HH22 ARG 57 HH22 ARG 57 -4.863 -2.190 7.181 472 H THR 58 H THR 58 -9.274 -3.842 9.417 473 HA THR 58 HA THR 58 -11.653 -4.811 8.005 474 HB THR 58 HB THR 58 -10.842 -1.927 8.251 475 HG1 THR 58 HG1 THR 58 -11.850 -1.832 10.219 476 HG21 THR 58 HG21 THR 58 -12.752 -2.431 6.815 477 HG22 THR 58 HG22 THR 58 -13.219 -1.502 8.240 478 HG23 THR 58 HG23 THR 58 -13.549 -3.234 8.169 479 H ASN 59 H ASN 59 -11.621 -5.112 5.867 480 HA ASN 59 HA ASN 59 -9.334 -4.055 4.358 481 HB2 ASN 59 HB3 ASN 59 -11.202 -6.360 3.788 482 HB3 ASN 59 HB2 ASN 59 -9.980 -5.788 2.656 483 HD21 ASN 59 HD21 ASN 59 -10.328 -6.839 6.015 484 HD22 ASN 59 HD22 ASN 59 -8.830 -7.693 6.089 485 H VAL 60 H VAL 60 -9.649 -3.243 2.229 486 HA VAL 60 HA VAL 60 -12.362 -2.369 1.558 487 HB VAL 60 HB VAL 60 -9.960 -0.546 1.740 488 HG11 VAL 60 HG11 VAL 60 -10.848 0.505 -0.023 489 HG12 VAL 60 HG12 VAL 60 -12.075 1.063 1.115 490 HG13 VAL 60 HG13 VAL 60 -12.381 -0.357 0.114 491 HG21 VAL 60 HG21 VAL 60 -10.755 0.080 3.712 492 HG22 VAL 60 HG22 VAL 60 -11.971 -1.192 3.594 493 HG23 VAL 60 HG23 VAL 60 -12.332 0.431 3.005 494 H VAL 61 H VAL 61 -12.808 -2.674 -0.542 495 HA VAL 61 HA VAL 61 -10.548 -3.239 -2.343 496 HB VAL 61 HB VAL 61 -13.399 -4.225 -2.502 497 HG11 VAL 61 HG11 VAL 61 -12.254 -5.736 -4.297 498 HG12 VAL 61 HG12 VAL 61 -11.097 -4.408 -4.395 499 HG13 VAL 61 HG13 VAL 61 -12.805 -4.117 -4.727 500 HG21 VAL 61 HG21 VAL 61 -10.913 -5.314 -1.370 501 HG22 VAL 61 HG22 VAL 61 -11.833 -6.430 -2.379 502 HG23 VAL 61 HG23 VAL 61 -12.594 -5.675 -0.978 503 H LEU 62 H LEU 62 -10.407 -2.288 -4.313 504 HA LEU 62 HA LEU 62 -12.426 -0.246 -4.965 505 HB2 LEU 62 HB3 LEU 62 -10.136 0.566 -4.116 506 HB3 LEU 62 HB2 LEU 62 -9.511 0.009 -5.656 507 HG LEU 62 HG LEU 62 -11.236 1.532 -6.751 508 HD11 LEU 62 HD11 LEU 62 -12.164 1.794 -4.173 509 HD12 LEU 62 HD12 LEU 62 -12.586 2.827 -5.538 510 HD13 LEU 62 HD13 LEU 62 -11.286 3.298 -4.443 511 HD21 LEU 62 HD21 LEU 62 -8.731 1.952 -6.389 512 HD22 LEU 62 HD22 LEU 62 -9.241 3.043 -5.101 513 HD23 LEU 62 HD23 LEU 62 -9.758 3.336 -6.761 514 H THR 63 H THR 63 -13.540 -1.275 -6.539 515 HA THR 63 HA THR 63 -12.031 -2.064 -8.931 516 HB THR 63 HB THR 63 -12.736 -4.097 -7.741 517 HG1 THR 63 HG1 THR 63 -13.912 -5.010 -9.488 518 HG21 THR 63 HG21 THR 63 -14.627 -3.945 -6.559 519 HG22 THR 63 HG22 THR 63 -15.398 -4.395 -8.079 520 HG23 THR 63 HG23 THR 63 -15.309 -2.699 -7.605 521 H HIS 64 H HIS 64 -12.926 -1.442 -10.872 522 HA HIS 64 HA HIS 64 -14.703 0.732 -10.877 523 HB2 HIS 64 HB3 HIS 64 -13.784 -1.082 -13.106 524 HB3 HIS 64 HB2 HIS 64 -14.784 0.340 -13.372 525 HD1 HIS 64 HD1 HIS 64 -13.658 2.651 -13.100 526 HD2 HIS 64 HD2 HIS 64 -11.099 -0.567 -12.509 527 HE1 HIS 64 HE1 HIS 64 -11.339 3.624 -13.118 528 HE2 HIS 64 HE2 HIS 64 -9.803 1.645 -12.850 529 H GLN 65 H GLN 65 -15.239 -2.704 -11.205 530 HA GLN 65 HA GLN 65 -17.717 -2.823 -12.381 531 HB2 GLN 65 HB3 GLN 65 -16.323 -4.489 -10.342 532 HB3 GLN 65 HB2 GLN 65 -18.031 -4.796 -10.630 533 HG2 GLN 65 HG3 GLN 65 -17.681 -5.539 -12.769 534 HG3 GLN 65 HG2 GLN 65 -16.184 -4.627 -12.957 535 HE21 GLN 65 HE21 GLN 65 -14.414 -5.350 -11.396 536 HE22 GLN 65 HE22 GLN 65 -14.200 -7.058 -11.234 537 H GLU 66 H GLU 66 -19.722 -2.240 -11.864 538 HA GLU 66 HA GLU 66 -20.166 -0.790 -9.404 539 HB2 GLU 66 HB3 GLU 66 -22.335 -0.228 -10.349 540 HB3 GLU 66 HB2 GLU 66 -21.068 0.047 -11.537 541 HG2 GLU 66 HG3 GLU 66 -21.648 -2.290 -12.410 542 HG3 GLU 66 HG2 GLU 66 -23.120 -2.131 -11.452 543 H ASP 67 H ASP 67 -21.129 -3.839 -10.851 544 HA ASP 67 HA ASP 67 -22.848 -4.445 -8.571 545 HB2 ASP 67 HB3 ASP 67 -22.482 -5.606 -11.298 546 HB3 ASP 67 HB2 ASP 67 -23.143 -6.628 -10.026 547 H TYR 68 H TYR 68 -19.768 -4.412 -8.565 548 HA TYR 68 HA TYR 68 -19.047 -7.158 -8.128 549 HB2 TYR 68 HB3 TYR 68 -17.376 -5.537 -8.901 550 HB3 TYR 68 HB2 TYR 68 -17.568 -4.614 -7.413 551 HD1 TYR 68 HD1 TYR 68 -16.605 -7.997 -8.650 552 HD2 TYR 68 HD2 TYR 68 -16.198 -5.073 -5.587 553 HE1 TYR 68 HE1 TYR 68 -14.861 -9.364 -7.584 554 HE2 TYR 68 HE2 TYR 68 -14.451 -6.431 -4.514 555 HH TYR 68 HH TYR 68 -12.828 -8.187 -5.154 556 H GLN 69 H GLN 69 -18.954 -8.276 -6.248 557 HA GLN 69 HA GLN 69 -19.761 -6.848 -3.800 558 HB2 GLN 69 HB3 GLN 69 -20.618 -9.524 -4.864 559 HB3 GLN 69 HB2 GLN 69 -20.712 -9.165 -3.145 560 HG2 GLN 69 HG3 GLN 69 -22.122 -7.735 -5.382 561 HG3 GLN 69 HG2 GLN 69 -22.844 -8.753 -4.136 562 HE21 GLN 69 HE21 GLN 69 -21.623 -5.638 -4.933 563 HE22 GLN 69 HE22 GLN 69 -22.048 -4.851 -3.455 564 H ALA 70 H ALA 70 -18.009 -6.679 -2.567 565 HA ALA 70 HA ALA 70 -16.080 -8.881 -2.473 566 HB1 ALA 70 HB1 ALA 70 -15.452 -6.395 -2.813 567 HB2 ALA 70 HB2 ALA 70 -14.495 -7.371 -1.699 568 HB3 ALA 70 HB3 ALA 70 -15.713 -6.259 -1.074 569 H GLN 71 H GLN 71 -16.716 -10.402 -1.069 570 HA GLN 71 HA GLN 71 -18.203 -9.831 1.298 571 HB2 GLN 71 HB3 GLN 71 -16.720 -12.386 0.692 572 HB3 GLN 71 HB2 GLN 71 -18.130 -12.176 1.723 573 HG2 GLN 71 HG3 GLN 71 -19.219 -12.957 -0.076 574 HG3 GLN 71 HG2 GLN 71 -19.128 -11.276 -0.599 575 HE21 GLN 71 HE21 GLN 71 -17.228 -14.270 -0.693 576 HE22 GLN 71 HE22 GLN 71 -16.647 -14.055 -2.306 577 H GLY 72 H GLY 72 -17.413 -9.023 3.119 578 HA2 GLY 72 HA3 GLY 72 -16.021 -9.287 5.048 579 HA3 GLY 72 HA2 GLY 72 -14.755 -9.910 4.005 580 H ALA 73 H ALA 73 -15.455 -7.543 2.108 581 HA ALA 73 HA ALA 73 -14.129 -5.443 3.686 582 HB1 ALA 73 HB1 ALA 73 -12.325 -5.517 2.397 583 HB2 ALA 73 HB2 ALA 73 -13.312 -5.274 0.956 584 HB3 ALA 73 HB3 ALA 73 -13.002 -6.906 1.550 585 H VAL 74 H VAL 74 -14.216 -3.282 2.472 586 HA VAL 74 HA VAL 74 -16.973 -2.872 1.615 587 HB VAL 74 HB VAL 74 -15.996 -0.382 1.569 588 HG11 VAL 74 HG11 VAL 74 -16.750 -0.190 3.955 589 HG12 VAL 74 HG12 VAL 74 -16.916 -1.946 3.968 590 HG13 VAL 74 HG13 VAL 74 -17.893 -0.976 2.866 591 HG21 VAL 74 HG21 VAL 74 -14.317 -1.731 3.678 592 HG22 VAL 74 HG22 VAL 74 -14.396 -0.002 3.338 593 HG23 VAL 74 HG23 VAL 74 -13.712 -1.104 2.144 594 H VAL 75 H VAL 75 -17.561 -2.261 -0.407 595 HA VAL 75 HA VAL 75 -15.402 -2.170 -2.403 596 HB VAL 75 HB VAL 75 -18.301 -2.836 -2.890 597 HG11 VAL 75 HG11 VAL 75 -17.083 -1.969 -4.837 598 HG12 VAL 75 HG12 VAL 75 -17.509 -3.669 -5.034 599 HG13 VAL 75 HG13 VAL 75 -15.856 -3.217 -4.617 600 HG21 VAL 75 HG21 VAL 75 -17.798 -4.736 -1.798 601 HG22 VAL 75 HG22 VAL 75 -16.060 -4.467 -1.920 602 HG23 VAL 75 HG23 VAL 75 -16.944 -5.153 -3.283 603 H VAL 76 H VAL 76 -15.276 -0.619 -3.906 604 HA VAL 76 HA VAL 76 -17.341 1.335 -4.324 605 HB VAL 76 HB VAL 76 -15.977 3.298 -3.759 606 HG11 VAL 76 HG11 VAL 76 -16.149 1.560 -1.315 607 HG12 VAL 76 HG12 VAL 76 -17.583 2.182 -2.130 608 HG13 VAL 76 HG13 VAL 76 -16.402 3.300 -1.449 609 HG21 VAL 76 HG21 VAL 76 -13.778 3.046 -3.563 610 HG22 VAL 76 HG22 VAL 76 -13.926 1.296 -3.396 611 HG23 VAL 76 HG23 VAL 76 -14.071 2.332 -1.976 612 H HIS 77 H HIS 77 -16.498 3.029 -5.977 613 HA HIS 77 HA HIS 77 -14.433 1.807 -7.677 614 HB2 HIS 77 HB3 HIS 77 -16.677 3.025 -9.145 615 HB3 HIS 77 HB2 HIS 77 -15.778 1.547 -9.473 616 HD1 HIS 77 HD1 HIS 77 -16.411 -0.312 -7.319 617 HD2 HIS 77 HD2 HIS 77 -19.257 2.373 -8.719 618 HE1 HIS 77 HE1 HIS 77 -18.633 -1.284 -6.659 619 HE2 HIS 77 HE2 HIS 77 -20.335 0.407 -7.429 620 H ASP 78 H ASP 78 -15.686 4.648 -6.282 621 HA ASP 78 HA ASP 78 -14.036 6.273 -8.103 622 HB2 ASP 78 HB3 ASP 78 -16.692 6.591 -7.716 623 HB3 ASP 78 HB2 ASP 78 -16.070 7.642 -6.448 624 H VAL 79 H VAL 79 -12.679 7.841 -7.244 625 HA VAL 79 HA VAL 79 -11.486 7.261 -4.776 626 HB VAL 79 HB VAL 79 -10.419 9.580 -5.139 627 HG11 VAL 79 HG11 VAL 79 -8.733 8.535 -6.206 628 HG12 VAL 79 HG12 VAL 79 -9.785 7.918 -7.480 629 HG13 VAL 79 HG13 VAL 79 -9.723 7.104 -5.916 630 HG21 VAL 79 HG21 VAL 79 -11.023 10.852 -6.861 631 HG22 VAL 79 HG22 VAL 79 -12.422 9.795 -7.037 632 HG23 VAL 79 HG23 VAL 79 -10.963 9.488 -7.976 633 H ALA 80 H ALA 80 -13.862 9.656 -5.756 634 HA ALA 80 HA ALA 80 -13.866 11.075 -3.282 635 HB1 ALA 80 HB1 ALA 80 -16.299 11.134 -4.960 636 HB2 ALA 80 HB2 ALA 80 -14.802 11.667 -5.727 637 HB3 ALA 80 HB3 ALA 80 -15.371 12.459 -4.258 638 H ALA 81 H ALA 81 -15.792 8.464 -4.664 639 HA ALA 81 HA ALA 81 -17.807 8.276 -2.767 640 HB1 ALA 81 HB1 ALA 81 -18.301 6.217 -3.667 641 HB2 ALA 81 HB2 ALA 81 -16.604 5.779 -3.874 642 HB3 ALA 81 HB3 ALA 81 -17.358 6.934 -4.974 643 H VAL 82 H VAL 82 -14.880 6.227 -2.853 644 HA VAL 82 HA VAL 82 -15.113 5.066 -0.383 645 HB VAL 82 HB VAL 82 -13.367 4.688 -2.260 646 HG11 VAL 82 HG11 VAL 82 -11.526 6.280 -0.549 647 HG12 VAL 82 HG12 VAL 82 -12.479 7.110 -1.778 648 HG13 VAL 82 HG13 VAL 82 -11.376 5.817 -2.244 649 HG21 VAL 82 HG21 VAL 82 -12.345 4.495 0.561 650 HG22 VAL 82 HG22 VAL 82 -11.996 3.432 -0.802 651 HG23 VAL 82 HG23 VAL 82 -13.605 3.441 -0.081 652 H PHE 83 H PHE 83 -13.901 8.285 -1.157 653 HA PHE 83 HA PHE 83 -12.700 8.875 1.302 654 HB2 PHE 83 HB3 PHE 83 -13.594 10.368 -1.045 655 HB3 PHE 83 HB2 PHE 83 -13.749 11.294 0.445 656 HD1 PHE 83 HD2 PHE 83 -11.514 10.629 2.040 657 HD2 PHE 83 HD1 PHE 83 -11.720 10.993 -2.194 658 HE1 PHE 83 HE2 PHE 83 -9.107 11.140 1.973 659 HE2 PHE 83 HE1 PHE 83 -9.313 11.503 -2.271 660 HZ PHE 83 HZ PHE 83 -8.005 11.579 -0.185 661 H ALA 84 H ALA 84 -16.060 9.194 0.239 662 HA ALA 84 HA ALA 84 -17.040 10.533 2.503 663 HB1 ALA 84 HB1 ALA 84 -18.280 10.157 0.346 664 HB2 ALA 84 HB2 ALA 84 -19.219 9.858 1.808 665 HB3 ALA 84 HB3 ALA 84 -18.572 8.503 0.883 666 H TYR 85 H TYR 85 -16.614 7.114 1.782 667 HA TYR 85 HA TYR 85 -17.776 6.073 4.110 668 HB2 TYR 85 HB3 TYR 85 -17.230 4.131 3.128 669 HB3 TYR 85 HB2 TYR 85 -16.366 5.034 1.894 670 HD1 TYR 85 HD1 TYR 85 -15.827 3.729 5.365 671 HD2 TYR 85 HD2 TYR 85 -14.161 4.512 1.533 672 HE1 TYR 85 HE1 TYR 85 -13.715 2.685 6.074 673 HE2 TYR 85 HE2 TYR 85 -12.045 3.473 2.230 674 HH TYR 85 HH TYR 85 -11.704 1.501 4.734 675 H ALA 86 H ALA 86 -14.284 6.584 3.457 676 HA ALA 86 HA ALA 86 -13.247 6.129 5.916 677 HB1 ALA 86 HB1 ALA 86 -11.945 6.763 3.910 678 HB2 ALA 86 HB2 ALA 86 -11.429 7.612 5.367 679 HB3 ALA 86 HB3 ALA 86 -12.421 8.442 4.168 680 H LYS 87 H LYS 87 -15.171 8.891 4.981 681 HA LYS 87 HA LYS 87 -14.568 10.504 7.251 682 HB2 LYS 87 HB3 LYS 87 -16.021 10.822 4.897 683 HB3 LYS 87 HB2 LYS 87 -17.247 10.883 6.154 684 HG2 LYS 87 HG3 LYS 87 -16.712 12.989 6.558 685 HG3 LYS 87 HG2 LYS 87 -15.085 12.483 7.019 686 HD2 LYS 87 HD3 LYS 87 -14.400 13.732 5.288 687 HD3 LYS 87 HD2 LYS 87 -14.973 12.401 4.281 688 HE2 LYS 87 HE3 LYS 87 -16.565 14.836 5.080 689 HE3 LYS 87 HE2 LYS 87 -15.843 14.545 3.498 690 HZ1 LYS 87 HZ1 LYS 87 -17.608 12.461 4.484 691 HZ2 LYS 87 HZ2 LYS 87 -17.459 13.109 2.929 692 HZ3 LYS 87 HZ3 LYS 87 -18.356 13.931 4.104 693 H GLN 88 H GLN 88 -17.180 8.289 6.427 694 HA GLN 88 HA GLN 88 -18.690 8.521 8.766 695 HB2 GLN 88 HB3 GLN 88 -19.042 7.198 6.463 696 HB3 GLN 88 HB2 GLN 88 -18.533 5.851 7.473 697 HG2 GLN 88 HG3 GLN 88 -20.658 5.677 8.080 698 HG3 GLN 88 HG2 GLN 88 -20.400 7.138 9.033 699 HE21 GLN 88 HE21 GLN 88 -20.872 6.403 5.589 700 HE22 GLN 88 HE22 GLN 88 -22.131 7.560 5.341 701 H HIS 89 H HIS 89 -15.657 6.998 8.234 702 HA HIS 89 HA HIS 89 -15.865 5.559 10.790 703 HB2 HIS 89 HB3 HIS 89 -14.396 5.064 8.263 704 HB3 HIS 89 HB2 HIS 89 -13.552 4.644 9.752 705 HD1 HIS 89 HD1 HIS 89 -15.931 3.532 11.372 706 HD2 HIS 89 HD2 HIS 89 -15.159 2.598 7.399 707 HE1 HIS 89 HE1 HIS 89 -17.063 1.323 10.970 708 HE2 HIS 89 HE2 HIS 89 -16.657 0.821 8.534 709 HA PRO 90 HA PRO 90 -13.079 9.188 11.630 710 HB2 PRO 90 HB3 PRO 90 -14.245 9.979 13.924 711 HB3 PRO 90 HB2 PRO 90 -14.870 10.459 12.341 712 HG2 PRO 90 HG3 PRO 90 -15.816 8.281 14.168 713 HG3 PRO 90 HG2 PRO 90 -16.769 9.471 13.262 714 HD2 PRO 90 HD3 PRO 90 -16.400 6.913 12.413 715 HD3 PRO 90 HD2 PRO 90 -16.629 8.280 11.304 716 H ASP 91 H ASP 91 -13.773 6.211 13.044 717 HA ASP 91 HA ASP 91 -11.871 6.579 15.239 718 HB2 ASP 91 HB3 ASP 91 -14.135 5.463 15.579 719 HB3 ASP 91 HB2 ASP 91 -13.497 4.105 14.657 720 H GLN 92 H GLN 92 -12.113 5.225 12.093 721 HA GLN 92 HA GLN 92 -9.671 3.644 12.506 722 HB2 GLN 92 HB3 GLN 92 -12.075 3.108 11.116 723 HB3 GLN 92 HB2 GLN 92 -10.821 3.285 9.899 724 HG2 GLN 92 HG3 GLN 92 -9.969 1.299 10.373 725 HG3 GLN 92 HG2 GLN 92 -9.898 1.668 12.096 726 HE21 GLN 92 HE21 GLN 92 -11.126 0.489 13.374 727 HE22 GLN 92 HE22 GLN 92 -12.515 -0.420 12.896 728 H GLU 93 H GLU 93 -8.278 3.560 10.417 729 HA GLU 93 HA GLU 93 -7.989 6.299 9.365 730 HB2 GLU 93 HB3 GLU 93 -6.214 5.150 11.050 731 HB3 GLU 93 HB2 GLU 93 -5.569 4.602 9.508 732 HG2 GLU 93 HG3 GLU 93 -5.486 6.937 8.740 733 HG3 GLU 93 HG2 GLU 93 -6.062 7.457 10.323 734 H LEU 94 H LEU 94 -7.128 6.499 7.233 735 HA LEU 94 HA LEU 94 -7.736 4.163 5.567 736 HB2 LEU 94 HB3 LEU 94 -8.531 6.785 5.357 737 HB3 LEU 94 HB2 LEU 94 -7.207 6.705 4.210 738 HG LEU 94 HG LEU 94 -8.335 4.793 3.095 739 HD11 LEU 94 HD11 LEU 94 -9.746 3.729 4.514 740 HD12 LEU 94 HD12 LEU 94 -10.911 4.813 3.754 741 HD13 LEU 94 HD13 LEU 94 -10.230 5.215 5.331 742 HD21 LEU 94 HD21 LEU 94 -9.967 7.317 3.337 743 HD22 LEU 94 HD22 LEU 94 -10.102 6.127 2.043 744 HD23 LEU 94 HD23 LEU 94 -8.613 7.052 2.238 745 H VAL 95 H VAL 95 -6.141 3.030 4.696 746 HA VAL 95 HA VAL 95 -3.617 4.373 4.042 747 HB VAL 95 HB VAL 95 -3.709 1.683 5.406 748 HG11 VAL 95 HG11 VAL 95 -1.308 3.447 5.171 749 HG12 VAL 95 HG12 VAL 95 -1.791 2.432 3.813 750 HG13 VAL 95 HG13 VAL 95 -1.399 1.697 5.367 751 HG21 VAL 95 HG21 VAL 95 -4.227 2.937 7.220 752 HG22 VAL 95 HG22 VAL 95 -3.601 4.424 6.509 753 HG23 VAL 95 HG23 VAL 95 -2.491 3.245 7.207 754 H ILE 96 H ILE 96 -2.745 3.769 2.138 755 HA ILE 96 HA ILE 96 -4.206 1.789 0.563 756 HB ILE 96 HB ILE 96 -1.999 3.616 -0.383 757 HG12 ILE 96 HG13 ILE 96 -3.832 4.950 0.562 758 HG13 ILE 96 HG12 ILE 96 -3.769 5.114 -1.190 759 HG21 ILE 96 HG21 ILE 96 -4.051 1.909 -1.756 760 HG22 ILE 96 HG22 ILE 96 -2.298 1.898 -1.948 761 HG23 ILE 96 HG23 ILE 96 -3.245 3.245 -2.579 762 HD11 ILE 96 HD11 ILE 96 -6.016 4.869 -0.825 763 HD12 ILE 96 HD12 ILE 96 -5.787 3.745 0.515 764 HD13 ILE 96 HD13 ILE 96 -5.537 3.202 -1.145 765 H ALA 97 H ALA 97 -3.394 -0.145 -0.009 766 HA ALA 97 HA ALA 97 -0.598 -0.712 0.729 767 HB1 ALA 97 HB1 ALA 97 -3.029 -2.483 0.797 768 HB2 ALA 97 HB2 ALA 97 -2.010 -1.978 2.144 769 HB3 ALA 97 HB3 ALA 97 -1.383 -3.100 0.936 770 H GLY 98 H GLY 98 -2.898 -0.694 -1.837 771 HA2 GLY 98 HA3 GLY 98 -1.248 -0.857 -3.948 772 HA3 GLY 98 HA2 GLY 98 -1.400 -2.548 -3.494 773 H GLY 99 H GLY 99 -3.926 -2.006 -6.087 774 HA2 GLY 99 HA3 GLY 99 -1.084 -2.328 -5.574 775 HA3 GLY 99 HA2 GLY 99 -1.915 -2.609 -7.093 776 H ALA 100 H ALA 100 -0.431 -1.476 -8.320 777 HA ALA 100 HA ALA 100 0.548 1.086 -7.764 778 HB1 ALA 100 HB1 ALA 100 0.414 -0.660 -10.143 779 HB2 ALA 100 HB2 ALA 100 1.794 0.157 -9.409 780 HB3 ALA 100 HB3 ALA 100 0.680 1.058 -10.437 781 H GLN 101 H GLN 101 -2.269 0.063 -9.673 782 HA GLN 101 HA GLN 101 -3.024 2.598 -10.593 783 HB2 GLN 101 HB3 GLN 101 -4.054 -0.035 -10.704 784 HB3 GLN 101 HB2 GLN 101 -5.349 0.988 -10.097 785 HG2 GLN 101 HG3 GLN 101 -3.806 1.863 -12.488 786 HG3 GLN 101 HG2 GLN 101 -5.029 0.605 -12.658 787 HE21 GLN 101 HE21 GLN 101 -4.498 3.898 -11.525 788 HE22 GLN 101 HE22 GLN 101 -6.111 4.450 -11.808 789 H ILE 102 H ILE 102 -3.625 0.949 -7.562 790 HA ILE 102 HA ILE 102 -5.577 2.806 -6.606 791 HB ILE 102 HB ILE 102 -3.860 0.997 -4.913 792 HG12 ILE 102 HG13 ILE 102 -4.840 -0.353 -6.683 793 HG13 ILE 102 HG12 ILE 102 -5.666 -0.681 -5.163 794 HG21 ILE 102 HG21 ILE 102 -5.698 1.073 -3.359 795 HG22 ILE 102 HG22 ILE 102 -6.663 2.020 -4.492 796 HG23 ILE 102 HG23 ILE 102 -5.216 2.720 -3.766 797 HD11 ILE 102 HD11 ILE 102 -6.759 1.317 -7.095 798 HD12 ILE 102 HD12 ILE 102 -7.592 0.413 -5.831 799 HD13 ILE 102 HD13 ILE 102 -7.059 -0.408 -7.298 800 H PHE 103 H PHE 103 -2.098 2.373 -6.140 801 HA PHE 103 HA PHE 103 -1.689 4.335 -4.199 802 HB2 PHE 103 HB3 PHE 103 0.110 3.275 -6.378 803 HB3 PHE 103 HB2 PHE 103 0.661 4.435 -5.175 804 HD1 PHE 103 HD2 PHE 103 -0.640 3.456 -2.741 805 HD2 PHE 103 HD1 PHE 103 1.235 1.314 -5.905 806 HE1 PHE 103 HE2 PHE 103 -0.141 1.611 -1.192 807 HE2 PHE 103 HE1 PHE 103 1.737 -0.535 -4.361 808 HZ PHE 103 HZ PHE 103 1.049 -0.387 -2.001 809 H THR 104 H THR 104 -1.464 4.591 -7.742 810 HA THR 104 HA THR 104 -0.770 7.266 -7.924 811 HB THR 104 HB THR 104 -2.523 5.676 -9.803 812 HG1 THR 104 HG1 THR 104 -0.671 4.619 -9.846 813 HG21 THR 104 HG21 THR 104 -1.024 7.376 -11.328 814 HG22 THR 104 HG22 THR 104 -1.485 8.387 -9.957 815 HG23 THR 104 HG23 THR 104 -2.727 7.585 -10.919 816 H ALA 105 H ALA 105 -4.019 5.838 -7.719 817 HA ALA 105 HA ALA 105 -5.515 8.133 -8.149 818 HB1 ALA 105 HB1 ALA 105 -7.094 6.886 -6.389 819 HB2 ALA 105 HB2 ALA 105 -5.985 5.566 -6.761 820 HB3 ALA 105 HB3 ALA 105 -6.898 6.342 -8.055 821 H PHE 106 H PHE 106 -4.606 6.825 -4.927 822 HA PHE 106 HA PHE 106 -5.402 9.272 -3.679 823 HB2 PHE 106 HB3 PHE 106 -3.977 6.845 -2.579 824 HB3 PHE 106 HB2 PHE 106 -4.581 8.183 -1.608 825 HD1 PHE 106 HD2 PHE 106 -5.627 5.480 -3.912 826 HD2 PHE 106 HD1 PHE 106 -6.815 8.251 -0.910 827 HE1 PHE 106 HE2 PHE 106 -7.821 4.376 -3.769 828 HE2 PHE 106 HE1 PHE 106 -9.011 7.151 -0.760 829 HZ PHE 106 HZ PHE 106 -9.515 5.210 -2.191 830 H LYS 107 H LYS 107 -2.530 8.241 -5.215 831 HA LYS 107 HA LYS 107 -0.501 9.305 -3.696 832 HB2 LYS 107 HB3 LYS 107 0.824 9.341 -5.611 833 HB3 LYS 107 HB2 LYS 107 -0.396 8.145 -6.007 834 HG2 LYS 107 HG3 LYS 107 -0.636 9.267 -7.911 835 HG3 LYS 107 HG2 LYS 107 -1.517 10.457 -6.955 836 HD2 LYS 107 HD3 LYS 107 1.213 11.039 -6.613 837 HD3 LYS 107 HD2 LYS 107 0.989 10.721 -8.334 838 HE2 LYS 107 HE3 LYS 107 -0.304 12.553 -8.643 839 HE3 LYS 107 HE2 LYS 107 -1.046 12.429 -7.048 840 HZ1 LYS 107 HZ1 LYS 107 1.261 13.933 -7.887 841 HZ2 LYS 107 HZ2 LYS 107 1.513 13.055 -6.464 842 HZ3 LYS 107 HZ3 LYS 107 0.243 14.167 -6.557 843 H ASP 108 H ASP 108 -2.902 10.983 -5.584 844 HA ASP 108 HA ASP 108 -1.642 13.569 -5.177 845 HB2 ASP 108 HB3 ASP 108 -2.995 12.776 -7.269 846 HB3 ASP 108 HB2 ASP 108 -4.402 13.200 -6.298 847 H ASP 109 H ASP 109 -4.514 11.790 -4.121 848 HA ASP 109 HA ASP 109 -5.328 13.957 -2.365 849 HB2 ASP 109 HB3 ASP 109 -6.583 11.661 -3.551 850 HB3 ASP 109 HB2 ASP 109 -6.851 11.643 -1.811 851 H VAL 110 H VAL 110 -2.891 11.906 -2.038 852 HA VAL 110 HA VAL 110 -3.457 10.894 0.618 853 HB VAL 110 HB VAL 110 -2.147 9.530 -0.955 854 HG11 VAL 110 HG11 VAL 110 0.261 11.221 -0.593 855 HG12 VAL 110 HG12 VAL 110 -0.940 11.755 -1.768 856 HG13 VAL 110 HG13 VAL 110 -0.194 10.166 -1.930 857 HG21 VAL 110 HG21 VAL 110 -1.881 9.379 1.545 858 HG22 VAL 110 HG22 VAL 110 -0.417 10.347 1.369 859 HG23 VAL 110 HG23 VAL 110 -0.525 8.764 0.599 860 H ASP 111 H ASP 111 -2.045 11.306 2.442 861 HA ASP 111 HA ASP 111 -0.915 14.027 2.411 862 HB2 ASP 111 HB3 ASP 111 -3.075 13.195 3.890 863 HB3 ASP 111 HB2 ASP 111 -1.749 12.996 5.032 864 H THR 112 H THR 112 -0.655 10.759 3.723 865 HA THR 112 HA THR 112 2.127 11.353 4.491 866 HB THR 112 HB THR 112 0.347 9.184 5.618 867 HG1 THR 112 HG1 THR 112 -0.300 10.584 7.025 868 HG21 THR 112 HG21 THR 112 2.027 9.077 7.413 869 HG22 THR 112 HG22 THR 112 3.048 10.183 6.493 870 HG23 THR 112 HG23 THR 112 2.665 8.589 5.843 871 H LEU 113 H LEU 113 3.679 9.588 4.201 872 HA LEU 113 HA LEU 113 2.891 7.521 2.307 873 HB2 LEU 113 HB3 LEU 113 3.722 9.674 1.162 874 HB3 LEU 113 HB2 LEU 113 5.301 9.213 1.764 875 HG LEU 113 HG LEU 113 4.730 6.934 0.558 876 HD11 LEU 113 HD11 LEU 113 3.224 6.999 -1.150 877 HD12 LEU 113 HD12 LEU 113 3.392 8.739 -1.382 878 HD13 LEU 113 HD13 LEU 113 2.435 8.116 -0.037 879 HD21 LEU 113 HD21 LEU 113 5.455 8.842 -1.485 880 HD22 LEU 113 HD22 LEU 113 6.430 7.590 -0.714 881 HD23 LEU 113 HD23 LEU 113 6.282 9.179 0.037 882 H LEU 114 H LEU 114 3.919 5.644 2.642 883 HA LEU 114 HA LEU 114 6.407 5.630 4.203 884 HB2 LEU 114 HB3 LEU 114 4.090 3.751 4.679 885 HB3 LEU 114 HB2 LEU 114 5.624 3.743 5.527 886 HG LEU 114 HG LEU 114 4.030 6.248 5.632 887 HD11 LEU 114 HD11 LEU 114 3.357 4.156 7.622 888 HD12 LEU 114 HD12 LEU 114 2.591 4.058 6.036 889 HD13 LEU 114 HD13 LEU 114 2.393 5.506 7.023 890 HD21 LEU 114 HD21 LEU 114 5.208 6.633 7.540 891 HD22 LEU 114 HD22 LEU 114 6.349 5.561 6.728 892 HD23 LEU 114 HD23 LEU 114 5.277 4.925 7.976 893 H VAL 115 H VAL 115 7.915 4.679 2.996 894 HA VAL 115 HA VAL 115 7.096 2.396 1.317 895 HB VAL 115 HB VAL 115 8.708 3.099 -0.389 896 HG11 VAL 115 HG11 VAL 115 6.325 3.795 -0.483 897 HG12 VAL 115 HG12 VAL 115 7.419 4.900 -1.316 898 HG13 VAL 115 HG13 VAL 115 6.783 5.321 0.275 899 HG21 VAL 115 HG21 VAL 115 9.794 5.243 -0.312 900 HG22 VAL 115 HG22 VAL 115 10.207 4.347 1.150 901 HG23 VAL 115 HG23 VAL 115 9.004 5.635 1.215 902 H THR 116 H THR 116 8.391 0.656 1.248 903 HA THR 116 HA THR 116 10.784 0.690 2.962 904 HB THR 116 HB THR 116 8.932 -1.572 2.180 905 HG1 THR 116 HG1 THR 116 8.552 -1.628 4.416 906 HG21 THR 116 HG21 THR 116 11.041 -2.608 2.264 907 HG22 THR 116 HG22 THR 116 10.283 -2.911 3.828 908 HG23 THR 116 HG23 THR 116 11.530 -1.672 3.677 909 H ARG 117 H ARG 117 12.403 1.212 1.559 910 HA ARG 117 HA ARG 117 12.524 -0.037 -1.057 911 HB2 ARG 117 HB3 ARG 117 13.976 2.171 0.319 912 HB3 ARG 117 HB2 ARG 117 14.787 1.350 -1.007 913 HG2 ARG 117 HG3 ARG 117 12.677 1.809 -2.361 914 HG3 ARG 117 HG2 ARG 117 12.237 2.925 -1.066 915 HD2 ARG 117 HD3 ARG 117 14.722 3.025 -2.770 916 HD3 ARG 117 HD2 ARG 117 13.348 4.128 -2.846 917 HE ARG 117 HE ARG 117 14.562 4.036 -0.254 918 HH11 ARG 117 HH11 ARG 117 14.775 5.464 -3.431 919 HH12 ARG 117 HH12 ARG 117 15.618 6.872 -2.879 920 HH21 ARG 117 HH21 ARG 117 15.670 5.887 0.475 921 HH22 ARG 117 HH22 ARG 117 16.126 7.113 -0.661 922 H LEU 118 H LEU 118 13.195 -2.085 -1.079 923 HA LEU 118 HA LEU 118 14.990 -3.205 0.810 924 HB2 LEU 118 HB3 LEU 118 13.558 -4.094 -1.601 925 HB3 LEU 118 HB2 LEU 118 15.075 -4.923 -1.314 926 HG LEU 118 HG LEU 118 14.296 -5.563 0.932 927 HD11 LEU 118 HD11 LEU 118 12.375 -4.859 1.875 928 HD12 LEU 118 HD12 LEU 118 11.505 -4.830 0.342 929 HD13 LEU 118 HD13 LEU 118 12.579 -3.499 0.771 930 HD21 LEU 118 HD21 LEU 118 12.059 -6.462 -0.759 931 HD22 LEU 118 HD22 LEU 118 13.245 -7.397 0.152 932 HD23 LEU 118 HD23 LEU 118 13.674 -6.720 -1.419 933 H ALA 119 H ALA 119 17.129 -3.965 0.475 934 HA ALA 119 HA ALA 119 18.742 -2.167 -1.087 935 HB1 ALA 119 HB1 ALA 119 19.182 -3.426 1.242 936 HB2 ALA 119 HB2 ALA 119 20.477 -2.839 0.199 937 HB3 ALA 119 HB3 ALA 119 20.002 -4.536 0.144 938 H GLY 120 H GLY 120 17.907 -5.605 -1.190 939 HA2 GLY 120 HA3 GLY 120 19.628 -6.374 -3.260 940 HA3 GLY 120 HA2 GLY 120 18.112 -7.166 -2.856 941 H SER 121 H SER 121 19.355 -6.629 -5.470 942 HA SER 121 HA SER 121 17.461 -4.746 -6.666 943 HB2 SER 121 HB3 SER 121 18.912 -4.560 -8.477 944 HB3 SER 121 HB2 SER 121 20.034 -4.832 -7.143 945 HG SER 121 HG SER 121 19.125 -6.698 -9.069 946 H PHE 122 H PHE 122 15.591 -5.548 -7.339 947 HA PHE 122 HA PHE 122 15.564 -8.252 -8.512 948 HB2 PHE 122 HB3 PHE 122 13.315 -6.918 -6.993 949 HB3 PHE 122 HB2 PHE 122 13.303 -8.547 -7.658 950 HD1 PHE 122 HD2 PHE 122 15.044 -6.386 -5.194 951 HD2 PHE 122 HD1 PHE 122 14.039 -10.346 -6.385 952 HE1 PHE 122 HE2 PHE 122 15.956 -7.249 -3.079 953 HE2 PHE 122 HE1 PHE 122 14.949 -11.217 -4.271 954 HZ PHE 122 HZ PHE 122 15.910 -9.668 -2.615 955 H GLU 123 H GLU 123 13.770 -8.611 -10.064 956 HA GLU 123 HA GLU 123 12.966 -6.157 -11.465 957 HB2 GLU 123 HB3 GLU 123 13.469 -7.187 -13.623 958 HB3 GLU 123 HB2 GLU 123 14.916 -7.077 -12.630 959 HG2 GLU 123 HG3 GLU 123 13.837 -9.573 -12.045 960 HG3 GLU 123 HG2 GLU 123 13.647 -9.389 -13.788 961 H GLY 124 H GLY 124 10.919 -6.154 -12.255 962 HA2 GLY 124 HA3 GLY 124 9.448 -8.677 -12.425 963 HA3 GLY 124 HA2 GLY 124 8.846 -7.468 -11.301 964 H ASP 125 H ASP 125 7.018 -6.729 -12.199 965 HA ASP 125 HA ASP 125 7.235 -5.390 -14.778 966 HB2 ASP 125 HB3 ASP 125 6.069 -7.928 -14.581 967 HB3 ASP 125 HB2 ASP 125 4.710 -6.810 -14.658 968 H THR 126 H THR 126 6.887 -4.640 -11.912 969 HA THR 126 HA THR 126 4.669 -2.808 -12.335 970 HB THR 126 HB THR 126 4.696 -4.111 -9.666 971 HG1 THR 126 HG1 THR 126 3.715 -5.911 -10.339 972 HG21 THR 126 HG21 THR 126 3.096 -2.360 -10.054 973 HG22 THR 126 HG22 THR 126 2.257 -3.904 -9.903 974 HG23 THR 126 HG23 THR 126 2.497 -3.183 -11.495 975 H LYS 127 H LYS 127 5.783 -0.966 -12.183 976 HA LYS 127 HA LYS 127 7.613 -0.607 -9.903 977 HB2 LYS 127 HB3 LYS 127 8.049 -0.163 -12.602 978 HB3 LYS 127 HB2 LYS 127 7.717 1.447 -11.978 979 HG2 LYS 127 HG3 LYS 127 9.436 0.738 -10.127 980 HG3 LYS 127 HG2 LYS 127 9.966 -0.399 -11.368 981 HD2 LYS 127 HD3 LYS 127 11.070 1.218 -12.421 982 HD3 LYS 127 HD2 LYS 127 9.593 2.172 -12.559 983 HE2 LYS 127 HE3 LYS 127 11.619 2.190 -10.335 984 HE3 LYS 127 HE2 LYS 127 11.165 3.517 -11.403 985 HZ1 LYS 127 HZ1 LYS 127 8.833 3.115 -10.342 986 HZ2 LYS 127 HZ2 LYS 127 9.995 4.033 -9.525 987 HZ3 LYS 127 HZ3 LYS 127 9.733 2.421 -9.088 988 H MET 128 H MET 128 7.711 1.676 -9.065 989 HA MET 128 HA MET 128 5.141 2.471 -8.193 990 HB2 MET 128 HB3 MET 128 7.290 2.778 -6.929 991 HB3 MET 128 HB2 MET 128 7.688 4.085 -8.035 992 HG2 MET 128 HG3 MET 128 6.757 4.871 -5.899 993 HG3 MET 128 HG2 MET 128 5.800 5.365 -7.293 994 HE1 MET 128 HE1 MET 128 3.044 5.543 -6.067 995 HE2 MET 128 HE2 MET 128 4.501 6.043 -5.208 996 HE3 MET 128 HE3 MET 128 3.311 5.020 -4.404 997 H ILE 129 H ILE 129 4.290 4.706 -8.386 998 HA ILE 129 HA ILE 129 4.475 5.610 -11.177 999 HB ILE 129 HB ILE 129 2.282 6.687 -10.785 1000 HG12 ILE 129 HG13 ILE 129 1.238 5.436 -8.567 1001 HG13 ILE 129 HG12 ILE 129 2.864 5.842 -8.033 1002 HG21 ILE 129 HG21 ILE 129 1.633 4.778 -11.728 1003 HG22 ILE 129 HG22 ILE 129 1.263 4.198 -10.104 1004 HG23 ILE 129 HG23 ILE 129 2.830 3.845 -10.831 1005 HD11 ILE 129 HD11 ILE 129 2.501 8.153 -8.457 1006 HD12 ILE 129 HD12 ILE 129 1.145 7.549 -7.507 1007 HD13 ILE 129 HD13 ILE 129 0.956 7.823 -9.239 1008 HA PRO 130 HA PRO 130 6.263 9.503 -10.144 1009 HB2 PRO 130 HB3 PRO 130 4.739 11.226 -11.661 1010 HB3 PRO 130 HB2 PRO 130 6.069 10.249 -12.290 1011 HG2 PRO 130 HG3 PRO 130 3.125 9.730 -12.384 1012 HG3 PRO 130 HG2 PRO 130 4.349 9.476 -13.642 1013 HD2 PRO 130 HD3 PRO 130 3.395 7.437 -12.188 1014 HD3 PRO 130 HD2 PRO 130 5.096 7.497 -12.692 1015 H LEU 131 H LEU 131 6.010 11.257 -8.786 1016 HA LEU 131 HA LEU 131 3.353 12.033 -7.905 1017 HB2 LEU 131 HB3 LEU 131 5.102 11.613 -5.599 1018 HB3 LEU 131 HB2 LEU 131 3.401 11.254 -5.797 1019 HG LEU 131 HG LEU 131 4.888 9.338 -7.310 1020 HD11 LEU 131 HD11 LEU 131 6.098 10.099 -4.739 1021 HD12 LEU 131 HD12 LEU 131 6.812 9.316 -6.148 1022 HD13 LEU 131 HD13 LEU 131 5.856 8.372 -5.005 1023 HD21 LEU 131 HD21 LEU 131 3.877 8.135 -4.999 1024 HD22 LEU 131 HD22 LEU 131 3.096 8.246 -6.576 1025 HD23 LEU 131 HD23 LEU 131 2.784 9.473 -5.349 1026 H ASN 132 H ASN 132 3.397 13.954 -6.504 1027 HA ASN 132 HA ASN 132 5.483 15.776 -7.363 1028 HB2 ASN 132 HB3 ASN 132 3.161 16.542 -7.410 1029 HB3 ASN 132 HB2 ASN 132 3.000 16.226 -5.686 1030 HD21 ASN 132 HD21 ASN 132 5.782 17.666 -7.291 1031 HD22 ASN 132 HD22 ASN 132 5.640 19.214 -6.541 1032 H TRP 133 H TRP 133 7.213 14.778 -6.220 1033 HA TRP 133 HA TRP 133 7.264 14.367 -3.451 1034 HB2 TRP 133 HB3 TRP 133 9.539 14.841 -5.379 1035 HB3 TRP 133 HB2 TRP 133 9.730 14.267 -3.725 1036 HD1 TRP 133 HD1 TRP 133 8.283 13.148 -7.112 1037 HE1 TRP 133 HE1 TRP 133 8.163 10.575 -7.132 1038 HE3 TRP 133 HE3 TRP 133 9.653 12.233 -2.271 1039 HZ2 TRP 133 HZ2 TRP 133 8.599 8.443 -5.334 1040 HZ3 TRP 133 HZ3 TRP 133 9.778 9.900 -1.502 1041 HH2 TRP 133 HH2 TRP 133 9.260 8.045 -3.002 1042 H ASP 134 H ASP 134 8.048 17.283 -5.345 1043 HA ASP 134 HA ASP 134 9.450 18.690 -3.424 1044 HB2 ASP 134 HB3 ASP 134 8.822 19.262 -5.901 1045 HB3 ASP 134 HB2 ASP 134 7.448 20.081 -5.165 1046 H ASP 135 H ASP 135 5.936 18.476 -3.888 1047 HA ASP 135 HA ASP 135 5.341 20.277 -1.754 1048 HB2 ASP 135 HB3 ASP 135 3.799 19.922 -3.636 1049 HB3 ASP 135 HB2 ASP 135 3.557 18.254 -3.124 1050 H PHE 136 H PHE 136 6.608 17.239 -1.636 1051 HA PHE 136 HA PHE 136 5.380 16.725 0.990 1052 HB2 PHE 136 HB3 PHE 136 6.138 14.788 -1.186 1053 HB3 PHE 136 HB2 PHE 136 5.982 14.271 0.489 1054 HD1 PHE 136 HD2 PHE 136 4.030 16.385 -1.895 1055 HD2 PHE 136 HD1 PHE 136 3.997 13.259 0.992 1056 HE1 PHE 136 HE2 PHE 136 1.603 16.126 -2.209 1057 HE2 PHE 136 HE1 PHE 136 1.570 12.993 0.683 1058 HZ PHE 136 HZ PHE 136 0.370 14.428 -0.919 1059 H THR 137 H THR 137 6.719 16.491 2.661 1060 HA THR 137 HA THR 137 9.611 16.404 2.095 1061 HB THR 137 HB THR 137 8.087 17.740 4.334 1062 HG1 THR 137 HG1 THR 137 9.868 18.753 2.374 1063 HG21 THR 137 HG21 THR 137 11.069 17.466 4.049 1064 HG22 THR 137 HG22 THR 137 10.066 16.787 5.332 1065 HG23 THR 137 HG23 THR 137 10.241 18.536 5.180 1066 H LYS 138 H LYS 138 10.930 15.071 3.304 1067 HA LYS 138 HA LYS 138 9.780 12.665 4.235 1068 HB2 LYS 138 HB3 LYS 138 12.050 12.825 3.259 1069 HB3 LYS 138 HB2 LYS 138 12.581 13.701 4.690 1070 HG2 LYS 138 HG3 LYS 138 12.740 11.841 5.928 1071 HG3 LYS 138 HG2 LYS 138 11.279 11.133 5.239 1072 HD2 LYS 138 HD3 LYS 138 12.892 9.707 4.427 1073 HD3 LYS 138 HD2 LYS 138 12.768 10.871 3.106 1074 HE2 LYS 138 HE3 LYS 138 14.886 10.667 5.228 1075 HE3 LYS 138 HE2 LYS 138 15.077 10.569 3.478 1076 HZ1 LYS 138 HZ1 LYS 138 14.282 12.944 3.435 1077 HZ2 LYS 138 HZ2 LYS 138 15.816 12.694 4.100 1078 HZ3 LYS 138 HZ3 LYS 138 14.490 12.967 5.114 1079 H VAL 139 H VAL 139 8.891 12.229 6.121 1080 HA VAL 139 HA VAL 139 9.174 14.097 8.328 1081 HB VAL 139 HB VAL 139 7.580 11.578 8.554 1082 HG11 VAL 139 HG11 VAL 139 7.961 13.587 10.266 1083 HG12 VAL 139 HG12 VAL 139 6.454 12.675 10.188 1084 HG13 VAL 139 HG13 VAL 139 6.581 14.238 9.381 1085 HG21 VAL 139 HG21 VAL 139 6.710 12.138 6.504 1086 HG22 VAL 139 HG22 VAL 139 6.996 13.863 6.729 1087 HG23 VAL 139 HG23 VAL 139 5.664 13.072 7.573 1088 H SER 140 H SER 140 10.141 10.855 7.437 1089 HA SER 140 HA SER 140 12.098 10.808 9.535 1090 HB2 SER 140 HB3 SER 140 9.537 9.383 9.882 1091 HB3 SER 140 HB2 SER 140 10.978 8.420 10.205 1092 HG SER 140 HG SER 140 10.417 10.958 11.347 1093 H SER 141 H SER 141 13.366 8.752 9.516 1094 HA SER 141 HA SER 141 13.120 7.037 7.224 1095 HB2 SER 141 HB3 SER 141 14.173 8.981 6.167 1096 HB3 SER 141 HB2 SER 141 15.455 8.959 7.377 1097 HG SER 141 HG SER 141 14.882 6.885 5.523 1098 H ARG 142 H ARG 142 13.763 5.092 7.841 1099 HA ARG 142 HA ARG 142 15.980 4.846 9.749 1100 HB2 ARG 142 HB3 ARG 142 13.805 4.633 10.949 1101 HB3 ARG 142 HB2 ARG 142 13.407 3.266 9.917 1102 HG2 ARG 142 HG3 ARG 142 14.681 1.855 11.091 1103 HG3 ARG 142 HG2 ARG 142 15.993 3.022 11.256 1104 HD2 ARG 142 HD3 ARG 142 14.666 4.180 13.008 1105 HD3 ARG 142 HD2 ARG 142 13.464 2.895 12.894 1106 HE ARG 142 HE ARG 142 15.748 1.543 13.382 1107 HH11 ARG 142 HH11 ARG 142 14.221 4.261 14.950 1108 HH12 ARG 142 HH12 ARG 142 14.848 3.871 16.516 1109 HH21 ARG 142 HH21 ARG 142 16.573 1.027 15.441 1110 HH22 ARG 142 HH22 ARG 142 16.184 2.035 16.795 1111 H THR 143 H THR 143 17.438 3.324 9.208 1112 HA THR 143 HA THR 143 16.813 1.640 6.887 1113 HB THR 143 HB THR 143 19.553 2.167 8.029 1114 HG1 THR 143 HG1 THR 143 18.983 4.161 7.469 1115 HG21 THR 143 HG21 THR 143 20.326 0.958 6.353 1116 HG22 THR 143 HG22 THR 143 19.427 1.928 5.186 1117 HG23 THR 143 HG23 THR 143 18.667 0.525 5.939 1118 H VAL 144 H VAL 144 16.028 -0.266 7.530 1119 HA VAL 144 HA VAL 144 17.215 -1.614 9.843 1120 HB VAL 144 HB VAL 144 14.809 -2.475 8.233 1121 HG11 VAL 144 HG11 VAL 144 15.262 -4.357 9.395 1122 HG12 VAL 144 HG12 VAL 144 14.452 -3.489 10.698 1123 HG13 VAL 144 HG13 VAL 144 16.213 -3.507 10.612 1124 HG21 VAL 144 HG21 VAL 144 15.096 -0.507 10.434 1125 HG22 VAL 144 HG22 VAL 144 13.707 -1.592 10.487 1126 HG23 VAL 144 HG23 VAL 144 13.955 -0.547 9.089 1127 H GLU 145 H GLU 145 18.559 -3.302 9.628 1128 HA GLU 145 HA GLU 145 18.756 -4.579 6.980 1129 HB2 GLU 145 HB3 GLU 145 21.219 -4.931 7.625 1130 HB3 GLU 145 HB2 GLU 145 20.726 -3.324 7.110 1131 HG2 GLU 145 HG3 GLU 145 21.140 -2.408 9.110 1132 HG3 GLU 145 HG2 GLU 145 20.548 -3.813 9.995 1133 H ASP 146 H ASP 146 19.127 -6.766 6.904 1134 HA ASP 146 HA ASP 146 18.811 -8.200 9.459 1135 HB2 ASP 146 HB3 ASP 146 17.622 -8.601 6.760 1136 HB3 ASP 146 HB2 ASP 146 18.014 -10.045 7.688 1137 H THR 147 H THR 147 19.469 -10.713 8.842 1138 HA THR 147 HA THR 147 22.265 -10.710 8.798 1139 HB THR 147 HB THR 147 21.767 -13.248 8.099 1140 HG1 THR 147 HG1 THR 147 19.688 -13.407 7.793 1141 HG21 THR 147 HG21 THR 147 22.669 -12.654 10.254 1142 HG22 THR 147 HG22 THR 147 21.339 -13.795 10.448 1143 HG23 THR 147 HG23 THR 147 21.088 -12.083 10.787 1144 H ASN 148 H ASN 148 19.919 -11.387 6.238 1145 HA ASN 148 HA ASN 148 21.959 -11.867 4.268 1146 HB2 ASN 148 HB3 ASN 148 19.348 -12.600 4.453 1147 HB3 ASN 148 HB2 ASN 148 19.227 -11.241 3.340 1148 HD21 ASN 148 HD21 ASN 148 19.648 -14.492 3.544 1149 HD22 ASN 148 HD22 ASN 148 20.388 -14.783 2.010 1150 HA PRO 149 HA PRO 149 22.764 -7.602 3.273 1151 HB2 PRO 149 HB3 PRO 149 23.399 -8.657 0.575 1152 HB3 PRO 149 HB2 PRO 149 24.403 -7.709 1.677 1153 HG2 PRO 149 HG3 PRO 149 24.869 -10.307 1.292 1154 HG3 PRO 149 HG2 PRO 149 25.056 -9.565 2.890 1155 HD2 PRO 149 HD3 PRO 149 22.833 -11.266 1.843 1156 HD3 PRO 149 HD2 PRO 149 23.585 -11.254 3.452 1157 H ALA 150 H ALA 150 20.883 -9.687 1.169 1158 HA ALA 150 HA ALA 150 19.694 -7.495 -0.278 1159 HB1 ALA 150 HB1 ALA 150 18.905 -9.052 -1.705 1160 HB2 ALA 150 HB2 ALA 150 18.422 -10.150 -0.413 1161 HB3 ALA 150 HB3 ALA 150 20.110 -10.073 -0.920 1162 H LEU 151 H LEU 151 19.082 -9.040 2.698 1163 HA LEU 151 HA LEU 151 16.236 -8.469 2.677 1164 HB2 LEU 151 HB3 LEU 151 18.094 -9.767 4.640 1165 HB3 LEU 151 HB2 LEU 151 16.482 -9.277 5.123 1166 HG LEU 151 HG LEU 151 17.252 -11.365 3.097 1167 HD11 LEU 151 HD11 LEU 151 15.213 -11.833 5.168 1168 HD12 LEU 151 HD12 LEU 151 16.861 -11.597 5.751 1169 HD13 LEU 151 HD13 LEU 151 16.511 -12.878 4.591 1170 HD21 LEU 151 HD21 LEU 151 14.765 -11.615 2.763 1171 HD22 LEU 151 HD22 LEU 151 15.498 -10.194 2.019 1172 HD23 LEU 151 HD23 LEU 151 14.588 -10.033 3.521 1173 H THR 152 H THR 152 18.616 -6.426 2.787 1174 HA THR 152 HA THR 152 17.950 -4.991 5.222 1175 HB THR 152 HB THR 152 19.788 -4.141 2.978 1176 HG1 THR 152 HG1 THR 152 21.430 -5.053 4.190 1177 HG21 THR 152 HG21 THR 152 19.300 -3.126 5.732 1178 HG22 THR 152 HG22 THR 152 19.561 -2.239 4.230 1179 HG23 THR 152 HG23 THR 152 20.918 -3.023 5.039 1180 H HIS 153 H HIS 153 16.333 -3.582 5.324 1181 HA HIS 153 HA HIS 153 15.463 -2.267 2.833 1182 HB2 HIS 153 HB3 HIS 153 13.485 -2.542 5.017 1183 HB3 HIS 153 HB2 HIS 153 13.269 -2.679 3.276 1184 HD1 HIS 153 HD1 HIS 153 12.550 -4.672 5.889 1185 HD2 HIS 153 HD2 HIS 153 15.106 -5.283 2.671 1186 HE1 HIS 153 HE1 HIS 153 12.792 -7.166 5.685 1187 HE2 HIS 153 HE2 HIS 153 14.264 -7.514 3.672 1188 H THR 154 H THR 154 14.243 -0.212 3.229 1189 HA THR 154 HA THR 154 15.203 1.220 5.606 1190 HB THR 154 HB THR 154 15.301 2.335 2.797 1191 HG1 THR 154 HG1 THR 154 17.432 1.484 4.462 1192 HG21 THR 154 HG21 THR 154 16.986 3.637 4.720 1193 HG22 THR 154 HG22 THR 154 15.301 3.678 5.237 1194 HG23 THR 154 HG23 THR 154 15.755 4.318 3.657 1195 H TYR 155 H TYR 155 13.530 2.055 6.648 1196 HA TYR 155 HA TYR 155 11.014 2.492 5.241 1197 HB2 TYR 155 HB3 TYR 155 11.823 2.213 8.102 1198 HB3 TYR 155 HB2 TYR 155 10.347 3.097 7.735 1199 HD1 TYR 155 HD1 TYR 155 8.537 1.916 6.407 1200 HD2 TYR 155 HD2 TYR 155 11.851 -0.138 8.112 1201 HE1 TYR 155 HE1 TYR 155 7.299 -0.208 6.246 1202 HE2 TYR 155 HE2 TYR 155 10.628 -2.264 7.948 1203 HH TYR 155 HH TYR 155 7.451 -2.536 7.594 1204 H GLU 156 H GLU 156 10.292 4.444 4.663 1205 HA GLU 156 HA GLU 156 11.516 6.814 5.912 1206 HB2 GLU 156 HB3 GLU 156 11.028 6.346 2.969 1207 HB3 GLU 156 HB2 GLU 156 11.389 7.923 3.655 1208 HG2 GLU 156 HG3 GLU 156 13.571 7.453 3.946 1209 HG3 GLU 156 HG2 GLU 156 13.268 5.760 4.336 1210 H VAL 157 H VAL 157 10.196 8.542 6.277 1211 HA VAL 157 HA VAL 157 7.336 8.130 5.716 1212 HB VAL 157 HB VAL 157 8.440 9.902 7.890 1213 HG11 VAL 157 HG11 VAL 157 6.079 9.293 8.800 1214 HG12 VAL 157 HG12 VAL 157 5.738 8.877 7.120 1215 HG13 VAL 157 HG13 VAL 157 6.239 10.515 7.539 1216 HG21 VAL 157 HG21 VAL 157 9.202 7.587 8.255 1217 HG22 VAL 157 HG22 VAL 157 7.528 7.039 8.169 1218 HG23 VAL 157 HG23 VAL 157 8.039 8.109 9.474 1219 H TRP 158 H TRP 158 6.103 9.860 5.047 1220 HA TRP 158 HA TRP 158 7.425 12.381 4.406 1221 HB2 TRP 158 HB3 TRP 158 6.017 10.818 2.242 1222 HB3 TRP 158 HB2 TRP 158 6.823 12.371 2.068 1223 HD1 TRP 158 HD1 TRP 158 7.708 8.682 2.842 1224 HE1 TRP 158 HE1 TRP 158 10.105 8.250 2.010 1225 HE3 TRP 158 HE3 TRP 158 8.918 13.422 1.357 1226 HZ2 TRP 158 HZ2 TRP 158 12.228 9.724 0.873 1227 HZ3 TRP 158 HZ3 TRP 158 11.151 13.827 0.408 1228 HH2 TRP 158 HH2 TRP 158 12.771 12.015 0.172 1229 H GLN 159 H GLN 159 6.123 14.116 4.464 1230 HA GLN 159 HA GLN 159 3.219 13.717 4.452 1231 HB2 GLN 159 HB3 GLN 159 4.873 14.674 6.711 1232 HB3 GLN 159 HB2 GLN 159 3.428 15.618 6.374 1233 HG2 GLN 159 HG3 GLN 159 2.315 13.220 6.331 1234 HG3 GLN 159 HG2 GLN 159 3.694 12.836 7.360 1235 HE21 GLN 159 HE21 GLN 159 3.997 14.162 9.277 1236 HE22 GLN 159 HE22 GLN 159 2.610 14.805 10.081 1237 H LYS 160 H LYS 160 2.196 15.204 3.234 1238 HA LYS 160 HA LYS 160 3.576 17.052 1.680 1239 HB2 LYS 160 HB3 LYS 160 1.333 16.118 1.160 1240 HB3 LYS 160 HB2 LYS 160 0.648 17.129 2.425 1241 HG2 LYS 160 HG3 LYS 160 2.090 18.884 0.818 1242 HG3 LYS 160 HG2 LYS 160 1.297 17.781 -0.307 1243 HD2 LYS 160 HD3 LYS 160 -0.799 18.465 0.285 1244 HD3 LYS 160 HD2 LYS 160 -0.321 18.862 1.937 1245 HE2 LYS 160 HE3 LYS 160 -0.369 20.996 1.283 1246 HE3 LYS 160 HE2 LYS 160 1.126 20.647 0.416 1247 HZ1 LYS 160 HZ1 LYS 160 -1.619 20.471 -0.706 1248 HZ2 LYS 160 HZ2 LYS 160 -0.197 20.098 -1.542 1249 HZ3 LYS 160 HZ3 LYS 160 -0.487 21.685 -1.034 1250 H LYS 161 H LYS 161 3.843 19.261 1.757 1251 HA LYS 161 HA LYS 161 4.191 20.413 4.317 1252 HB2 LYS 161 HB3 LYS 161 4.397 21.393 1.503 1253 HB3 LYS 161 HB2 LYS 161 4.363 22.576 2.803 1254 HG2 LYS 161 HG3 LYS 161 6.374 21.843 3.697 1255 HG3 LYS 161 HG2 LYS 161 6.274 20.277 2.890 1256 HD2 LYS 161 HD3 LYS 161 6.693 21.314 0.746 1257 HD3 LYS 161 HD2 LYS 161 6.668 22.918 1.483 1258 HE2 LYS 161 HE3 LYS 161 8.589 22.087 2.943 1259 HE3 LYS 161 HE2 LYS 161 8.706 20.734 1.818 1260 HZ1 LYS 161 HZ1 LYS 161 9.290 22.148 0.073 1261 HZ2 LYS 161 HZ2 LYS 161 10.176 22.738 1.387 1262 HZ3 LYS 161 HZ3 LYS 161 8.774 23.540 0.886 1263 H ALA 162 H ALA 162 2.851 21.539 5.576 1264 HA ALA 162 HA ALA 162 0.968 22.550 6.358 1265 HB1 ALA 162 HB1 ALA 162 1.744 24.033 4.269 1266 HB2 ALA 162 HB2 ALA 162 0.316 24.403 5.235 1267 HB3 ALA 162 HB3 ALA 162 0.146 23.549 3.701 1268 H51A NDP 170 H51A NDP 170 -5.406 -0.570 -9.401 1269 H52A NDP 170 H52A NDP 170 -5.777 -2.163 -8.729 1270 H4B NDP 170 H4B NDP 170 -7.147 -2.639 -10.799 1271 H3B NDP 170 H3B NDP 170 -6.451 0.224 -11.477 1272 HO3A NDP 170 HO3A NDP 170 -5.474 -1.500 -12.664 1273 H2B NDP 170 H2B NDP 170 -8.669 0.454 -12.358 1274 H1B NDP 170 H1B NDP 170 -9.945 -0.734 -10.228 1275 H8A NDP 170 H8A NDP 170 -6.821 1.159 -9.183 1276 H61A NDP 170 H61A NDP 170 -10.608 6.015 -8.415 1277 H62A NDP 170 H62A NDP 170 -8.960 5.449 -8.278 1278 H2A NDP 170 H2A NDP 170 -12.967 2.700 -10.300 1279 H51N NDP 170 H51N NDP 170 -1.539 -4.746 -8.005 1280 H52N NDP 170 H52N NDP 170 -0.863 -3.842 -9.371 1281 H4D NDP 170 H4D NDP 170 0.818 -5.675 -9.700 1282 H3D NDP 170 H3D NDP 170 -0.482 -6.874 -7.243 1283 HO3N NDP 170 HO3N NDP 170 -0.259 -8.703 -8.493 1284 H2D NDP 170 H2D NDP 170 1.701 -7.631 -6.603 1285 HO2N NDP 170 HO2N NDP 170 3.012 -8.243 -8.111 1286 H1D NDP 170 H1D NDP 170 2.996 -5.256 -7.193 1287 H2N NDP 170 H2N NDP 170 3.500 -5.219 -4.806 1288 H71N NDP 170 H71N NDP 170 5.275 -4.700 -2.170 1289 H72N NDP 170 H72N NDP 170 4.825 -5.380 -3.713 1290 H41N NDP 170 H41N NDP 170 0.521 -3.543 -2.753 1291 H42N NDP 170 H42N NDP 170 0.351 -5.291 -2.372 1292 H5N NDP 170 H5N NDP 170 -1.361 -4.555 -4.025 1293 H6N NDP 170 H6N NDP 170 -0.592 -5.133 -6.333 Start of MODEL 13 1 H1 THR 1 HT1 THR 1 -6.281 9.153 5.367 2 H2 THR 1 HT2 THR 1 -4.774 9.625 6.042 3 H3 THR 1 HT3 THR 1 -5.217 7.967 5.998 4 HA THR 1 HA THR 1 -5.112 7.929 3.660 5 HB THR 1 HB THR 1 -4.110 10.134 2.643 6 HG1 THR 1 HG1 THR 1 -5.512 11.144 4.889 7 HG21 THR 1 HG21 THR 1 -6.072 10.213 1.642 8 HG22 THR 1 HG22 THR 1 -6.793 10.924 3.086 9 HG23 THR 1 HG23 THR 1 -6.754 9.171 2.891 10 H ALA 2 H ALA 2 -3.479 6.504 4.234 11 HA ALA 2 HA ALA 2 -0.783 7.676 4.280 12 HB1 ALA 2 HB1 ALA 2 -1.230 7.075 6.553 13 HB2 ALA 2 HB2 ALA 2 -0.105 5.892 5.885 14 HB3 ALA 2 HB3 ALA 2 -1.811 5.481 6.070 15 H PHE 3 H PHE 3 0.868 6.381 3.384 16 HA PHE 3 HA PHE 3 -0.125 4.220 1.639 17 HB2 PHE 3 HB3 PHE 3 1.796 6.447 1.204 18 HB3 PHE 3 HB2 PHE 3 2.172 4.908 0.439 19 HD1 PHE 3 HD1 PHE 3 -1.153 6.471 1.000 20 HD2 PHE 3 HD2 PHE 3 1.819 5.307 -1.814 21 HE1 PHE 3 HE1 PHE 3 -2.687 7.021 -0.844 22 HE2 PHE 3 HE2 PHE 3 0.292 5.854 -3.662 23 HZ PHE 3 HZ PHE 3 -1.963 6.713 -3.179 24 H LEU 4 H LEU 4 0.755 2.232 1.874 25 HA LEU 4 HA LEU 4 3.379 1.983 3.132 26 HB2 LEU 4 HB3 LEU 4 1.907 1.788 5.001 27 HB3 LEU 4 HB2 LEU 4 0.853 0.689 4.131 28 HG LEU 4 HG LEU 4 2.761 -0.961 4.101 29 HD11 LEU 4 HD11 LEU 4 4.710 0.182 4.507 30 HD12 LEU 4 HD12 LEU 4 4.359 -0.461 6.111 31 HD13 LEU 4 HD13 LEU 4 3.976 1.218 5.731 32 HD21 LEU 4 HD21 LEU 4 2.164 -0.389 6.943 33 HD22 LEU 4 HD22 LEU 4 2.009 -1.890 6.029 34 HD23 LEU 4 HD23 LEU 4 0.792 -0.624 5.859 35 H TRP 5 H TRP 5 4.550 0.848 1.729 36 HA TRP 5 HA TRP 5 3.683 -1.748 0.885 37 HB2 TRP 5 HB3 TRP 5 3.440 -1.445 -1.406 38 HB3 TRP 5 HB2 TRP 5 2.662 -0.007 -0.757 39 HD1 TRP 5 HD1 TRP 5 5.701 -1.124 -2.765 40 HE1 TRP 5 HE1 TRP 5 6.813 0.946 -3.813 41 HE3 TRP 5 HE3 TRP 5 3.020 2.523 -0.394 42 HZ2 TRP 5 HZ2 TRP 5 6.587 3.755 -3.653 43 HZ3 TRP 5 HZ3 TRP 5 3.529 4.879 -0.902 44 HH2 TRP 5 HH2 TRP 5 5.275 5.479 -2.497 45 H ALA 6 H ALA 6 5.370 -2.944 -0.241 46 HA ALA 6 HA ALA 6 8.031 -1.965 0.519 47 HB1 ALA 6 HB1 ALA 6 8.687 -4.385 0.130 48 HB2 ALA 6 HB2 ALA 6 6.963 -4.725 -0.025 49 HB3 ALA 6 HB3 ALA 6 7.602 -4.077 1.486 50 H GLN 7 H GLN 7 9.738 -1.886 -0.960 51 HA GLN 7 HA GLN 7 9.242 -2.658 -3.714 52 HB2 GLN 7 HB3 GLN 7 9.801 -0.397 -4.579 53 HB3 GLN 7 HB2 GLN 7 8.279 -0.452 -3.698 54 HG2 GLN 7 HG3 GLN 7 10.319 0.168 -1.839 55 HG3 GLN 7 HG2 GLN 7 10.547 1.200 -3.249 56 HE21 GLN 7 HE21 GLN 7 8.166 0.146 -0.868 57 HE22 GLN 7 HE22 GLN 7 7.220 1.590 -0.910 58 H ASP 8 H ASP 8 11.100 -2.714 -5.029 59 HA ASP 8 HA ASP 8 13.568 -3.047 -3.525 60 HB2 ASP 8 HB3 ASP 8 14.420 -4.163 -5.491 61 HB3 ASP 8 HB2 ASP 8 12.800 -4.769 -5.171 62 H ARG 9 H ARG 9 15.472 -2.488 -5.483 63 HA ARG 9 HA ARG 9 15.737 0.326 -5.194 64 HB2 ARG 9 HB3 ARG 9 17.281 -1.593 -6.948 65 HB3 ARG 9 HB2 ARG 9 17.756 0.061 -6.590 66 HG2 ARG 9 HG3 ARG 9 17.253 -1.605 -4.230 67 HG3 ARG 9 HG2 ARG 9 18.609 -2.123 -5.234 68 HD2 ARG 9 HD3 ARG 9 18.194 0.589 -3.988 69 HD3 ARG 9 HD2 ARG 9 19.417 -0.605 -3.555 70 HE ARG 9 HE ARG 9 19.556 1.294 -5.672 71 HH11 ARG 9 HH11 ARG 9 20.535 -1.925 -4.747 72 HH12 ARG 9 HH12 ARG 9 21.920 -1.938 -5.786 73 HH21 ARG 9 HH21 ARG 9 21.377 1.280 -7.040 74 HH22 ARG 9 HH22 ARG 9 22.399 -0.118 -7.087 75 H ASP 10 H ASP 10 14.519 -1.752 -7.706 76 HA ASP 10 HA ASP 10 14.449 0.334 -9.707 77 HB2 ASP 10 HB3 ASP 10 14.675 -2.302 -9.974 78 HB3 ASP 10 HB2 ASP 10 12.918 -2.202 -10.036 79 H GLY 11 H GLY 11 12.684 -0.116 -7.027 80 HA2 GLY 11 HA3 GLY 11 10.742 1.012 -6.399 81 HA3 GLY 11 HA2 GLY 11 10.449 1.390 -8.089 82 H LEU 12 H LEU 12 11.078 -1.840 -7.966 83 HA LEU 12 HA LEU 12 8.630 -2.751 -8.771 84 HB2 LEU 12 HB3 LEU 12 10.916 -3.950 -8.591 85 HB3 LEU 12 HB2 LEU 12 10.386 -4.412 -6.987 86 HG LEU 12 HG LEU 12 8.545 -5.686 -7.883 87 HD11 LEU 12 HD11 LEU 12 9.061 -4.069 -10.254 88 HD12 LEU 12 HD12 LEU 12 7.591 -4.899 -9.742 89 HD13 LEU 12 HD13 LEU 12 8.844 -5.783 -10.613 90 HD21 LEU 12 HD21 LEU 12 11.265 -6.236 -8.373 91 HD22 LEU 12 HD22 LEU 12 10.372 -6.764 -9.801 92 HD23 LEU 12 HD23 LEU 12 9.934 -7.381 -8.208 93 H ILE 13 H ILE 13 7.260 -4.393 -7.524 94 HA ILE 13 HA ILE 13 6.933 -3.846 -4.708 95 HB ILE 13 HB ILE 13 4.611 -3.202 -4.805 96 HG12 ILE 13 HG13 ILE 13 4.508 -2.564 -7.667 97 HG13 ILE 13 HG12 ILE 13 4.574 -4.290 -7.340 98 HG21 ILE 13 HG21 ILE 13 6.310 -1.445 -6.566 99 HG22 ILE 13 HG22 ILE 13 6.252 -1.421 -4.803 100 HG23 ILE 13 HG23 ILE 13 4.833 -0.952 -5.739 101 HD11 ILE 13 HD11 ILE 13 2.287 -3.525 -7.507 102 HD12 ILE 13 HD12 ILE 13 2.569 -2.357 -6.215 103 HD13 ILE 13 HD13 ILE 13 2.639 -4.086 -5.874 104 H GLY 14 H GLY 14 5.953 -5.532 -7.628 105 HA2 GLY 14 HA3 GLY 14 5.543 -7.929 -6.023 106 HA3 GLY 14 HA2 GLY 14 4.183 -7.380 -6.988 107 H LYS 15 H LYS 15 4.843 -9.772 -7.569 108 HA LYS 15 HA LYS 15 6.336 -9.602 -10.094 109 HB2 LYS 15 HB3 LYS 15 7.279 -11.820 -9.701 110 HB3 LYS 15 HB2 LYS 15 7.749 -10.720 -8.412 111 HG2 LYS 15 HG3 LYS 15 6.621 -11.867 -6.837 112 HG3 LYS 15 HG2 LYS 15 5.295 -12.272 -7.928 113 HD2 LYS 15 HD3 LYS 15 7.190 -13.764 -9.047 114 HD3 LYS 15 HD2 LYS 15 7.840 -13.709 -7.407 115 HE2 LYS 15 HE3 LYS 15 4.996 -14.224 -7.396 116 HE3 LYS 15 HE2 LYS 15 5.856 -15.411 -8.376 117 HZ1 LYS 15 HZ1 LYS 15 5.712 -16.139 -6.094 118 HZ2 LYS 15 HZ2 LYS 15 6.453 -14.719 -5.550 119 HZ3 LYS 15 HZ3 LYS 15 7.327 -15.823 -6.487 120 H ASP 16 H ASP 16 3.690 -9.238 -10.107 121 HA ASP 16 HA ASP 16 1.860 -9.957 -11.286 122 HB2 ASP 16 HB3 ASP 16 3.775 -11.624 -12.291 123 HB3 ASP 16 HB2 ASP 16 2.669 -12.782 -11.559 124 H GLY 17 H GLY 17 1.693 -9.773 -8.663 125 HA2 GLY 17 HA3 GLY 17 -0.496 -11.029 -7.796 126 HA3 GLY 17 HA2 GLY 17 0.732 -12.251 -7.489 127 H HIS 18 H HIS 18 2.857 -10.744 -6.645 128 HA HIS 18 HA HIS 18 2.258 -8.750 -4.751 129 HB2 HIS 18 HB3 HIS 18 2.479 -9.981 -2.666 130 HB3 HIS 18 HB2 HIS 18 1.136 -10.636 -3.595 131 HD1 HIS 18 HD1 HIS 18 2.355 -12.383 -1.453 132 HD2 HIS 18 HD2 HIS 18 3.679 -12.367 -5.392 133 HE1 HIS 18 HE1 HIS 18 3.496 -14.599 -1.788 134 HE2 HIS 18 HE2 HIS 18 4.213 -14.601 -4.203 135 H LEU 19 H LEU 19 4.187 -8.953 -2.911 136 HA LEU 19 HA LEU 19 6.536 -8.412 -4.373 137 HB2 LEU 19 HB3 LEU 19 7.632 -8.348 -2.122 138 HB3 LEU 19 HB2 LEU 19 6.240 -7.298 -2.306 139 HG LEU 19 HG LEU 19 4.956 -9.331 -1.226 140 HD11 LEU 19 HD11 LEU 19 6.266 -11.021 -0.631 141 HD12 LEU 19 HD12 LEU 19 6.961 -9.960 0.594 142 HD13 LEU 19 HD13 LEU 19 7.727 -10.101 -0.988 143 HD21 LEU 19 HD21 LEU 19 6.646 -7.824 0.701 144 HD22 LEU 19 HD22 LEU 19 4.908 -8.123 0.712 145 HD23 LEU 19 HD23 LEU 19 5.587 -6.913 -0.377 146 HA PRO 20 HA PRO 20 8.066 -12.599 -4.612 147 HB2 PRO 20 HB3 PRO 20 10.212 -12.135 -6.119 148 HB3 PRO 20 HB2 PRO 20 8.582 -11.927 -6.768 149 HG2 PRO 20 HG3 PRO 20 10.526 -9.865 -5.830 150 HG3 PRO 20 HG2 PRO 20 9.414 -9.813 -7.208 151 HD2 PRO 20 HD3 PRO 20 8.965 -8.645 -4.717 152 HD3 PRO 20 HD2 PRO 20 7.720 -8.992 -5.933 153 H TRP 21 H TRP 21 9.173 -10.400 -2.502 154 HA TRP 21 HA TRP 21 11.626 -11.916 -1.896 155 HB2 TRP 21 HB3 TRP 21 12.222 -9.863 -0.511 156 HB3 TRP 21 HB2 TRP 21 12.249 -9.664 -2.260 157 HD1 TRP 21 HD1 TRP 21 9.775 -9.004 0.658 158 HE1 TRP 21 HE1 TRP 21 8.479 -6.848 0.120 159 HE3 TRP 21 HE3 TRP 21 11.735 -8.016 -3.956 160 HZ2 TRP 21 HZ2 TRP 21 8.305 -4.978 -1.991 161 HZ3 TRP 21 HZ3 TRP 21 10.948 -6.027 -5.172 162 HH2 TRP 21 HH2 TRP 21 9.268 -4.542 -4.208 163 H HIS 22 H HIS 22 11.869 -12.874 0.050 164 HA HIS 22 HA HIS 22 9.509 -13.111 1.707 165 HB2 HIS 22 HB3 HIS 22 11.219 -14.976 1.010 166 HB3 HIS 22 HB2 HIS 22 12.137 -14.379 2.389 167 HD1 HIS 22 HD1 HIS 22 10.789 -17.235 2.194 168 HD2 HIS 22 HD2 HIS 22 9.248 -13.938 4.200 169 HE1 HIS 22 HE1 HIS 22 9.238 -18.173 3.936 170 HE2 HIS 22 HE2 HIS 22 8.383 -16.164 5.193 171 H LEU 23 H LEU 23 9.368 -11.027 2.614 172 HA LEU 23 HA LEU 23 11.536 -10.241 4.425 173 HB2 LEU 23 HB3 LEU 23 9.644 -8.810 2.780 174 HB3 LEU 23 HB2 LEU 23 9.522 -8.280 4.447 175 HG LEU 23 HG LEU 23 12.099 -8.034 4.323 176 HD11 LEU 23 HD11 LEU 23 13.061 -8.577 2.401 177 HD12 LEU 23 HD12 LEU 23 12.191 -7.251 1.630 178 HD13 LEU 23 HD13 LEU 23 11.494 -8.870 1.648 179 HD21 LEU 23 HD21 LEU 23 10.988 -6.052 4.618 180 HD22 LEU 23 HD22 LEU 23 10.001 -6.262 3.171 181 HD23 LEU 23 HD23 LEU 23 11.693 -5.789 3.022 182 HA PRO 24 HA PRO 24 8.627 -12.226 7.390 183 HB2 PRO 24 HB3 PRO 24 10.555 -12.486 9.332 184 HB3 PRO 24 HB2 PRO 24 10.235 -13.691 8.081 185 HG2 PRO 24 HG3 PRO 24 12.350 -11.579 8.183 186 HG3 PRO 24 HG2 PRO 24 12.473 -13.264 7.644 187 HD2 PRO 24 HD3 PRO 24 12.298 -11.235 5.896 188 HD3 PRO 24 HD2 PRO 24 11.529 -12.804 5.579 189 H ASP 25 H ASP 25 10.924 -9.592 7.853 190 HA ASP 25 HA ASP 25 9.763 -8.634 10.266 191 HB2 ASP 25 HB3 ASP 25 11.152 -6.588 9.714 192 HB3 ASP 25 HB2 ASP 25 12.040 -8.093 9.884 193 H ASP 26 H ASP 26 9.306 -7.967 6.850 194 HA ASP 26 HA ASP 26 7.747 -5.612 7.205 195 HB2 ASP 26 HB3 ASP 26 8.992 -6.469 5.089 196 HB3 ASP 26 HB2 ASP 26 7.521 -7.393 4.797 197 H LEU 27 H LEU 27 6.936 -9.025 6.680 198 HA LEU 27 HA LEU 27 4.171 -8.757 6.439 199 HB2 LEU 27 HB3 LEU 27 5.554 -11.059 7.802 200 HB3 LEU 27 HB2 LEU 27 4.020 -11.084 6.954 201 HG LEU 27 HG LEU 27 6.361 -10.277 5.341 202 HD11 LEU 27 HD11 LEU 27 6.142 -13.173 5.489 203 HD12 LEU 27 HD12 LEU 27 6.707 -12.450 6.995 204 HD13 LEU 27 HD13 LEU 27 7.573 -12.142 5.489 205 HD21 LEU 27 HD21 LEU 27 4.446 -10.445 4.084 206 HD22 LEU 27 HD22 LEU 27 3.828 -11.813 5.009 207 HD23 LEU 27 HD23 LEU 27 5.143 -12.049 3.859 208 H HIS 28 H HIS 28 5.948 -9.754 9.368 209 HA HIS 28 HA HIS 28 3.858 -9.683 11.160 210 HB2 HIS 28 HB3 HIS 28 6.788 -9.082 11.550 211 HB3 HIS 28 HB2 HIS 28 5.652 -9.163 12.893 212 HD1 HIS 28 HD1 HIS 28 7.786 -11.141 13.129 213 HD2 HIS 28 HD2 HIS 28 4.417 -11.900 10.819 214 HE1 HIS 28 HE1 HIS 28 7.653 -13.644 12.937 215 HE2 HIS 28 HE2 HIS 28 5.558 -14.083 11.608 216 H TYR 29 H TYR 29 5.744 -7.009 9.900 217 HA TYR 29 HA TYR 29 4.796 -5.067 11.758 218 HB2 TYR 29 HB3 TYR 29 6.824 -5.101 9.966 219 HB3 TYR 29 HB2 TYR 29 5.641 -4.153 9.073 220 HD1 TYR 29 HD1 TYR 29 6.882 -4.329 12.602 221 HD2 TYR 29 HD2 TYR 29 5.898 -1.878 9.267 222 HE1 TYR 29 HE1 TYR 29 7.526 -2.334 13.887 223 HE2 TYR 29 HE2 TYR 29 6.540 0.124 10.542 224 HH TYR 29 HH TYR 29 8.277 0.461 12.689 225 H PHE 30 H PHE 30 3.644 -6.319 8.711 226 HA PHE 30 HA PHE 30 1.785 -4.240 8.162 227 HB2 PHE 30 HB3 PHE 30 2.759 -6.335 6.733 228 HB3 PHE 30 HB2 PHE 30 1.161 -6.944 7.152 229 HD1 PHE 30 HD2 PHE 30 2.917 -4.077 5.590 230 HD2 PHE 30 HD1 PHE 30 -0.727 -6.240 5.980 231 HE1 PHE 30 HE2 PHE 30 1.941 -2.756 3.758 232 HE2 PHE 30 HE1 PHE 30 -1.709 -4.924 4.148 233 HZ PHE 30 HZ PHE 30 -0.375 -3.178 3.035 234 H ARG 31 H ARG 31 1.187 -7.600 9.203 235 HA ARG 31 HA ARG 31 -1.508 -7.210 9.861 236 HB2 ARG 31 HB3 ARG 31 0.102 -9.373 9.667 237 HB3 ARG 31 HB2 ARG 31 -0.021 -9.239 11.415 238 HG2 ARG 31 HG3 ARG 31 -2.095 -10.039 11.427 239 HG3 ARG 31 HG2 ARG 31 -2.600 -8.970 10.117 240 HD2 ARG 31 HD3 ARG 31 -0.940 -11.424 9.620 241 HD3 ARG 31 HD2 ARG 31 -2.700 -11.491 9.697 242 HE ARG 31 HE ARG 31 -2.252 -9.523 7.907 243 HH11 ARG 31 HH11 ARG 31 -1.061 -12.793 8.178 244 HH12 ARG 31 HH12 ARG 31 -0.881 -13.002 6.469 245 HH21 ARG 31 HH21 ARG 31 -2.016 -9.797 5.659 246 HH22 ARG 31 HH22 ARG 31 -1.423 -11.301 5.038 247 H ALA 32 H ALA 32 1.365 -6.382 11.575 248 HA ALA 32 HA ALA 32 0.080 -6.244 14.161 249 HB1 ALA 32 HB1 ALA 32 2.282 -5.195 14.834 250 HB2 ALA 32 HB2 ALA 32 2.824 -5.505 13.185 251 HB3 ALA 32 HB3 ALA 32 2.356 -6.849 14.226 252 H GLN 33 H GLN 33 0.566 -4.139 11.469 253 HA GLN 33 HA GLN 33 -0.058 -1.784 13.101 254 HB2 GLN 33 HB3 GLN 33 1.419 -2.237 10.611 255 HB3 GLN 33 HB2 GLN 33 0.333 -0.856 10.542 256 HG2 GLN 33 HG3 GLN 33 1.870 -0.922 13.000 257 HG3 GLN 33 HG2 GLN 33 2.893 -0.889 11.565 258 HE21 GLN 33 HE21 GLN 33 2.178 0.751 9.890 259 HE22 GLN 33 HE22 GLN 33 1.719 2.306 10.486 260 H THR 34 H THR 34 -1.381 -3.869 10.655 261 HA THR 34 HA THR 34 -3.538 -2.048 10.007 262 HB THR 34 HB THR 34 -4.308 -3.827 8.511 263 HG1 THR 34 HG1 THR 34 -2.130 -5.334 9.517 264 HG21 THR 34 HG21 THR 34 -1.445 -4.019 7.941 265 HG22 THR 34 HG22 THR 34 -2.058 -2.377 8.131 266 HG23 THR 34 HG23 THR 34 -2.775 -3.452 6.931 267 H VAL 35 H VAL 35 -3.211 -3.178 12.789 268 HA VAL 35 HA VAL 35 -5.594 -4.827 13.061 269 HB VAL 35 HB VAL 35 -3.810 -3.810 15.272 270 HG11 VAL 35 HG11 VAL 35 -5.209 -6.384 15.501 271 HG12 VAL 35 HG12 VAL 35 -6.254 -4.964 15.456 272 HG13 VAL 35 HG13 VAL 35 -4.997 -5.096 16.686 273 HG21 VAL 35 HG21 VAL 35 -2.290 -5.023 14.031 274 HG22 VAL 35 HG22 VAL 35 -3.513 -6.141 13.428 275 HG23 VAL 35 HG23 VAL 35 -2.950 -6.265 15.095 276 H GLY 36 H GLY 36 -7.488 -3.813 13.071 277 HA2 GLY 36 HA3 GLY 36 -9.168 -2.495 13.991 278 HA3 GLY 36 HA2 GLY 36 -7.964 -1.713 15.003 279 H LYS 37 H LYS 37 -7.309 -1.888 11.620 280 HA LYS 37 HA LYS 37 -8.173 0.913 11.310 281 HB2 LYS 37 HB3 LYS 37 -5.547 -0.370 10.688 282 HB3 LYS 37 HB2 LYS 37 -6.110 0.941 9.661 283 HG2 LYS 37 HG3 LYS 37 -5.766 2.508 11.240 284 HG3 LYS 37 HG2 LYS 37 -6.251 1.441 12.558 285 HD2 LYS 37 HD3 LYS 37 -4.060 1.414 13.054 286 HD3 LYS 37 HD2 LYS 37 -3.947 0.257 11.726 287 HE2 LYS 37 HE3 LYS 37 -3.827 2.633 10.399 288 HE3 LYS 37 HE2 LYS 37 -3.000 3.027 11.906 289 HZ1 LYS 37 HZ1 LYS 37 -2.183 1.267 9.750 290 HZ2 LYS 37 HZ2 LYS 37 -1.873 0.690 11.309 291 HZ3 LYS 37 HZ3 LYS 37 -1.243 2.181 10.819 292 H ILE 38 H ILE 38 -7.794 1.415 8.748 293 HA ILE 38 HA ILE 38 -9.220 -0.730 7.313 294 HB ILE 38 HB ILE 38 -9.690 1.850 6.107 295 HG12 ILE 38 HG13 ILE 38 -10.936 1.627 8.836 296 HG13 ILE 38 HG12 ILE 38 -9.404 2.462 8.615 297 HG21 ILE 38 HG21 ILE 38 -11.578 0.811 5.576 298 HG22 ILE 38 HG22 ILE 38 -12.008 0.590 7.270 299 HG23 ILE 38 HG23 ILE 38 -10.982 -0.592 6.458 300 HD11 ILE 38 HD11 ILE 38 -10.479 3.964 7.002 301 HD12 ILE 38 HD12 ILE 38 -11.222 4.037 8.600 302 HD13 ILE 38 HD13 ILE 38 -12.015 3.151 7.298 303 H MET 39 H MET 39 -8.275 -1.458 5.531 304 HA MET 39 HA MET 39 -6.081 0.133 4.374 305 HB2 MET 39 HB3 MET 39 -5.242 -1.911 5.322 306 HB3 MET 39 HB2 MET 39 -6.481 -2.857 4.513 307 HG2 MET 39 HG3 MET 39 -5.316 -1.770 2.370 308 HG3 MET 39 HG2 MET 39 -3.946 -1.752 3.476 309 HE1 MET 39 HE1 MET 39 -6.275 -5.535 2.268 310 HE2 MET 39 HE2 MET 39 -6.852 -3.873 2.144 311 HE3 MET 39 HE3 MET 39 -6.741 -4.653 3.722 312 H VAL 40 H VAL 40 -6.280 0.816 2.349 313 HA VAL 40 HA VAL 40 -8.600 0.004 0.794 314 HB VAL 40 HB VAL 40 -6.499 2.033 0.036 315 HG11 VAL 40 HG11 VAL 40 -8.418 0.950 -1.518 316 HG12 VAL 40 HG12 VAL 40 -7.806 2.592 -1.714 317 HG13 VAL 40 HG13 VAL 40 -9.302 2.309 -0.824 318 HG21 VAL 40 HG21 VAL 40 -9.131 2.661 1.346 319 HG22 VAL 40 HG22 VAL 40 -7.761 3.735 1.066 320 HG23 VAL 40 HG23 VAL 40 -7.643 2.451 2.269 321 H VAL 41 H VAL 41 -8.470 -1.659 -0.556 322 HA VAL 41 HA VAL 41 -5.869 -2.256 -1.797 323 HB VAL 41 HB VAL 41 -7.124 -3.934 -0.180 324 HG11 VAL 41 HG11 VAL 41 -8.334 -4.642 -2.850 325 HG12 VAL 41 HG12 VAL 41 -9.209 -3.967 -1.476 326 HG13 VAL 41 HG13 VAL 41 -8.476 -5.565 -1.355 327 HG21 VAL 41 HG21 VAL 41 -5.368 -5.135 -0.784 328 HG22 VAL 41 HG22 VAL 41 -5.190 -4.155 -2.240 329 HG23 VAL 41 HG23 VAL 41 -6.190 -5.608 -2.271 330 H GLY 42 H GLY 42 -5.744 -2.642 -3.987 331 HA2 GLY 42 HA3 GLY 42 -7.865 -1.494 -5.572 332 HA3 GLY 42 HA2 GLY 42 -6.312 -2.063 -6.162 333 H ARG 43 H ARG 43 -8.279 -2.631 -7.774 334 HA ARG 43 HA ARG 43 -9.843 -4.885 -7.277 335 HB2 ARG 43 HB3 ARG 43 -10.235 -3.398 -9.174 336 HB3 ARG 43 HB2 ARG 43 -8.720 -3.911 -9.905 337 HG2 ARG 43 HG3 ARG 43 -9.875 -6.299 -9.655 338 HG3 ARG 43 HG2 ARG 43 -11.326 -5.302 -9.759 339 HD2 ARG 43 HD3 ARG 43 -9.051 -5.338 -11.740 340 HD3 ARG 43 HD2 ARG 43 -10.627 -6.097 -11.961 341 HE ARG 43 HE ARG 43 -10.722 -3.264 -11.427 342 HH11 ARG 43 HH11 ARG 43 -10.522 -5.735 -13.886 343 HH12 ARG 43 HH12 ARG 43 -11.146 -4.714 -15.137 344 HH21 ARG 43 HH21 ARG 43 -11.539 -1.923 -13.072 345 HH22 ARG 43 HH22 ARG 43 -11.723 -2.550 -14.676 346 H ARG 44 H ARG 44 -6.863 -4.756 -9.228 347 HA ARG 44 HA ARG 44 -6.540 -7.526 -9.455 348 HB2 ARG 44 HB3 ARG 44 -5.114 -5.176 -10.224 349 HB3 ARG 44 HB2 ARG 44 -3.973 -6.293 -9.488 350 HG2 ARG 44 HG3 ARG 44 -3.945 -6.795 -11.772 351 HG3 ARG 44 HG2 ARG 44 -4.930 -8.061 -11.036 352 HD2 ARG 44 HD3 ARG 44 -6.174 -7.456 -12.897 353 HD3 ARG 44 HD2 ARG 44 -6.922 -6.519 -11.604 354 HE ARG 44 HE ARG 44 -6.267 -4.616 -12.675 355 HH11 ARG 44 HH11 ARG 44 -4.331 -7.267 -13.861 356 HH12 ARG 44 HH12 ARG 44 -3.553 -6.316 -15.081 357 HH21 ARG 44 HH21 ARG 44 -5.244 -3.365 -14.280 358 HH22 ARG 44 HH22 ARG 44 -4.071 -4.101 -15.319 359 H THR 45 H THR 45 -5.956 -5.440 -6.800 360 HA THR 45 HA THR 45 -3.977 -7.102 -5.541 361 HB THR 45 HB THR 45 -5.578 -5.048 -4.067 362 HG1 THR 45 HG1 THR 45 -5.072 -3.669 -5.558 363 HG21 THR 45 HG21 THR 45 -2.754 -6.026 -3.981 364 HG22 THR 45 HG22 THR 45 -3.948 -5.958 -2.685 365 HG23 THR 45 HG23 THR 45 -3.213 -4.472 -3.286 366 H TYR 46 H TYR 46 -7.431 -6.375 -4.861 367 HA TYR 46 HA TYR 46 -7.731 -7.999 -2.652 368 HB2 TYR 46 HB3 TYR 46 -10.083 -7.976 -3.024 369 HB3 TYR 46 HB2 TYR 46 -9.473 -6.437 -3.612 370 HD1 TYR 46 HD2 TYR 46 -10.132 -9.876 -4.962 371 HD2 TYR 46 HD1 TYR 46 -10.383 -5.672 -5.590 372 HE1 TYR 46 HE2 TYR 46 -11.218 -10.270 -7.117 373 HE2 TYR 46 HE1 TYR 46 -11.486 -6.065 -7.749 374 HH TYR 46 HH TYR 46 -11.383 -8.412 -9.475 375 H GLU 47 H GLU 47 -7.836 -8.905 -6.064 376 HA GLU 47 HA GLU 47 -8.420 -11.668 -5.467 377 HB2 GLU 47 HB3 GLU 47 -8.458 -9.989 -7.777 378 HB3 GLU 47 HB2 GLU 47 -7.433 -11.375 -8.120 379 HG2 GLU 47 HG3 GLU 47 -10.064 -11.867 -6.848 380 HG3 GLU 47 HG2 GLU 47 -10.031 -11.414 -8.551 381 H SER 48 H SER 48 -5.633 -9.697 -5.817 382 HA SER 48 HA SER 48 -3.906 -12.076 -5.984 383 HB2 SER 48 HB3 SER 48 -3.161 -9.189 -6.499 384 HB3 SER 48 HB2 SER 48 -2.136 -10.599 -6.760 385 HG SER 48 HG SER 48 -3.003 -10.732 -8.655 386 H PHE 49 H PHE 49 -5.249 -11.016 -3.544 387 HA PHE 49 HA PHE 49 -2.949 -10.115 -1.977 388 HB2 PHE 49 HB3 PHE 49 -5.510 -9.240 -1.931 389 HB3 PHE 49 HB2 PHE 49 -5.568 -10.441 -0.644 390 HD1 PHE 49 HD1 PHE 49 -3.409 -7.632 -1.812 391 HD2 PHE 49 HD2 PHE 49 -5.054 -9.759 1.485 392 HE1 PHE 49 HE1 PHE 49 -2.389 -6.014 -0.265 393 HE2 PHE 49 HE2 PHE 49 -4.037 -8.146 3.039 394 HZ PHE 49 HZ PHE 49 -2.702 -6.270 2.165 395 HA PRO 50 HA PRO 50 -2.207 -14.232 -0.464 396 HB2 PRO 50 HB3 PRO 50 -1.071 -12.876 1.906 397 HB3 PRO 50 HB2 PRO 50 -0.310 -14.008 0.785 398 HG2 PRO 50 HG3 PRO 50 0.300 -11.406 0.753 399 HG3 PRO 50 HG2 PRO 50 0.208 -12.353 -0.744 400 HD2 PRO 50 HD3 PRO 50 -1.771 -10.425 0.406 401 HD3 PRO 50 HD2 PRO 50 -1.280 -10.667 -1.284 402 H LYS 51 H LYS 51 -3.904 -11.792 1.350 403 HA LYS 51 HA LYS 51 -5.455 -13.876 2.668 404 HB2 LYS 51 HB3 LYS 51 -3.860 -11.779 4.121 405 HB3 LYS 51 HB2 LYS 51 -5.287 -12.509 4.844 406 HG2 LYS 51 HG3 LYS 51 -2.952 -14.109 3.833 407 HG3 LYS 51 HG2 LYS 51 -3.091 -13.531 5.494 408 HD2 LYS 51 HD3 LYS 51 -5.251 -15.162 4.189 409 HD3 LYS 51 HD2 LYS 51 -3.879 -15.913 5.006 410 HE2 LYS 51 HE3 LYS 51 -5.446 -13.809 6.424 411 HE3 LYS 51 HE2 LYS 51 -6.116 -15.434 6.293 412 HZ1 LYS 51 HZ1 LYS 51 -3.740 -14.515 7.747 413 HZ2 LYS 51 HZ2 LYS 51 -3.754 -16.095 7.143 414 HZ3 LYS 51 HZ3 LYS 51 -4.948 -15.597 8.232 415 H ARG 52 H ARG 52 -7.178 -13.230 1.370 416 HA ARG 52 HA ARG 52 -8.284 -10.578 2.012 417 HB2 ARG 52 HB3 ARG 52 -9.458 -10.785 -0.237 418 HB3 ARG 52 HB2 ARG 52 -7.726 -10.486 -0.277 419 HG2 ARG 52 HG3 ARG 52 -7.379 -12.325 -1.459 420 HG3 ARG 52 HG2 ARG 52 -8.228 -13.310 -0.267 421 HD2 ARG 52 HD3 ARG 52 -9.582 -11.704 -2.429 422 HD3 ARG 52 HD2 ARG 52 -9.204 -13.422 -2.551 423 HE ARG 52 HE ARG 52 -10.778 -12.676 -0.245 424 HH11 ARG 52 HH11 ARG 52 -10.832 -13.750 -3.568 425 HH12 ARG 52 HH12 ARG 52 -12.428 -14.413 -3.456 426 HH21 ARG 52 HH21 ARG 52 -12.876 -13.546 -0.101 427 HH22 ARG 52 HH22 ARG 52 -13.588 -14.296 -1.490 428 HA PRO 53 HA PRO 53 -9.621 -9.640 2.822 429 HB2 PRO 53 HB3 PRO 53 -11.319 -9.142 4.814 430 HB3 PRO 53 HB2 PRO 53 -11.878 -9.222 3.140 431 HG2 PRO 53 HG3 PRO 53 -12.147 -11.228 5.326 432 HG3 PRO 53 HG2 PRO 53 -13.280 -10.822 4.026 433 HD2 PRO 53 HD3 PRO 53 -11.504 -12.995 4.059 434 HD3 PRO 53 HD2 PRO 53 -12.377 -12.378 2.644 435 H LEU 54 H LEU 54 -8.542 -8.608 4.589 436 HA LEU 54 HA LEU 54 -6.928 -10.353 6.136 437 HB2 LEU 54 HB3 LEU 54 -7.303 -7.368 6.167 438 HB3 LEU 54 HB2 LEU 54 -6.162 -8.189 7.215 439 HG LEU 54 HG LEU 54 -5.918 -8.814 4.340 440 HD11 LEU 54 HD11 LEU 54 -5.387 -6.789 3.545 441 HD12 LEU 54 HD12 LEU 54 -4.585 -6.303 5.038 442 HD13 LEU 54 HD13 LEU 54 -6.338 -6.184 4.900 443 HD21 LEU 54 HD21 LEU 54 -3.667 -7.854 5.994 444 HD22 LEU 54 HD22 LEU 54 -3.762 -9.221 4.883 445 HD23 LEU 54 HD23 LEU 54 -4.438 -9.355 6.506 446 HA PRO 55 HA PRO 55 -9.697 -10.836 9.593 447 HB2 PRO 55 HB3 PRO 55 -7.409 -11.823 11.119 448 HB3 PRO 55 HB2 PRO 55 -8.842 -12.692 10.568 449 HG2 PRO 55 HG3 PRO 55 -6.384 -13.128 9.528 450 HG3 PRO 55 HG2 PRO 55 -7.871 -13.299 8.577 451 HD2 PRO 55 HD3 PRO 55 -5.909 -11.036 8.639 452 HD3 PRO 55 HD2 PRO 55 -6.740 -11.772 7.253 453 H GLU 56 H GLU 56 -10.086 -10.025 11.660 454 HA GLU 56 HA GLU 56 -10.170 -8.361 13.204 455 HB2 GLU 56 HB3 GLU 56 -7.501 -9.539 13.280 456 HB3 GLU 56 HB2 GLU 56 -7.549 -7.915 13.952 457 HG2 GLU 56 HG3 GLU 56 -7.917 -9.372 15.753 458 HG3 GLU 56 HG2 GLU 56 -9.493 -8.686 15.360 459 H ARG 57 H ARG 57 -9.822 -7.474 10.399 460 HA ARG 57 HA ARG 57 -9.152 -4.731 11.035 461 HB2 ARG 57 HB3 ARG 57 -7.432 -4.403 9.498 462 HB3 ARG 57 HB2 ARG 57 -7.032 -5.946 10.231 463 HG2 ARG 57 HG3 ARG 57 -6.666 -6.391 8.016 464 HG3 ARG 57 HG2 ARG 57 -8.330 -6.937 8.204 465 HD2 ARG 57 HD3 ARG 57 -7.673 -5.431 6.181 466 HD3 ARG 57 HD2 ARG 57 -9.191 -5.157 7.027 467 HE ARG 57 HE ARG 57 -8.384 -3.141 7.780 468 HH11 ARG 57 HH11 ARG 57 -5.777 -4.980 6.365 469 HH12 ARG 57 HH12 ARG 57 -4.660 -3.660 6.403 470 HH21 ARG 57 HH21 ARG 57 -6.913 -1.406 7.836 471 HH22 ARG 57 HH22 ARG 57 -5.301 -1.632 7.248 472 H THR 58 H THR 58 -9.836 -3.208 9.376 473 HA THR 58 HA THR 58 -12.230 -4.170 8.032 474 HB THR 58 HB THR 58 -11.165 -1.349 8.252 475 HG1 THR 58 HG1 THR 58 -11.622 -1.917 10.294 476 HG21 THR 58 HG21 THR 58 -13.487 -0.678 7.869 477 HG22 THR 58 HG22 THR 58 -13.915 -2.365 7.580 478 HG23 THR 58 HG23 THR 58 -12.804 -1.538 6.489 479 H ASN 59 H ASN 59 -12.205 -4.778 5.978 480 HA ASN 59 HA ASN 59 -9.937 -4.046 4.300 481 HB2 ASN 59 HB3 ASN 59 -12.088 -6.134 4.110 482 HB3 ASN 59 HB2 ASN 59 -11.101 -5.726 2.710 483 HD21 ASN 59 HD21 ASN 59 -10.602 -6.338 6.173 484 HD22 ASN 59 HD22 ASN 59 -9.265 -7.409 5.963 485 H VAL 60 H VAL 60 -10.101 -3.088 2.299 486 HA VAL 60 HA VAL 60 -12.703 -2.008 1.492 487 HB VAL 60 HB VAL 60 -10.183 -0.369 1.824 488 HG11 VAL 60 HG11 VAL 60 -12.520 0.018 0.111 489 HG12 VAL 60 HG12 VAL 60 -10.932 0.784 0.057 490 HG13 VAL 60 HG13 VAL 60 -12.167 1.393 1.158 491 HG21 VAL 60 HG21 VAL 60 -12.676 -0.673 3.365 492 HG22 VAL 60 HG22 VAL 60 -12.117 0.982 3.122 493 HG23 VAL 60 HG23 VAL 60 -11.061 -0.200 3.894 494 H VAL 61 H VAL 61 -13.049 -2.476 -0.584 495 HA VAL 61 HA VAL 61 -10.727 -3.061 -2.290 496 HB VAL 61 HB VAL 61 -13.603 -3.939 -2.583 497 HG11 VAL 61 HG11 VAL 61 -11.408 -3.869 -4.483 498 HG12 VAL 61 HG12 VAL 61 -13.122 -4.194 -4.746 499 HG13 VAL 61 HG13 VAL 61 -12.042 -5.498 -4.250 500 HG21 VAL 61 HG21 VAL 61 -12.098 -4.964 -0.770 501 HG22 VAL 61 HG22 VAL 61 -11.230 -5.711 -2.112 502 HG23 VAL 61 HG23 VAL 61 -12.942 -6.058 -1.865 503 H LEU 62 H LEU 62 -10.464 -2.115 -4.261 504 HA LEU 62 HA LEU 62 -12.413 -0.050 -5.033 505 HB2 LEU 62 HB3 LEU 62 -10.253 0.804 -3.953 506 HB3 LEU 62 HB2 LEU 62 -9.446 0.263 -5.413 507 HG LEU 62 HG LEU 62 -11.090 1.751 -6.686 508 HD11 LEU 62 HD11 LEU 62 -12.759 2.512 -5.395 509 HD12 LEU 62 HD12 LEU 62 -11.590 3.744 -4.919 510 HD13 LEU 62 HD13 LEU 62 -11.834 2.321 -3.906 511 HD21 LEU 62 HD21 LEU 62 -8.653 2.217 -6.182 512 HD22 LEU 62 HD22 LEU 62 -9.221 3.226 -4.851 513 HD23 LEU 62 HD23 LEU 62 -9.667 3.622 -6.511 514 H THR 63 H THR 63 -13.353 -1.110 -6.697 515 HA THR 63 HA THR 63 -11.625 -1.790 -8.974 516 HB THR 63 HB THR 63 -12.383 -3.853 -7.838 517 HG1 THR 63 HG1 THR 63 -13.819 -3.687 -10.248 518 HG21 THR 63 HG21 THR 63 -15.053 -2.611 -8.181 519 HG22 THR 63 HG22 THR 63 -14.418 -3.601 -6.866 520 HG23 THR 63 HG23 THR 63 -14.910 -4.357 -8.382 521 H HIS 64 H HIS 64 -12.514 -1.387 -11.033 522 HA HIS 64 HA HIS 64 -14.300 0.812 -11.158 523 HB2 HIS 64 HB3 HIS 64 -13.257 -1.000 -13.341 524 HB3 HIS 64 HB2 HIS 64 -14.162 0.482 -13.626 525 HD1 HIS 64 HD1 HIS 64 -12.823 2.569 -13.808 526 HD2 HIS 64 HD2 HIS 64 -10.704 -0.497 -11.973 527 HE1 HIS 64 HE1 HIS 64 -10.489 3.453 -13.506 528 HE2 HIS 64 HE2 HIS 64 -9.249 1.614 -12.312 529 H GLN 65 H GLN 65 -14.699 -2.641 -11.543 530 HA GLN 65 HA GLN 65 -17.088 -2.847 -12.866 531 HB2 GLN 65 HB3 GLN 65 -15.839 -4.456 -10.673 532 HB3 GLN 65 HB2 GLN 65 -17.466 -4.849 -11.213 533 HG2 GLN 65 HG3 GLN 65 -16.765 -5.570 -13.263 534 HG3 GLN 65 HG2 GLN 65 -15.332 -4.544 -13.257 535 HE21 GLN 65 HE21 GLN 65 -13.637 -5.145 -11.676 536 HE22 GLN 65 HE22 GLN 65 -13.349 -6.826 -11.401 537 H GLU 66 H GLU 66 -19.142 -2.325 -12.486 538 HA GLU 66 HA GLU 66 -19.799 -0.912 -10.049 539 HB2 GLU 66 HB3 GLU 66 -22.056 -0.664 -11.197 540 HB3 GLU 66 HB2 GLU 66 -20.683 0.088 -11.997 541 HG2 GLU 66 HG3 GLU 66 -21.151 -2.643 -12.880 542 HG3 GLU 66 HG2 GLU 66 -22.528 -1.579 -13.159 543 H ASP 67 H ASP 67 -20.543 -3.974 -11.585 544 HA ASP 67 HA ASP 67 -22.395 -4.674 -9.440 545 HB2 ASP 67 HB3 ASP 67 -21.689 -6.016 -12.048 546 HB3 ASP 67 HB2 ASP 67 -22.731 -6.761 -10.840 547 H TYR 68 H TYR 68 -19.332 -4.510 -9.220 548 HA TYR 68 HA TYR 68 -18.397 -7.163 -8.850 549 HB2 TYR 68 HB3 TYR 68 -16.854 -5.286 -9.169 550 HB3 TYR 68 HB2 TYR 68 -17.388 -4.573 -7.651 551 HD1 TYR 68 HD1 TYR 68 -16.240 -7.967 -8.742 552 HD2 TYR 68 HD2 TYR 68 -15.832 -4.767 -5.970 553 HE1 TYR 68 HE1 TYR 68 -14.509 -9.235 -7.542 554 HE2 TYR 68 HE2 TYR 68 -14.098 -6.025 -4.763 555 HH TYR 68 HH TYR 68 -13.636 -8.915 -4.694 556 H GLN 69 H GLN 69 -18.060 -8.326 -6.917 557 HA GLN 69 HA GLN 69 -19.589 -7.373 -4.591 558 HB2 GLN 69 HB3 GLN 69 -19.572 -10.251 -5.488 559 HB3 GLN 69 HB2 GLN 69 -20.586 -9.510 -4.258 560 HG2 GLN 69 HG3 GLN 69 -20.742 -8.590 -7.095 561 HG3 GLN 69 HG2 GLN 69 -21.580 -10.052 -6.579 562 HE21 GLN 69 HE21 GLN 69 -21.680 -6.688 -6.757 563 HE22 GLN 69 HE22 GLN 69 -23.099 -6.429 -5.806 564 H ALA 70 H ALA 70 -18.007 -6.954 -3.167 565 HA ALA 70 HA ALA 70 -15.890 -8.961 -2.791 566 HB1 ALA 70 HB1 ALA 70 -15.343 -6.505 -3.288 567 HB2 ALA 70 HB2 ALA 70 -14.498 -7.284 -1.951 568 HB3 ALA 70 HB3 ALA 70 -15.847 -6.196 -1.627 569 H GLN 71 H GLN 71 -16.847 -10.419 -1.434 570 HA GLN 71 HA GLN 71 -18.429 -9.670 0.812 571 HB2 GLN 71 HB3 GLN 71 -17.043 -12.322 0.493 572 HB3 GLN 71 HB2 GLN 71 -18.560 -11.974 1.311 573 HG2 GLN 71 HG3 GLN 71 -19.553 -12.691 -0.539 574 HG3 GLN 71 HG2 GLN 71 -19.054 -11.164 -1.266 575 HE21 GLN 71 HE21 GLN 71 -17.792 -11.239 -2.993 576 HE22 GLN 71 HE22 GLN 71 -16.944 -12.632 -3.562 577 H GLY 72 H GLY 72 -17.774 -8.946 2.716 578 HA2 GLY 72 HA3 GLY 72 -16.480 -9.220 4.713 579 HA3 GLY 72 HA2 GLY 72 -15.153 -9.812 3.728 580 H ALA 73 H ALA 73 -15.614 -7.519 1.780 581 HA ALA 73 HA ALA 73 -14.499 -5.371 3.457 582 HB1 ALA 73 HB1 ALA 73 -12.778 -6.594 2.116 583 HB2 ALA 73 HB2 ALA 73 -12.878 -4.865 1.784 584 HB3 ALA 73 HB3 ALA 73 -13.593 -6.022 0.662 585 H VAL 74 H VAL 74 -14.520 -3.221 2.255 586 HA VAL 74 HA VAL 74 -17.211 -2.768 1.291 587 HB VAL 74 HB VAL 74 -15.018 -0.712 1.533 588 HG11 VAL 74 HG11 VAL 74 -16.666 0.451 0.520 589 HG12 VAL 74 HG12 VAL 74 -17.311 0.548 2.159 590 HG13 VAL 74 HG13 VAL 74 -17.925 -0.670 1.040 591 HG21 VAL 74 HG21 VAL 74 -15.688 -0.286 3.786 592 HG22 VAL 74 HG22 VAL 74 -15.329 -2.007 3.651 593 HG23 VAL 74 HG23 VAL 74 -17.004 -1.454 3.675 594 H VAL 75 H VAL 75 -17.813 -2.262 -0.753 595 HA VAL 75 HA VAL 75 -15.707 -2.379 -2.805 596 HB VAL 75 HB VAL 75 -18.656 -2.919 -3.159 597 HG11 VAL 75 HG11 VAL 75 -17.598 -4.110 -5.245 598 HG12 VAL 75 HG12 VAL 75 -16.297 -2.949 -4.981 599 HG13 VAL 75 HG13 VAL 75 -17.941 -2.380 -5.273 600 HG21 VAL 75 HG21 VAL 75 -16.903 -4.508 -1.796 601 HG22 VAL 75 HG22 VAL 75 -16.778 -5.146 -3.435 602 HG23 VAL 75 HG23 VAL 75 -18.348 -5.076 -2.634 603 H VAL 76 H VAL 76 -15.354 -0.732 -4.122 604 HA VAL 76 HA VAL 76 -17.396 1.255 -4.656 605 HB VAL 76 HB VAL 76 -16.033 3.170 -4.040 606 HG11 VAL 76 HG11 VAL 76 -17.569 1.940 -2.382 607 HG12 VAL 76 HG12 VAL 76 -16.444 3.143 -1.751 608 HG13 VAL 76 HG13 VAL 76 -16.071 1.426 -1.605 609 HG21 VAL 76 HG21 VAL 76 -13.911 1.376 -4.072 610 HG22 VAL 76 HG22 VAL 76 -14.086 1.824 -2.376 611 HG23 VAL 76 HG23 VAL 76 -13.855 3.074 -3.599 612 H HIS 77 H HIS 77 -16.463 2.940 -6.265 613 HA HIS 77 HA HIS 77 -14.403 1.700 -7.950 614 HB2 HIS 77 HB3 HIS 77 -16.642 2.951 -9.417 615 HB3 HIS 77 HB2 HIS 77 -15.700 1.514 -9.802 616 HD1 HIS 77 HD1 HIS 77 -16.308 -0.457 -7.739 617 HD2 HIS 77 HD2 HIS 77 -19.207 2.212 -9.056 618 HE1 HIS 77 HE1 HIS 77 -18.512 -1.517 -7.154 619 HE2 HIS 77 HE2 HIS 77 -20.249 0.163 -7.870 620 H ASP 78 H ASP 78 -15.677 4.541 -6.559 621 HA ASP 78 HA ASP 78 -13.973 6.169 -8.324 622 HB2 ASP 78 HB3 ASP 78 -16.661 6.643 -7.179 623 HB3 ASP 78 HB2 ASP 78 -15.568 8.024 -7.180 624 H VAL 79 H VAL 79 -12.771 7.881 -7.384 625 HA VAL 79 HA VAL 79 -11.580 7.216 -4.905 626 HB VAL 79 HB VAL 79 -10.524 9.558 -5.220 627 HG11 VAL 79 HG11 VAL 79 -9.097 7.798 -5.602 628 HG12 VAL 79 HG12 VAL 79 -9.130 8.569 -7.188 629 HG13 VAL 79 HG13 VAL 79 -10.102 7.128 -6.887 630 HG21 VAL 79 HG21 VAL 79 -12.448 9.823 -7.138 631 HG22 VAL 79 HG22 VAL 79 -11.030 9.379 -8.087 632 HG23 VAL 79 HG23 VAL 79 -10.977 10.789 -7.030 633 H ALA 80 H ALA 80 -13.935 9.620 -5.920 634 HA ALA 80 HA ALA 80 -13.994 11.055 -3.471 635 HB1 ALA 80 HB1 ALA 80 -14.897 11.689 -5.850 636 HB2 ALA 80 HB2 ALA 80 -15.684 12.310 -4.399 637 HB3 ALA 80 HB3 ALA 80 -16.379 10.936 -5.260 638 H ALA 81 H ALA 81 -15.868 8.362 -4.774 639 HA ALA 81 HA ALA 81 -17.853 8.174 -2.849 640 HB1 ALA 81 HB1 ALA 81 -16.610 5.672 -3.891 641 HB2 ALA 81 HB2 ALA 81 -17.385 6.779 -5.023 642 HB3 ALA 81 HB3 ALA 81 -18.313 6.087 -3.693 643 H VAL 82 H VAL 82 -14.871 6.197 -2.899 644 HA VAL 82 HA VAL 82 -15.054 5.094 -0.405 645 HB VAL 82 HB VAL 82 -13.293 4.752 -2.283 646 HG11 VAL 82 HG11 VAL 82 -12.482 7.215 -1.762 647 HG12 VAL 82 HG12 VAL 82 -11.367 5.962 -2.301 648 HG13 VAL 82 HG13 VAL 82 -11.474 6.370 -0.589 649 HG21 VAL 82 HG21 VAL 82 -12.274 4.612 0.540 650 HG22 VAL 82 HG22 VAL 82 -11.903 3.541 -0.810 651 HG23 VAL 82 HG23 VAL 82 -13.511 3.523 -0.087 652 H PHE 83 H PHE 83 -14.003 8.353 -1.234 653 HA PHE 83 HA PHE 83 -12.806 9.025 1.211 654 HB2 PHE 83 HB3 PHE 83 -13.831 10.471 -1.129 655 HB3 PHE 83 HB2 PHE 83 -13.918 11.394 0.367 656 HD1 PHE 83 HD2 PHE 83 -11.562 10.665 1.822 657 HD2 PHE 83 HD1 PHE 83 -12.058 11.223 -2.367 658 HE1 PHE 83 HE2 PHE 83 -9.174 11.220 1.618 659 HE2 PHE 83 HE1 PHE 83 -9.670 11.778 -2.580 660 HZ PHE 83 HZ PHE 83 -8.225 11.778 -0.584 661 H ALA 84 H ALA 84 -16.182 9.184 0.161 662 HA ALA 84 HA ALA 84 -17.208 10.511 2.411 663 HB1 ALA 84 HB1 ALA 84 -18.842 8.395 1.101 664 HB2 ALA 84 HB2 ALA 84 -18.326 9.773 0.129 665 HB3 ALA 84 HB3 ALA 84 -19.291 10.031 1.582 666 H TYR 85 H TYR 85 -16.610 7.109 1.752 667 HA TYR 85 HA TYR 85 -17.728 6.070 4.113 668 HB2 TYR 85 HB3 TYR 85 -17.120 4.129 3.167 669 HB3 TYR 85 HB2 TYR 85 -16.317 5.037 1.897 670 HD1 TYR 85 HD1 TYR 85 -15.655 3.845 5.387 671 HD2 TYR 85 HD2 TYR 85 -14.100 4.572 1.497 672 HE1 TYR 85 HE1 TYR 85 -13.496 2.890 6.075 673 HE2 TYR 85 HE2 TYR 85 -11.937 3.622 2.175 674 HH TYR 85 HH TYR 85 -10.991 3.214 5.237 675 H ALA 86 H ALA 86 -14.275 6.682 3.389 676 HA ALA 86 HA ALA 86 -13.163 6.321 5.822 677 HB1 ALA 86 HB1 ALA 86 -12.255 7.331 3.504 678 HB2 ALA 86 HB2 ALA 86 -11.337 7.367 5.010 679 HB3 ALA 86 HB3 ALA 86 -12.246 8.789 4.497 680 H LYS 87 H LYS 87 -15.124 9.094 4.872 681 HA LYS 87 HA LYS 87 -14.542 10.658 7.181 682 HB2 LYS 87 HB3 LYS 87 -15.829 11.161 4.843 683 HB3 LYS 87 HB2 LYS 87 -17.203 10.963 5.922 684 HG2 LYS 87 HG3 LYS 87 -16.822 13.219 6.067 685 HG3 LYS 87 HG2 LYS 87 -15.899 12.620 7.446 686 HD2 LYS 87 HD3 LYS 87 -14.059 12.481 5.433 687 HD3 LYS 87 HD2 LYS 87 -14.984 13.914 4.980 688 HE2 LYS 87 HE3 LYS 87 -13.680 13.416 7.655 689 HE3 LYS 87 HE2 LYS 87 -13.079 14.495 6.397 690 HZ1 LYS 87 HZ1 LYS 87 -14.618 15.295 8.411 691 HZ2 LYS 87 HZ2 LYS 87 -15.812 14.960 7.261 692 HZ3 LYS 87 HZ3 LYS 87 -14.584 16.068 6.906 693 H GLN 88 H GLN 88 -17.123 8.440 6.294 694 HA GLN 88 HA GLN 88 -18.684 8.646 8.603 695 HB2 GLN 88 HB3 GLN 88 -19.220 7.468 6.389 696 HB3 GLN 88 HB2 GLN 88 -18.353 6.088 7.050 697 HG2 GLN 88 HG3 GLN 88 -20.384 5.488 7.775 698 HG3 GLN 88 HG2 GLN 88 -20.031 6.612 9.086 699 HE21 GLN 88 HE21 GLN 88 -21.066 6.993 5.712 700 HE22 GLN 88 HE22 GLN 88 -22.442 7.976 6.066 701 H HIS 89 H HIS 89 -15.612 7.187 8.150 702 HA HIS 89 HA HIS 89 -15.881 5.704 10.675 703 HB2 HIS 89 HB3 HIS 89 -14.334 5.257 8.190 704 HB3 HIS 89 HB2 HIS 89 -13.517 4.844 9.694 705 HD1 HIS 89 HD1 HIS 89 -15.881 3.656 11.262 706 HD2 HIS 89 HD2 HIS 89 -15.056 2.801 7.281 707 HE1 HIS 89 HE1 HIS 89 -16.965 1.431 10.814 708 HE2 HIS 89 HE2 HIS 89 -16.528 0.977 8.375 709 HA PRO 90 HA PRO 90 -13.141 9.323 11.675 710 HB2 PRO 90 HB3 PRO 90 -14.431 10.152 13.876 711 HB3 PRO 90 HB2 PRO 90 -14.981 10.600 12.256 712 HG2 PRO 90 HG3 PRO 90 -16.007 8.453 14.076 713 HG3 PRO 90 HG2 PRO 90 -16.919 9.622 13.104 714 HD2 PRO 90 HD3 PRO 90 -16.482 7.042 12.327 715 HD3 PRO 90 HD2 PRO 90 -16.701 8.383 11.186 716 H ASP 91 H ASP 91 -13.917 6.351 13.014 717 HA ASP 91 HA ASP 91 -12.129 6.706 15.315 718 HB2 ASP 91 HB3 ASP 91 -14.569 5.493 15.187 719 HB3 ASP 91 HB2 ASP 91 -13.490 4.116 14.993 720 H GLN 92 H GLN 92 -11.733 5.977 12.207 721 HA GLN 92 HA GLN 92 -9.529 4.132 12.787 722 HB2 GLN 92 HB3 GLN 92 -11.837 3.664 11.016 723 HB3 GLN 92 HB2 GLN 92 -10.272 3.300 10.303 724 HG2 GLN 92 HG3 GLN 92 -10.447 1.314 11.271 725 HG3 GLN 92 HG2 GLN 92 -10.104 2.142 12.789 726 HE21 GLN 92 HE21 GLN 92 -12.325 0.298 11.058 727 HE22 GLN 92 HE22 GLN 92 -13.659 0.419 12.149 728 H GLU 93 H GLU 93 -8.088 3.934 10.747 729 HA GLU 93 HA GLU 93 -7.775 6.626 9.588 730 HB2 GLU 93 HB3 GLU 93 -6.020 5.523 11.272 731 HB3 GLU 93 HB2 GLU 93 -5.437 4.797 9.781 732 HG2 GLU 93 HG3 GLU 93 -5.510 7.242 8.890 733 HG3 GLU 93 HG2 GLU 93 -5.481 7.660 10.603 734 H LEU 94 H LEU 94 -6.805 6.731 7.460 735 HA LEU 94 HA LEU 94 -7.618 4.450 5.804 736 HB2 LEU 94 HB3 LEU 94 -8.234 7.074 5.550 737 HB3 LEU 94 HB2 LEU 94 -6.815 6.989 4.525 738 HG LEU 94 HG LEU 94 -7.889 5.193 3.212 739 HD11 LEU 94 HD11 LEU 94 -9.788 4.182 3.803 740 HD12 LEU 94 HD12 LEU 94 -10.570 5.702 4.234 741 HD13 LEU 94 HD13 LEU 94 -9.521 4.890 5.396 742 HD21 LEU 94 HD21 LEU 94 -8.994 6.662 1.883 743 HD22 LEU 94 HD22 LEU 94 -8.235 7.827 2.967 744 HD23 LEU 94 HD23 LEU 94 -9.914 7.352 3.220 745 H VAL 95 H VAL 95 -6.135 3.179 4.905 746 HA VAL 95 HA VAL 95 -3.468 4.266 4.343 747 HB VAL 95 HB VAL 95 -3.857 1.560 5.619 748 HG11 VAL 95 HG11 VAL 95 -1.638 1.257 5.414 749 HG12 VAL 95 HG12 VAL 95 -1.270 2.948 5.756 750 HG13 VAL 95 HG13 VAL 95 -1.774 2.465 4.136 751 HG21 VAL 95 HG21 VAL 95 -3.393 4.244 6.837 752 HG22 VAL 95 HG22 VAL 95 -2.649 2.822 7.568 753 HG23 VAL 95 HG23 VAL 95 -4.402 2.912 7.399 754 H ILE 96 H ILE 96 -2.506 3.493 2.519 755 HA ILE 96 HA ILE 96 -4.122 1.670 0.873 756 HB ILE 96 HB ILE 96 -1.862 3.374 -0.147 757 HG12 ILE 96 HG13 ILE 96 -3.383 4.917 0.935 758 HG13 ILE 96 HG12 ILE 96 -3.592 5.041 -0.809 759 HG21 ILE 96 HG21 ILE 96 -2.454 1.793 -1.748 760 HG22 ILE 96 HG22 ILE 96 -3.370 3.222 -2.225 761 HG23 ILE 96 HG23 ILE 96 -4.172 1.907 -1.366 762 HD11 ILE 96 HD11 ILE 96 -5.373 3.396 0.964 763 HD12 ILE 96 HD12 ILE 96 -5.628 3.823 -0.728 764 HD13 ILE 96 HD13 ILE 96 -5.701 5.070 0.517 765 H ALA 97 H ALA 97 -3.347 -0.271 0.265 766 HA ALA 97 HA ALA 97 -0.559 -0.895 0.992 767 HB1 ALA 97 HB1 ALA 97 -2.971 -2.701 0.918 768 HB2 ALA 97 HB2 ALA 97 -2.104 -2.142 2.348 769 HB3 ALA 97 HB3 ALA 97 -1.319 -3.243 1.216 770 H GLY 98 H GLY 98 -2.986 -1.068 -1.521 771 HA2 GLY 98 HA3 GLY 98 -1.255 -1.111 -3.652 772 HA3 GLY 98 HA2 GLY 98 -1.489 -2.803 -3.240 773 H GLY 99 H GLY 99 -3.956 -2.044 -5.850 774 HA2 GLY 99 HA3 GLY 99 -1.141 -2.556 -5.309 775 HA3 GLY 99 HA2 GLY 99 -1.964 -2.747 -6.846 776 H ALA 100 H ALA 100 -0.319 -1.664 -7.957 777 HA ALA 100 HA ALA 100 0.664 0.884 -7.288 778 HB1 ALA 100 HB1 ALA 100 1.920 -0.442 -8.800 779 HB2 ALA 100 HB2 ALA 100 1.361 0.963 -9.708 780 HB3 ALA 100 HB3 ALA 100 0.555 -0.593 -9.908 781 H GLN 101 H GLN 101 -2.002 -0.127 -9.390 782 HA GLN 101 HA GLN 101 -2.655 2.356 -10.472 783 HB2 GLN 101 HB3 GLN 101 -3.801 -0.253 -10.389 784 HB3 GLN 101 HB2 GLN 101 -5.066 0.905 -10.004 785 HG2 GLN 101 HG3 GLN 101 -3.420 1.713 -12.266 786 HG3 GLN 101 HG2 GLN 101 -4.254 0.180 -12.517 787 HE21 GLN 101 HE21 GLN 101 -5.001 3.323 -11.036 788 HE22 GLN 101 HE22 GLN 101 -6.526 3.522 -11.822 789 H ILE 102 H ILE 102 -3.448 0.939 -7.363 790 HA ILE 102 HA ILE 102 -5.377 2.910 -6.626 791 HB ILE 102 HB ILE 102 -3.775 1.198 -4.731 792 HG12 ILE 102 HG13 ILE 102 -4.729 -0.255 -6.441 793 HG13 ILE 102 HG12 ILE 102 -5.600 -0.459 -4.925 794 HG21 ILE 102 HG21 ILE 102 -5.417 1.608 -3.162 795 HG22 ILE 102 HG22 ILE 102 -6.622 2.029 -4.379 796 HG23 ILE 102 HG23 ILE 102 -5.319 3.156 -4.001 797 HD11 ILE 102 HD11 ILE 102 -7.499 0.555 -5.729 798 HD12 ILE 102 HD12 ILE 102 -6.899 -0.283 -7.160 799 HD13 ILE 102 HD13 ILE 102 -6.625 1.448 -6.972 800 H PHE 103 H PHE 103 -1.923 2.457 -6.013 801 HA PHE 103 HA PHE 103 -1.556 4.560 -4.206 802 HB2 PHE 103 HB3 PHE 103 0.330 3.333 -6.223 803 HB3 PHE 103 HB2 PHE 103 0.834 4.525 -5.030 804 HD1 PHE 103 HD2 PHE 103 -0.748 3.601 -2.683 805 HD2 PHE 103 HD1 PHE 103 1.492 1.427 -5.575 806 HE1 PHE 103 HE2 PHE 103 -0.387 1.802 -1.045 807 HE2 PHE 103 HE1 PHE 103 1.857 -0.376 -3.943 808 HZ PHE 103 HZ PHE 103 0.918 -0.190 -1.675 809 H THR 104 H THR 104 -1.467 4.497 -7.739 810 HA THR 104 HA THR 104 -0.570 7.088 -8.205 811 HB THR 104 HB THR 104 -2.590 5.573 -9.865 812 HG1 THR 104 HG1 THR 104 -0.854 4.243 -9.634 813 HG21 THR 104 HG21 THR 104 -2.257 7.008 -11.533 814 HG22 THR 104 HG22 THR 104 -0.529 7.140 -11.204 815 HG23 THR 104 HG23 THR 104 -1.681 8.102 -10.276 816 H ALA 105 H ALA 105 -3.954 5.946 -8.069 817 HA ALA 105 HA ALA 105 -5.211 8.379 -8.442 818 HB1 ALA 105 HB1 ALA 105 -7.122 7.283 -7.967 819 HB2 ALA 105 HB2 ALA 105 -6.486 6.605 -6.468 820 HB3 ALA 105 HB3 ALA 105 -6.076 5.864 -8.014 821 H PHE 106 H PHE 106 -4.565 6.874 -5.240 822 HA PHE 106 HA PHE 106 -5.265 9.250 -3.862 823 HB2 PHE 106 HB3 PHE 106 -3.875 6.715 -3.002 824 HB3 PHE 106 HB2 PHE 106 -4.236 8.033 -1.891 825 HD1 PHE 106 HD2 PHE 106 -5.827 5.667 -4.272 826 HD2 PHE 106 HD1 PHE 106 -6.318 8.178 -0.871 827 HE1 PHE 106 HE2 PHE 106 -8.088 4.756 -3.931 828 HE2 PHE 106 HE1 PHE 106 -8.579 7.272 -0.523 829 HZ PHE 106 HZ PHE 106 -9.467 5.559 -2.056 830 H LYS 107 H LYS 107 -2.446 8.348 -5.537 831 HA LYS 107 HA LYS 107 -0.333 9.290 -4.094 832 HB2 LYS 107 HB3 LYS 107 0.831 9.361 -6.058 833 HB3 LYS 107 HB2 LYS 107 -0.577 8.471 -6.616 834 HG2 LYS 107 HG3 LYS 107 -1.544 10.637 -7.397 835 HG3 LYS 107 HG2 LYS 107 -0.008 11.402 -6.989 836 HD2 LYS 107 HD3 LYS 107 1.155 9.957 -8.555 837 HD3 LYS 107 HD2 LYS 107 -0.351 9.115 -8.927 838 HE2 LYS 107 HE3 LYS 107 -0.398 10.574 -10.652 839 HE3 LYS 107 HE2 LYS 107 -1.110 11.635 -9.437 840 HZ1 LYS 107 HZ1 LYS 107 0.983 12.317 -10.906 841 HZ2 LYS 107 HZ2 LYS 107 1.795 11.620 -9.596 842 HZ3 LYS 107 HZ3 LYS 107 0.731 12.909 -9.340 843 H ASP 108 H ASP 108 -2.783 11.186 -5.742 844 HA ASP 108 HA ASP 108 -1.512 13.697 -5.014 845 HB2 ASP 108 HB3 ASP 108 -3.494 12.844 -6.946 846 HB3 ASP 108 HB2 ASP 108 -4.068 14.237 -6.033 847 H ASP 109 H ASP 109 -4.342 11.774 -4.174 848 HA ASP 109 HA ASP 109 -5.276 13.739 -2.257 849 HB2 ASP 109 HB3 ASP 109 -6.347 11.356 -3.550 850 HB3 ASP 109 HB2 ASP 109 -6.748 11.431 -1.837 851 H VAL 110 H VAL 110 -2.728 11.818 -2.056 852 HA VAL 110 HA VAL 110 -3.262 10.550 0.492 853 HB VAL 110 HB VAL 110 -1.842 9.415 -1.158 854 HG11 VAL 110 HG11 VAL 110 0.492 11.132 -0.663 855 HG12 VAL 110 HG12 VAL 110 -0.764 11.842 -1.676 856 HG13 VAL 110 HG13 VAL 110 -0.023 10.309 -2.135 857 HG21 VAL 110 HG21 VAL 110 -1.574 9.013 1.282 858 HG22 VAL 110 HG22 VAL 110 -0.254 10.182 1.287 859 HG23 VAL 110 HG23 VAL 110 -0.113 8.698 0.345 860 H ASP 111 H ASP 111 -1.936 10.906 2.381 861 HA ASP 111 HA ASP 111 -0.939 13.671 2.589 862 HB2 ASP 111 HB3 ASP 111 -2.760 12.119 4.375 863 HB3 ASP 111 HB2 ASP 111 -1.651 13.274 5.110 864 H THR 112 H THR 112 -0.628 10.337 3.715 865 HA THR 112 HA THR 112 2.064 11.000 4.715 866 HB THR 112 HB THR 112 0.364 8.652 5.565 867 HG1 THR 112 HG1 THR 112 -0.188 9.840 7.342 868 HG21 THR 112 HG21 THR 112 2.025 9.183 7.628 869 HG22 THR 112 HG22 THR 112 3.060 9.570 6.253 870 HG23 THR 112 HG23 THR 112 2.329 7.970 6.384 871 H LEU 113 H LEU 113 3.734 9.411 4.378 872 HA LEU 113 HA LEU 113 3.198 7.428 2.294 873 HB2 LEU 113 HB3 LEU 113 4.373 9.878 1.756 874 HB3 LEU 113 HB2 LEU 113 5.741 8.795 1.915 875 HG LEU 113 HG LEU 113 4.948 7.407 0.129 876 HD11 LEU 113 HD11 LEU 113 2.736 8.881 -0.880 877 HD12 LEU 113 HD12 LEU 113 2.414 8.482 0.806 878 HD13 LEU 113 HD13 LEU 113 2.791 7.202 -0.345 879 HD21 LEU 113 HD21 LEU 113 4.545 9.430 -1.600 880 HD22 LEU 113 HD22 LEU 113 6.127 8.991 -0.955 881 HD23 LEU 113 HD23 LEU 113 5.215 10.315 -0.229 882 H LEU 114 H LEU 114 3.890 5.546 3.030 883 HA LEU 114 HA LEU 114 6.396 5.452 4.579 884 HB2 LEU 114 HB3 LEU 114 4.006 3.641 4.954 885 HB3 LEU 114 HB2 LEU 114 5.497 3.602 5.874 886 HG LEU 114 HG LEU 114 3.796 6.069 5.867 887 HD11 LEU 114 HD11 LEU 114 2.129 4.731 6.631 888 HD12 LEU 114 HD12 LEU 114 3.012 4.945 8.143 889 HD13 LEU 114 HD13 LEU 114 3.239 3.478 7.190 890 HD21 LEU 114 HD21 LEU 114 5.650 6.654 7.008 891 HD22 LEU 114 HD22 LEU 114 6.078 4.984 7.381 892 HD23 LEU 114 HD23 LEU 114 4.846 5.812 8.333 893 H VAL 115 H VAL 115 7.863 4.626 3.202 894 HA VAL 115 HA VAL 115 7.049 2.275 1.619 895 HB VAL 115 HB VAL 115 8.594 2.979 -0.143 896 HG11 VAL 115 HG11 VAL 115 6.708 5.228 0.522 897 HG12 VAL 115 HG12 VAL 115 6.183 3.668 -0.110 898 HG13 VAL 115 HG13 VAL 115 7.240 4.699 -1.074 899 HG21 VAL 115 HG21 VAL 115 10.231 4.226 1.043 900 HG22 VAL 115 HG22 VAL 115 9.025 5.365 1.641 901 HG23 VAL 115 HG23 VAL 115 9.446 5.345 -0.071 902 H THR 116 H THR 116 8.390 0.571 1.484 903 HA THR 116 HA THR 116 10.789 0.621 3.187 904 HB THR 116 HB THR 116 9.000 -1.655 2.309 905 HG1 THR 116 HG1 THR 116 8.588 -1.811 4.510 906 HG21 THR 116 HG21 THR 116 11.191 -2.581 2.324 907 HG22 THR 116 HG22 THR 116 10.378 -3.077 3.809 908 HG23 THR 116 HG23 THR 116 11.576 -1.783 3.849 909 H ARG 117 H ARG 117 12.390 1.257 1.810 910 HA ARG 117 HA ARG 117 12.544 0.211 -0.875 911 HB2 ARG 117 HB3 ARG 117 13.303 2.559 0.174 912 HB3 ARG 117 HB2 ARG 117 14.830 1.696 0.298 913 HG2 ARG 117 HG3 ARG 117 14.603 1.157 -2.146 914 HG3 ARG 117 HG2 ARG 117 13.242 2.281 -2.185 915 HD2 ARG 117 HD3 ARG 117 15.876 3.142 -1.061 916 HD3 ARG 117 HD2 ARG 117 15.627 3.117 -2.804 917 HE ARG 117 HE ARG 117 14.164 4.788 -0.877 918 HH11 ARG 117 HH11 ARG 117 15.056 4.049 -4.180 919 HH12 ARG 117 HH12 ARG 117 14.408 5.524 -4.808 920 HH21 ARG 117 HH21 ARG 117 13.312 6.718 -1.715 921 HH22 ARG 117 HH22 ARG 117 13.419 7.037 -3.414 922 H LEU 118 H LEU 118 13.145 -1.847 -1.083 923 HA LEU 118 HA LEU 118 14.973 -3.142 0.692 924 HB2 LEU 118 HB3 LEU 118 13.244 -3.875 -1.526 925 HB3 LEU 118 HB2 LEU 118 14.790 -4.697 -1.614 926 HG LEU 118 HG LEU 118 14.427 -5.492 0.731 927 HD11 LEU 118 HD11 LEU 118 11.717 -5.398 1.062 928 HD12 LEU 118 HD12 LEU 118 12.071 -3.790 0.431 929 HD13 LEU 118 HD13 LEU 118 12.881 -4.363 1.888 930 HD21 LEU 118 HD21 LEU 118 13.432 -7.363 -0.035 931 HD22 LEU 118 HD22 LEU 118 13.613 -6.567 -1.598 932 HD23 LEU 118 HD23 LEU 118 12.075 -6.483 -0.739 933 H ALA 119 H ALA 119 17.121 -3.493 0.471 934 HA ALA 119 HA ALA 119 18.666 -1.847 -1.188 935 HB1 ALA 119 HB1 ALA 119 19.173 -4.031 0.705 936 HB2 ALA 119 HB2 ALA 119 19.986 -2.478 0.518 937 HB3 ALA 119 HB3 ALA 119 20.406 -3.826 -0.539 938 H GLY 120 H GLY 120 17.924 -5.314 -1.443 939 HA2 GLY 120 HA3 GLY 120 19.413 -5.823 -3.761 940 HA3 GLY 120 HA2 GLY 120 18.031 -6.761 -3.216 941 H SER 121 H SER 121 18.837 -6.042 -5.921 942 HA SER 121 HA SER 121 16.657 -4.272 -6.758 943 HB2 SER 121 HB3 SER 121 19.171 -4.117 -7.558 944 HB3 SER 121 HB2 SER 121 18.665 -5.380 -8.680 945 HG SER 121 HG SER 121 17.208 -2.979 -8.375 946 H PHE 122 H PHE 122 15.017 -4.956 -8.056 947 HA PHE 122 HA PHE 122 15.036 -7.720 -9.014 948 HB2 PHE 122 HB3 PHE 122 12.868 -6.531 -7.274 949 HB3 PHE 122 HB2 PHE 122 12.725 -8.059 -8.137 950 HD1 PHE 122 HD2 PHE 122 14.412 -6.304 -5.390 951 HD2 PHE 122 HD1 PHE 122 13.816 -10.033 -7.352 952 HE1 PHE 122 HE2 PHE 122 15.445 -7.468 -3.483 953 HE2 PHE 122 HE1 PHE 122 14.846 -11.204 -5.449 954 HZ PHE 122 HZ PHE 122 15.663 -9.921 -3.512 955 H GLU 123 H GLU 123 13.207 -8.167 -10.503 956 HA GLU 123 HA GLU 123 12.170 -5.761 -11.825 957 HB2 GLU 123 HB3 GLU 123 12.725 -6.670 -14.027 958 HB3 GLU 123 HB2 GLU 123 14.175 -6.442 -13.058 959 HG2 GLU 123 HG3 GLU 123 13.368 -9.052 -12.534 960 HG3 GLU 123 HG2 GLU 123 13.123 -8.835 -14.266 961 H GLY 124 H GLY 124 10.119 -5.938 -12.589 962 HA2 GLY 124 HA3 GLY 124 8.900 -8.555 -12.932 963 HA3 GLY 124 HA2 GLY 124 8.256 -7.590 -11.613 964 H ASP 125 H ASP 125 6.255 -7.131 -12.374 965 HA ASP 125 HA ASP 125 6.138 -5.512 -14.826 966 HB2 ASP 125 HB3 ASP 125 3.968 -6.557 -15.378 967 HB3 ASP 125 HB2 ASP 125 5.286 -7.725 -15.378 968 H THR 126 H THR 126 6.049 -5.092 -11.759 969 HA THR 126 HA THR 126 3.834 -3.185 -11.860 970 HB THR 126 HB THR 126 4.154 -4.540 -9.257 971 HG1 THR 126 HG1 THR 126 3.246 -6.411 -9.845 972 HG21 THR 126 HG21 THR 126 2.404 -2.923 -9.512 973 HG22 THR 126 HG22 THR 126 1.689 -4.525 -9.323 974 HG23 THR 126 HG23 THR 126 1.768 -3.776 -10.918 975 H LYS 127 H LYS 127 4.949 -1.342 -11.748 976 HA LYS 127 HA LYS 127 6.962 -1.061 -9.613 977 HB2 LYS 127 HB3 LYS 127 7.562 -0.857 -12.181 978 HB3 LYS 127 HB2 LYS 127 6.924 0.768 -11.973 979 HG2 LYS 127 HG3 LYS 127 8.685 0.282 -9.819 980 HG3 LYS 127 HG2 LYS 127 9.493 -0.252 -11.293 981 HD2 LYS 127 HD3 LYS 127 8.095 2.321 -11.520 982 HD3 LYS 127 HD2 LYS 127 9.450 2.315 -10.389 983 HE2 LYS 127 HE3 LYS 127 9.991 2.938 -12.782 984 HE3 LYS 127 HE2 LYS 127 10.976 1.663 -12.065 985 HZ1 LYS 127 HZ1 LYS 127 10.167 0.130 -13.474 986 HZ2 LYS 127 HZ2 LYS 127 9.798 1.465 -14.445 987 HZ3 LYS 127 HZ3 LYS 127 8.601 0.771 -13.472 988 H MET 128 H MET 128 7.222 1.222 -8.838 989 HA MET 128 HA MET 128 4.693 2.213 -7.971 990 HB2 MET 128 HB3 MET 128 6.825 2.255 -6.632 991 HB3 MET 128 HB2 MET 128 7.387 3.547 -7.682 992 HG2 MET 128 HG3 MET 128 6.473 4.352 -5.544 993 HG3 MET 128 HG2 MET 128 5.622 4.992 -6.948 994 HE1 MET 128 HE1 MET 128 2.774 5.360 -5.664 995 HE2 MET 128 HE2 MET 128 4.341 5.761 -4.962 996 HE3 MET 128 HE3 MET 128 3.175 4.818 -4.034 997 H ILE 129 H ILE 129 4.121 4.557 -8.121 998 HA ILE 129 HA ILE 129 4.573 5.519 -10.867 999 HB ILE 129 HB ILE 129 2.425 6.704 -10.664 1000 HG12 ILE 129 HG13 ILE 129 0.976 5.722 -8.672 1001 HG13 ILE 129 HG12 ILE 129 2.551 5.567 -7.904 1002 HG21 ILE 129 HG21 ILE 129 1.481 4.906 -11.560 1003 HG22 ILE 129 HG22 ILE 129 1.387 4.115 -9.987 1004 HG23 ILE 129 HG23 ILE 129 2.840 3.948 -10.973 1005 HD11 ILE 129 HD11 ILE 129 1.679 8.150 -9.124 1006 HD12 ILE 129 HD12 ILE 129 2.903 7.855 -7.890 1007 HD13 ILE 129 HD13 ILE 129 1.193 7.691 -7.492 1008 HA PRO 130 HA PRO 130 6.420 9.303 -9.577 1009 HB2 PRO 130 HB3 PRO 130 4.424 10.823 -11.151 1010 HB3 PRO 130 HB2 PRO 130 6.184 10.782 -11.302 1011 HG2 PRO 130 HG3 PRO 130 4.622 9.571 -13.097 1012 HG3 PRO 130 HG2 PRO 130 6.162 8.854 -12.586 1013 HD2 PRO 130 HD3 PRO 130 3.372 8.141 -11.766 1014 HD3 PRO 130 HD2 PRO 130 4.751 7.077 -12.116 1015 H LEU 131 H LEU 131 6.211 11.054 -8.165 1016 HA LEU 131 HA LEU 131 3.554 11.714 -7.147 1017 HB2 LEU 131 HB3 LEU 131 5.630 11.237 -5.079 1018 HB3 LEU 131 HB2 LEU 131 3.889 11.075 -4.975 1019 HG LEU 131 HG LEU 131 5.361 9.098 -6.647 1020 HD11 LEU 131 HD11 LEU 131 6.140 7.823 -4.870 1021 HD12 LEU 131 HD12 LEU 131 5.179 8.707 -3.685 1022 HD13 LEU 131 HD13 LEU 131 6.591 9.467 -4.419 1023 HD21 LEU 131 HD21 LEU 131 2.844 9.229 -6.325 1024 HD22 LEU 131 HD22 LEU 131 3.134 8.692 -4.670 1025 HD23 LEU 131 HD23 LEU 131 3.600 7.664 -6.026 1026 H ASN 132 H ASN 132 3.478 13.685 -5.936 1027 HA ASN 132 HA ASN 132 5.385 15.634 -6.840 1028 HB2 ASN 132 HB3 ASN 132 2.731 15.717 -6.034 1029 HB3 ASN 132 HB2 ASN 132 3.578 16.519 -4.715 1030 HD21 ASN 132 HD21 ASN 132 5.636 17.731 -6.071 1031 HD22 ASN 132 HD22 ASN 132 4.995 18.941 -7.125 1032 H TRP 133 H TRP 133 7.217 14.524 -5.833 1033 HA TRP 133 HA TRP 133 7.588 14.141 -3.127 1034 HB2 TRP 133 HB3 TRP 133 9.623 14.847 -5.241 1035 HB3 TRP 133 HB2 TRP 133 10.023 14.258 -3.629 1036 HD1 TRP 133 HD1 TRP 133 8.581 13.094 -6.971 1037 HE1 TRP 133 HE1 TRP 133 8.544 10.520 -7.006 1038 HE3 TRP 133 HE3 TRP 133 9.894 12.194 -2.112 1039 HZ2 TRP 133 HZ2 TRP 133 9.017 8.392 -5.215 1040 HZ3 TRP 133 HZ3 TRP 133 10.080 9.861 -1.353 1041 HH2 TRP 133 HH2 TRP 133 9.649 8.000 -2.873 1042 H ASP 134 H ASP 134 8.269 17.131 -5.003 1043 HA ASP 134 HA ASP 134 9.524 18.553 -2.985 1044 HB2 ASP 134 HB3 ASP 134 8.049 19.224 -5.457 1045 HB3 ASP 134 HB2 ASP 134 8.174 20.520 -4.272 1046 H ASP 135 H ASP 135 6.065 18.219 -3.672 1047 HA ASP 135 HA ASP 135 5.249 19.990 -1.592 1048 HB2 ASP 135 HB3 ASP 135 4.013 18.805 -3.762 1049 HB3 ASP 135 HB2 ASP 135 3.264 17.999 -2.388 1050 H PHE 136 H PHE 136 6.666 17.026 -1.371 1051 HA PHE 136 HA PHE 136 5.315 16.458 1.181 1052 HB2 PHE 136 HB3 PHE 136 6.217 14.595 -0.987 1053 HB3 PHE 136 HB2 PHE 136 6.184 14.037 0.682 1054 HD1 PHE 136 HD2 PHE 136 3.929 16.040 -1.523 1055 HD2 PHE 136 HD1 PHE 136 4.337 12.799 1.203 1056 HE1 PHE 136 HE2 PHE 136 1.525 15.566 -1.735 1057 HE2 PHE 136 HE1 PHE 136 1.933 12.318 0.997 1058 HZ PHE 136 HZ PHE 136 0.523 13.702 -0.474 1059 H THR 137 H THR 137 6.566 16.302 2.926 1060 HA THR 137 HA THR 137 9.485 16.417 2.529 1061 HB THR 137 HB THR 137 7.771 17.565 4.738 1062 HG1 THR 137 HG1 THR 137 7.792 18.855 2.921 1063 HG21 THR 137 HG21 THR 137 9.863 18.612 5.555 1064 HG22 THR 137 HG22 THR 137 10.766 17.546 4.478 1065 HG23 THR 137 HG23 THR 137 9.796 16.865 5.784 1066 H LYS 138 H LYS 138 10.797 15.038 3.598 1067 HA LYS 138 HA LYS 138 9.756 12.601 4.532 1068 HB2 LYS 138 HB3 LYS 138 12.041 12.964 3.554 1069 HB3 LYS 138 HB2 LYS 138 12.514 13.695 5.081 1070 HG2 LYS 138 HG3 LYS 138 12.784 11.719 6.067 1071 HG3 LYS 138 HG2 LYS 138 11.270 11.089 5.419 1072 HD2 LYS 138 HD3 LYS 138 12.783 9.717 4.372 1073 HD3 LYS 138 HD2 LYS 138 12.631 11.007 3.177 1074 HE2 LYS 138 HE3 LYS 138 14.633 12.089 4.215 1075 HE3 LYS 138 HE2 LYS 138 14.821 10.650 5.216 1076 HZ1 LYS 138 HZ1 LYS 138 14.642 10.347 2.300 1077 HZ2 LYS 138 HZ2 LYS 138 15.441 9.378 3.433 1078 HZ3 LYS 138 HZ3 LYS 138 16.101 10.868 2.982 1079 H VAL 139 H VAL 139 8.861 12.123 6.401 1080 HA VAL 139 HA VAL 139 9.135 13.941 8.657 1081 HB VAL 139 HB VAL 139 7.505 11.433 8.773 1082 HG11 VAL 139 HG11 VAL 139 7.916 13.278 10.618 1083 HG12 VAL 139 HG12 VAL 139 6.352 12.484 10.436 1084 HG13 VAL 139 HG13 VAL 139 6.610 14.090 9.754 1085 HG21 VAL 139 HG21 VAL 139 6.944 13.837 7.093 1086 HG22 VAL 139 HG22 VAL 139 5.610 12.989 7.874 1087 HG23 VAL 139 HG23 VAL 139 6.660 12.131 6.746 1088 H SER 140 H SER 140 10.046 10.705 7.679 1089 HA SER 140 HA SER 140 11.961 10.569 9.833 1090 HB2 SER 140 HB3 SER 140 9.397 9.230 10.064 1091 HB3 SER 140 HB2 SER 140 10.727 8.074 10.106 1092 HG SER 140 HG SER 140 9.965 9.928 11.961 1093 H SER 141 H SER 141 13.375 8.675 9.658 1094 HA SER 141 HA SER 141 13.242 7.074 7.268 1095 HB2 SER 141 HB3 SER 141 14.275 9.387 6.663 1096 HB3 SER 141 HB2 SER 141 15.698 8.788 7.516 1097 HG SER 141 HG SER 141 15.543 8.379 5.161 1098 H ARG 142 H ARG 142 13.990 5.132 7.775 1099 HA ARG 142 HA ARG 142 16.191 4.901 9.703 1100 HB2 ARG 142 HB3 ARG 142 14.117 4.480 10.930 1101 HB3 ARG 142 HB2 ARG 142 13.643 3.273 9.743 1102 HG2 ARG 142 HG3 ARG 142 14.705 1.707 10.884 1103 HG3 ARG 142 HG2 ARG 142 16.223 2.590 10.716 1104 HD2 ARG 142 HD3 ARG 142 15.180 4.034 12.671 1105 HD3 ARG 142 HD2 ARG 142 14.281 2.547 12.969 1106 HE ARG 142 HE ARG 142 17.115 2.153 12.682 1107 HH11 ARG 142 HH11 ARG 142 14.542 2.923 14.912 1108 HH12 ARG 142 HH12 ARG 142 15.419 2.384 16.304 1109 HH21 ARG 142 HH21 ARG 142 18.269 1.445 14.513 1110 HH22 ARG 142 HH22 ARG 142 17.535 1.546 16.079 1111 H THR 143 H THR 143 17.582 3.173 9.375 1112 HA THR 143 HA THR 143 17.128 1.641 6.898 1113 HB THR 143 HB THR 143 19.832 2.414 7.989 1114 HG1 THR 143 HG1 THR 143 18.660 4.289 7.415 1115 HG21 THR 143 HG21 THR 143 19.090 0.663 5.946 1116 HG22 THR 143 HG22 THR 143 20.700 1.289 6.300 1117 HG23 THR 143 HG23 THR 143 19.662 2.126 5.146 1118 H VAL 144 H VAL 144 16.787 -0.428 7.299 1119 HA VAL 144 HA VAL 144 18.116 -1.662 9.622 1120 HB VAL 144 HB VAL 144 15.635 -2.677 8.235 1121 HG11 VAL 144 HG11 VAL 144 15.382 -3.990 10.319 1122 HG12 VAL 144 HG12 VAL 144 16.951 -3.386 10.853 1123 HG13 VAL 144 HG13 VAL 144 16.839 -4.398 9.414 1124 HG21 VAL 144 HG21 VAL 144 14.642 -0.883 9.166 1125 HG22 VAL 144 HG22 VAL 144 15.977 -0.594 10.282 1126 HG23 VAL 144 HG23 VAL 144 14.767 -1.822 10.654 1127 H GLU 145 H GLU 145 19.449 -3.353 9.302 1128 HA GLU 145 HA GLU 145 19.533 -4.534 6.605 1129 HB2 GLU 145 HB3 GLU 145 22.043 -4.852 7.137 1130 HB3 GLU 145 HB2 GLU 145 21.482 -3.262 6.637 1131 HG2 GLU 145 HG3 GLU 145 21.782 -2.347 8.710 1132 HG3 GLU 145 HG2 GLU 145 21.593 -3.892 9.539 1133 H ASP 146 H ASP 146 19.947 -6.706 6.434 1134 HA ASP 146 HA ASP 146 19.773 -8.232 8.947 1135 HB2 ASP 146 HB3 ASP 146 18.368 -8.444 6.390 1136 HB3 ASP 146 HB2 ASP 146 19.056 -9.976 6.918 1137 H THR 147 H THR 147 20.447 -10.723 8.112 1138 HA THR 147 HA THR 147 23.244 -10.670 8.088 1139 HB THR 147 HB THR 147 22.802 -13.141 7.167 1140 HG1 THR 147 HG1 THR 147 20.348 -12.634 8.443 1141 HG21 THR 147 HG21 THR 147 23.544 -12.395 9.491 1142 HG22 THR 147 HG22 THR 147 22.712 -13.943 9.347 1143 HG23 THR 147 HG23 THR 147 21.842 -12.525 9.933 1144 H ASN 148 H ASN 148 20.902 -11.025 5.480 1145 HA ASN 148 HA ASN 148 23.018 -11.208 3.489 1146 HB2 ASN 148 HB3 ASN 148 20.043 -11.535 3.452 1147 HB3 ASN 148 HB2 ASN 148 20.880 -11.171 1.946 1148 HD21 ASN 148 HD21 ASN 148 19.578 -13.605 3.488 1149 HD22 ASN 148 HD22 ASN 148 20.646 -14.896 3.065 1150 HA PRO 149 HA PRO 149 23.117 -6.838 2.751 1151 HB2 PRO 149 HB3 PRO 149 24.014 -6.872 0.165 1152 HB3 PRO 149 HB2 PRO 149 25.055 -7.119 1.570 1153 HG2 PRO 149 HG3 PRO 149 23.826 -9.144 -0.258 1154 HG3 PRO 149 HG2 PRO 149 25.464 -9.095 0.420 1155 HD2 PRO 149 HD3 PRO 149 23.552 -10.690 1.441 1156 HD3 PRO 149 HD2 PRO 149 24.776 -9.919 2.470 1157 H ALA 150 H ALA 150 21.373 -9.033 0.669 1158 HA ALA 150 HA ALA 150 19.994 -6.941 -0.757 1159 HB1 ALA 150 HB1 ALA 150 18.626 -8.912 -1.614 1160 HB2 ALA 150 HB2 ALA 150 19.755 -9.933 -0.723 1161 HB3 ALA 150 HB3 ALA 150 20.343 -8.888 -2.016 1162 H LEU 151 H LEU 151 19.565 -8.573 2.226 1163 HA LEU 151 HA LEU 151 16.699 -8.151 2.305 1164 HB2 LEU 151 HB3 LEU 151 18.685 -9.311 4.235 1165 HB3 LEU 151 HB2 LEU 151 17.040 -8.960 4.724 1166 HG LEU 151 HG LEU 151 17.999 -10.998 2.734 1167 HD11 LEU 151 HD11 LEU 151 17.833 -12.194 4.624 1168 HD12 LEU 151 HD12 LEU 151 16.099 -12.147 4.299 1169 HD13 LEU 151 HD13 LEU 151 16.819 -10.989 5.418 1170 HD21 LEU 151 HD21 LEU 151 16.203 -9.935 1.586 1171 HD22 LEU 151 HD22 LEU 151 15.219 -9.882 3.048 1172 HD23 LEU 151 HD23 LEU 151 15.571 -11.429 2.278 1173 H THR 152 H THR 152 19.092 -6.030 2.468 1174 HA THR 152 HA THR 152 18.536 -4.646 4.903 1175 HB THR 152 HB THR 152 19.718 -3.318 2.485 1176 HG1 THR 152 HG1 THR 152 21.138 -5.060 4.208 1177 HG21 THR 152 HG21 THR 152 19.922 -2.995 5.422 1178 HG22 THR 152 HG22 THR 152 19.841 -1.780 4.146 1179 HG23 THR 152 HG23 THR 152 21.347 -2.646 4.445 1180 H HIS 153 H HIS 153 16.802 -3.461 5.341 1181 HA HIS 153 HA HIS 153 15.266 -2.342 3.088 1182 HB2 HIS 153 HB3 HIS 153 14.084 -2.823 5.805 1183 HB3 HIS 153 HB2 HIS 153 13.271 -2.708 4.249 1184 HD1 HIS 153 HD1 HIS 153 13.589 -5.117 6.606 1185 HD2 HIS 153 HD2 HIS 153 14.717 -5.069 2.608 1186 HE1 HIS 153 HE1 HIS 153 13.735 -7.532 5.920 1187 HE2 HIS 153 HE2 HIS 153 14.336 -7.476 3.474 1188 H THR 154 H THR 154 14.250 -0.295 3.387 1189 HA THR 154 HA THR 154 15.348 1.344 5.563 1190 HB THR 154 HB THR 154 15.239 2.182 2.658 1191 HG1 THR 154 HG1 THR 154 17.318 1.747 2.564 1192 HG21 THR 154 HG21 THR 154 16.394 4.165 3.297 1193 HG22 THR 154 HG22 THR 154 16.504 3.623 4.972 1194 HG23 THR 154 HG23 THR 154 14.936 4.036 4.279 1195 H TYR 155 H TYR 155 13.677 2.081 6.685 1196 HA TYR 155 HA TYR 155 11.097 2.474 5.384 1197 HB2 TYR 155 HB3 TYR 155 12.023 2.263 8.224 1198 HB3 TYR 155 HB2 TYR 155 10.484 3.044 7.878 1199 HD1 TYR 155 HD1 TYR 155 8.741 1.715 6.573 1200 HD2 TYR 155 HD2 TYR 155 12.182 -0.073 8.324 1201 HE1 TYR 155 HE1 TYR 155 7.643 -0.484 6.472 1202 HE2 TYR 155 HE2 TYR 155 11.095 -2.276 8.227 1203 HH TYR 155 HH TYR 155 8.861 -3.223 8.103 1204 H GLU 156 H GLU 156 10.259 4.421 4.901 1205 HA GLU 156 HA GLU 156 11.481 6.804 6.105 1206 HB2 GLU 156 HB3 GLU 156 10.915 6.442 3.158 1207 HB3 GLU 156 HB2 GLU 156 11.467 7.931 3.914 1208 HG2 GLU 156 HG3 GLU 156 13.594 7.182 4.169 1209 HG3 GLU 156 HG2 GLU 156 13.101 5.498 4.338 1210 H VAL 157 H VAL 157 10.127 8.494 6.494 1211 HA VAL 157 HA VAL 157 7.279 8.044 5.903 1212 HB VAL 157 HB VAL 157 8.367 9.767 8.128 1213 HG11 VAL 157 HG11 VAL 157 6.177 10.436 7.682 1214 HG12 VAL 157 HG12 VAL 157 5.997 9.277 8.999 1215 HG13 VAL 157 HG13 VAL 157 5.643 8.790 7.341 1216 HG21 VAL 157 HG21 VAL 157 7.627 7.851 9.605 1217 HG22 VAL 157 HG22 VAL 157 9.100 7.586 8.673 1218 HG23 VAL 157 HG23 VAL 157 7.581 6.864 8.145 1219 H TRP 158 H TRP 158 6.026 9.770 5.243 1220 HA TRP 158 HA TRP 158 7.327 12.314 4.652 1221 HB2 TRP 158 HB3 TRP 158 6.078 10.616 2.493 1222 HB3 TRP 158 HB2 TRP 158 6.552 12.295 2.290 1223 HD1 TRP 158 HD1 TRP 158 8.208 8.895 3.154 1224 HE1 TRP 158 HE1 TRP 158 10.606 8.927 2.218 1225 HE3 TRP 158 HE3 TRP 158 8.328 13.691 1.385 1226 HZ2 TRP 158 HZ2 TRP 158 12.321 10.744 0.903 1227 HZ3 TRP 158 HZ3 TRP 158 10.384 14.497 0.302 1228 HH2 TRP 158 HH2 TRP 158 12.339 13.053 0.067 1229 H GLN 159 H GLN 159 6.001 14.034 4.691 1230 HA GLN 159 HA GLN 159 3.103 13.592 4.679 1231 HB2 GLN 159 HB3 GLN 159 4.735 14.822 6.871 1232 HB3 GLN 159 HB2 GLN 159 3.099 15.398 6.582 1233 HG2 GLN 159 HG3 GLN 159 3.444 12.475 6.787 1234 HG3 GLN 159 HG2 GLN 159 3.693 13.406 8.264 1235 HE21 GLN 159 HE21 GLN 159 1.688 11.665 8.282 1236 HE22 GLN 159 HE22 GLN 159 0.159 12.462 8.178 1237 H LYS 160 H LYS 160 2.113 14.994 3.354 1238 HA LYS 160 HA LYS 160 3.487 16.886 1.847 1239 HB2 LYS 160 HB3 LYS 160 1.252 15.805 1.331 1240 HB3 LYS 160 HB2 LYS 160 0.528 16.976 2.425 1241 HG2 LYS 160 HG3 LYS 160 1.815 18.693 0.899 1242 HG3 LYS 160 HG2 LYS 160 1.714 17.373 -0.268 1243 HD2 LYS 160 HD3 LYS 160 -0.429 17.822 -0.672 1244 HD3 LYS 160 HD2 LYS 160 -0.819 17.730 1.047 1245 HE2 LYS 160 HE3 LYS 160 0.395 20.130 0.968 1246 HE3 LYS 160 HE2 LYS 160 -0.279 20.078 -0.660 1247 HZ1 LYS 160 HZ1 LYS 160 -2.433 19.960 0.150 1248 HZ2 LYS 160 HZ2 LYS 160 -1.699 21.053 1.210 1249 HZ3 LYS 160 HZ3 LYS 160 -1.951 19.451 1.690 1250 H LYS 161 H LYS 161 3.650 19.107 1.910 1251 HA LYS 161 HA LYS 161 3.451 20.272 4.564 1252 HB2 LYS 161 HB3 LYS 161 4.973 20.802 2.118 1253 HB3 LYS 161 HB2 LYS 161 4.385 22.263 2.901 1254 HG2 LYS 161 HG3 LYS 161 5.622 21.891 4.820 1255 HG3 LYS 161 HG2 LYS 161 5.791 20.164 4.497 1256 HD2 LYS 161 HD3 LYS 161 7.887 20.870 3.919 1257 HD3 LYS 161 HD2 LYS 161 7.075 21.053 2.363 1258 HE2 LYS 161 HE3 LYS 161 6.550 23.456 3.301 1259 HE3 LYS 161 HE2 LYS 161 7.961 23.130 4.306 1260 HZ1 LYS 161 HZ1 LYS 161 9.262 22.744 2.325 1261 HZ2 LYS 161 HZ2 LYS 161 8.537 24.270 2.239 1262 HZ3 LYS 161 HZ3 LYS 161 7.907 22.984 1.339 1263 H ALA 162 H ALA 162 1.925 21.648 5.215 1264 HA ALA 162 HA ALA 162 0.057 22.946 5.227 1265 HB1 ALA 162 HB1 ALA 162 0.930 23.708 2.443 1266 HB2 ALA 162 HB2 ALA 162 1.513 24.451 3.932 1267 HB3 ALA 162 HB3 ALA 162 -0.184 24.602 3.477 1268 H51A NDP 170 H51A NDP 170 -6.564 -2.713 -8.148 1269 H52A NDP 170 H52A NDP 170 -5.725 -1.220 -8.601 1270 H4B NDP 170 H4B NDP 170 -7.516 -2.833 -10.470 1271 H3B NDP 170 H3B NDP 170 -6.053 -0.213 -10.858 1272 HO3A NDP 170 HO3A NDP 170 -5.231 -2.125 -11.858 1273 H2B NDP 170 H2B NDP 170 -7.906 0.493 -12.206 1274 H1B NDP 170 H1B NDP 170 -9.869 -0.407 -10.482 1275 H8A NDP 170 H8A NDP 170 -6.559 1.112 -9.186 1276 H61A NDP 170 H61A NDP 170 -8.404 5.478 -8.060 1277 H62A NDP 170 H62A NDP 170 -9.957 6.228 -8.341 1278 H2A NDP 170 H2A NDP 170 -12.598 3.093 -10.171 1279 H51N NDP 170 H51N NDP 170 -1.583 -4.777 -7.329 1280 H52N NDP 170 H52N NDP 170 -1.821 -5.580 -8.891 1281 H4D NDP 170 H4D NDP 170 0.522 -6.357 -8.873 1282 H3D NDP 170 H3D NDP 170 -1.023 -7.015 -6.353 1283 HO3N NDP 170 HO3N NDP 170 -0.205 -8.388 -8.726 1284 H2D NDP 170 H2D NDP 170 0.937 -8.163 -5.594 1285 HO2N NDP 170 HO2N NDP 170 2.734 -8.510 -6.943 1286 H1D NDP 170 H1D NDP 170 2.727 -6.202 -6.387 1287 H2N NDP 170 H2N NDP 170 3.340 -5.638 -4.156 1288 H71N NDP 170 H71N NDP 170 5.289 -4.790 -1.753 1289 H72N NDP 170 H72N NDP 170 4.736 -5.648 -3.169 1290 H41N NDP 170 H41N NDP 170 0.504 -3.706 -2.137 1291 H42N NDP 170 H42N NDP 170 0.356 -5.392 -1.533 1292 H5N NDP 170 H5N NDP 170 -1.461 -4.850 -3.150 1293 H6N NDP 170 H6N NDP 170 -0.839 -5.719 -5.414 Start of MODEL 14 1 H1 THR 1 HT1 THR 1 -5.738 8.995 5.693 2 H2 THR 1 HT2 THR 1 -4.436 10.112 5.717 3 H3 THR 1 HT3 THR 1 -4.204 8.510 6.285 4 HA THR 1 HA THR 1 -4.813 7.756 4.013 5 HB THR 1 HB THR 1 -4.675 9.364 2.241 6 HG1 THR 1 HG1 THR 1 -4.138 11.354 4.183 7 HG21 THR 1 HG21 THR 1 -6.264 10.925 4.218 8 HG22 THR 1 HG22 THR 1 -6.804 9.322 3.719 9 HG23 THR 1 HG23 THR 1 -6.592 10.595 2.517 10 H ALA 2 H ALA 2 -3.030 6.508 4.362 11 HA ALA 2 HA ALA 2 -0.436 7.768 3.783 12 HB1 ALA 2 HB1 ALA 2 -0.379 5.497 5.660 13 HB2 ALA 2 HB2 ALA 2 -1.061 6.998 6.287 14 HB3 ALA 2 HB3 ALA 2 0.578 6.978 5.637 15 H PHE 3 H PHE 3 1.062 6.478 2.686 16 HA PHE 3 HA PHE 3 -0.116 4.138 1.351 17 HB2 PHE 3 HB3 PHE 3 2.104 6.024 0.569 18 HB3 PHE 3 HB2 PHE 3 1.843 4.494 -0.253 19 HD1 PHE 3 HD1 PHE 3 -1.216 5.970 0.838 20 HD2 PHE 3 HD2 PHE 3 1.716 6.065 -2.244 21 HE1 PHE 3 HE1 PHE 3 -2.833 7.055 -0.662 22 HE2 PHE 3 HE2 PHE 3 0.103 7.148 -3.750 23 HZ PHE 3 HZ PHE 3 -2.171 7.644 -2.958 24 H LEU 4 H LEU 4 0.516 2.208 2.103 25 HA LEU 4 HA LEU 4 3.280 1.962 3.097 26 HB2 LEU 4 HB3 LEU 4 1.737 1.780 4.952 27 HB3 LEU 4 HB2 LEU 4 0.794 0.575 4.095 28 HG LEU 4 HG LEU 4 2.565 -1.044 4.280 29 HD11 LEU 4 HD11 LEU 4 4.574 -0.298 5.773 30 HD12 LEU 4 HD12 LEU 4 4.157 1.311 5.184 31 HD13 LEU 4 HD13 LEU 4 4.582 0.036 4.041 32 HD21 LEU 4 HD21 LEU 4 2.207 -1.559 6.455 33 HD22 LEU 4 HD22 LEU 4 1.038 -0.245 6.323 34 HD23 LEU 4 HD23 LEU 4 2.628 0.057 7.023 35 H TRP 5 H TRP 5 4.452 0.826 1.705 36 HA TRP 5 HA TRP 5 3.567 -1.769 0.850 37 HB2 TRP 5 HB3 TRP 5 3.335 -1.442 -1.438 38 HB3 TRP 5 HB2 TRP 5 2.577 0.001 -0.781 39 HD1 TRP 5 HD1 TRP 5 5.574 -1.146 -2.819 40 HE1 TRP 5 HE1 TRP 5 6.733 0.913 -3.839 41 HE3 TRP 5 HE3 TRP 5 3.017 2.535 -0.355 42 HZ2 TRP 5 HZ2 TRP 5 6.588 3.722 -3.626 43 HZ3 TRP 5 HZ3 TRP 5 3.592 4.883 -0.825 44 HH2 TRP 5 HH2 TRP 5 5.338 5.461 -2.427 45 H ALA 6 H ALA 6 5.235 -2.962 -0.312 46 HA ALA 6 HA ALA 6 7.907 -2.044 0.484 47 HB1 ALA 6 HB1 ALA 6 7.944 -4.122 1.324 48 HB2 ALA 6 HB2 ALA 6 8.227 -4.634 -0.340 49 HB3 ALA 6 HB3 ALA 6 6.592 -4.651 0.322 50 H GLN 7 H GLN 7 9.596 -1.891 -0.979 51 HA GLN 7 HA GLN 7 9.123 -2.609 -3.757 52 HB2 GLN 7 HB3 GLN 7 9.738 -0.330 -4.551 53 HB3 GLN 7 HB2 GLN 7 8.195 -0.393 -3.710 54 HG2 GLN 7 HG3 GLN 7 10.236 0.157 -1.810 55 HG3 GLN 7 HG2 GLN 7 10.428 1.252 -3.178 56 HE21 GLN 7 HE21 GLN 7 8.035 0.005 -0.896 57 HE22 GLN 7 HE22 GLN 7 7.081 1.444 -0.837 58 H ASP 8 H ASP 8 11.026 -2.509 -5.087 59 HA ASP 8 HA ASP 8 13.397 -3.214 -3.625 60 HB2 ASP 8 HB3 ASP 8 12.394 -3.989 -6.027 61 HB3 ASP 8 HB2 ASP 8 13.600 -2.813 -6.544 62 H ARG 9 H ARG 9 15.543 -2.312 -4.693 63 HA ARG 9 HA ARG 9 15.764 0.354 -3.863 64 HB2 ARG 9 HB3 ARG 9 17.537 -1.645 -5.112 65 HB3 ARG 9 HB2 ARG 9 17.991 0.032 -5.383 66 HG2 ARG 9 HG3 ARG 9 17.315 -0.703 -2.607 67 HG3 ARG 9 HG2 ARG 9 18.797 -1.394 -3.269 68 HD2 ARG 9 HD3 ARG 9 18.124 1.541 -3.354 69 HD3 ARG 9 HD2 ARG 9 19.091 0.792 -2.084 70 HE ARG 9 HE ARG 9 20.196 0.129 -4.575 71 HH11 ARG 9 HH11 ARG 9 19.774 2.899 -2.494 72 HH12 ARG 9 HH12 ARG 9 21.193 3.706 -3.072 73 HH21 ARG 9 HH21 ARG 9 22.062 1.189 -5.336 74 HH22 ARG 9 HH22 ARG 9 22.492 2.736 -4.686 75 H ASP 10 H ASP 10 14.854 -0.970 -6.917 76 HA ASP 10 HA ASP 10 15.424 1.515 -8.328 77 HB2 ASP 10 HB3 ASP 10 14.115 -1.041 -9.291 78 HB3 ASP 10 HB2 ASP 10 14.548 0.330 -10.309 79 H GLY 11 H GLY 11 12.734 -0.377 -7.144 80 HA2 GLY 11 HA3 GLY 11 10.957 1.347 -6.306 81 HA3 GLY 11 HA2 GLY 11 10.845 1.693 -8.024 82 H LEU 12 H LEU 12 11.516 -1.522 -7.881 83 HA LEU 12 HA LEU 12 9.117 -2.432 -8.855 84 HB2 LEU 12 HB3 LEU 12 11.449 -3.615 -8.475 85 HB3 LEU 12 HB2 LEU 12 10.669 -4.215 -7.026 86 HG LEU 12 HG LEU 12 8.963 -5.345 -8.340 87 HD11 LEU 12 HD11 LEU 12 10.296 -3.974 -10.668 88 HD12 LEU 12 HD12 LEU 12 8.613 -3.856 -10.152 89 HD13 LEU 12 HD13 LEU 12 9.219 -5.359 -10.848 90 HD21 LEU 12 HD21 LEU 12 10.382 -6.948 -9.540 91 HD22 LEU 12 HD22 LEU 12 11.034 -6.547 -7.951 92 HD23 LEU 12 HD23 LEU 12 11.745 -5.837 -9.401 93 H ILE 13 H ILE 13 7.721 -4.153 -7.678 94 HA ILE 13 HA ILE 13 7.267 -3.664 -4.885 95 HB ILE 13 HB ILE 13 4.925 -3.020 -5.071 96 HG12 ILE 13 HG13 ILE 13 5.241 -2.367 -7.973 97 HG13 ILE 13 HG12 ILE 13 4.825 -4.013 -7.517 98 HG21 ILE 13 HG21 ILE 13 5.237 -0.716 -5.700 99 HG22 ILE 13 HG22 ILE 13 6.677 -1.130 -6.630 100 HG23 ILE 13 HG23 ILE 13 6.682 -1.300 -4.875 101 HD11 ILE 13 HD11 ILE 13 2.853 -3.215 -6.354 102 HD12 ILE 13 HD12 ILE 13 2.852 -2.691 -8.038 103 HD13 ILE 13 HD13 ILE 13 3.276 -1.552 -6.761 104 H GLY 14 H GLY 14 6.324 -5.173 -7.897 105 HA2 GLY 14 HA3 GLY 14 5.993 -7.708 -6.532 106 HA3 GLY 14 HA2 GLY 14 4.550 -7.077 -7.312 107 H LYS 15 H LYS 15 5.145 -9.352 -8.271 108 HA LYS 15 HA LYS 15 6.443 -8.812 -10.844 109 HB2 LYS 15 HB3 LYS 15 7.419 -11.044 -10.879 110 HB3 LYS 15 HB2 LYS 15 7.993 -10.153 -9.477 111 HG2 LYS 15 HG3 LYS 15 7.411 -11.888 -8.238 112 HG3 LYS 15 HG2 LYS 15 5.725 -11.502 -8.586 113 HD2 LYS 15 HD3 LYS 15 6.474 -12.852 -10.839 114 HD3 LYS 15 HD2 LYS 15 7.417 -13.675 -9.596 115 HE2 LYS 15 HE3 LYS 15 4.981 -13.466 -8.393 116 HE3 LYS 15 HE2 LYS 15 4.524 -13.670 -10.083 117 HZ1 LYS 15 HZ1 LYS 15 4.725 -15.834 -9.546 118 HZ2 LYS 15 HZ2 LYS 15 5.794 -15.550 -8.266 119 HZ3 LYS 15 HZ3 LYS 15 6.366 -15.563 -9.858 120 H ASP 16 H ASP 16 4.094 -8.375 -11.226 121 HA ASP 16 HA ASP 16 2.177 -8.929 -12.311 122 HB2 ASP 16 HB3 ASP 16 3.836 -11.365 -12.772 123 HB3 ASP 16 HB2 ASP 16 2.112 -11.464 -13.114 124 H GLY 17 H GLY 17 2.306 -9.057 -9.495 125 HA2 GLY 17 HA3 GLY 17 -0.136 -10.267 -8.883 126 HA3 GLY 17 HA2 GLY 17 1.134 -11.389 -8.417 127 H HIS 18 H HIS 18 2.979 -10.221 -7.133 128 HA HIS 18 HA HIS 18 2.362 -7.950 -5.575 129 HB2 HIS 18 HB3 HIS 18 1.870 -9.000 -3.424 130 HB3 HIS 18 HB2 HIS 18 0.663 -9.464 -4.617 131 HD1 HIS 18 HD1 HIS 18 0.606 -11.936 -5.354 132 HD2 HIS 18 HD2 HIS 18 3.499 -11.088 -2.495 133 HE1 HIS 18 HE1 HIS 18 1.394 -14.170 -4.512 134 HE2 HIS 18 HE2 HIS 18 3.205 -13.633 -2.846 135 H LEU 19 H LEU 19 3.699 -8.572 -3.205 136 HA LEU 19 HA LEU 19 6.391 -8.405 -4.046 137 HB2 LEU 19 HB3 LEU 19 6.160 -9.212 -1.274 138 HB3 LEU 19 HB2 LEU 19 6.788 -7.726 -1.956 139 HG LEU 19 HG LEU 19 4.242 -7.108 -2.190 140 HD11 LEU 19 HD11 LEU 19 2.796 -8.086 -0.613 141 HD12 LEU 19 HD12 LEU 19 4.116 -8.930 0.196 142 HD13 LEU 19 HD13 LEU 19 3.597 -9.440 -1.410 143 HD21 LEU 19 HD21 LEU 19 5.308 -5.643 -0.853 144 HD22 LEU 19 HD22 LEU 19 6.141 -6.905 0.053 145 HD23 LEU 19 HD23 LEU 19 4.459 -6.521 0.419 146 HA PRO 20 HA PRO 20 6.922 -12.881 -4.191 147 HB2 PRO 20 HB3 PRO 20 8.893 -12.941 -5.968 148 HB3 PRO 20 HB2 PRO 20 7.258 -12.470 -6.451 149 HG2 PRO 20 HG3 PRO 20 9.653 -10.760 -5.945 150 HG3 PRO 20 HG2 PRO 20 8.395 -10.589 -7.180 151 HD2 PRO 20 HD3 PRO 20 8.512 -9.210 -4.743 152 HD3 PRO 20 HD2 PRO 20 7.095 -9.334 -5.803 153 H TRP 21 H TRP 21 8.348 -10.951 -2.230 154 HA TRP 21 HA TRP 21 10.716 -12.655 -1.807 155 HB2 TRP 21 HB3 TRP 21 11.647 -10.597 -0.584 156 HB3 TRP 21 HB2 TRP 21 11.612 -10.549 -2.343 157 HD1 TRP 21 HD1 TRP 21 9.030 -9.535 0.392 158 HE1 TRP 21 HE1 TRP 21 8.129 -7.201 -0.213 159 HE3 TRP 21 HE3 TRP 21 11.729 -8.701 -3.869 160 HZ2 TRP 21 HZ2 TRP 21 8.512 -5.263 -2.229 161 HZ3 TRP 21 HZ3 TRP 21 11.403 -6.583 -5.077 162 HH2 TRP 21 HH2 TRP 21 9.826 -4.900 -4.273 163 H HIS 22 H HIS 22 11.297 -13.116 0.363 164 HA HIS 22 HA HIS 22 8.992 -13.257 2.132 165 HB2 HIS 22 HB3 HIS 22 10.566 -15.214 1.654 166 HB3 HIS 22 HB2 HIS 22 11.741 -14.379 2.665 167 HD1 HIS 22 HD1 HIS 22 10.031 -17.166 3.137 168 HD2 HIS 22 HD2 HIS 22 9.682 -13.520 5.101 169 HE1 HIS 22 HE1 HIS 22 8.988 -17.698 5.363 170 HE2 HIS 22 HE2 HIS 22 8.866 -15.489 6.567 171 H LEU 23 H LEU 23 8.734 -11.207 2.951 172 HA LEU 23 HA LEU 23 10.986 -10.128 4.510 173 HB2 LEU 23 HB3 LEU 23 9.065 -8.904 2.699 174 HB3 LEU 23 HB2 LEU 23 9.126 -8.090 4.251 175 HG LEU 23 HG LEU 23 11.602 -7.893 3.975 176 HD11 LEU 23 HD11 LEU 23 11.237 -8.465 1.075 177 HD12 LEU 23 HD12 LEU 23 11.534 -9.796 2.193 178 HD13 LEU 23 HD13 LEU 23 12.705 -8.484 2.053 179 HD21 LEU 23 HD21 LEU 23 10.098 -6.034 3.475 180 HD22 LEU 23 HD22 LEU 23 9.918 -6.621 1.822 181 HD23 LEU 23 HD23 LEU 23 11.486 -6.046 2.389 182 HA PRO 24 HA PRO 24 8.065 -11.518 7.769 183 HB2 PRO 24 HB3 PRO 24 10.499 -11.125 9.402 184 HB3 PRO 24 HB2 PRO 24 9.440 -12.533 9.282 185 HG2 PRO 24 HG3 PRO 24 11.883 -12.540 8.194 186 HG3 PRO 24 HG2 PRO 24 10.517 -13.352 7.406 187 HD2 PRO 24 HD3 PRO 24 11.777 -10.712 6.770 188 HD3 PRO 24 HD2 PRO 24 11.180 -11.971 5.669 189 H ASP 25 H ASP 25 10.590 -9.040 8.259 190 HA ASP 25 HA ASP 25 9.287 -7.620 10.268 191 HB2 ASP 25 HB3 ASP 25 10.772 -5.709 9.434 192 HB3 ASP 25 HB2 ASP 25 11.576 -7.172 9.976 193 H ASP 26 H ASP 26 8.812 -7.628 6.826 194 HA ASP 26 HA ASP 26 7.356 -5.137 6.793 195 HB2 ASP 26 HB3 ASP 26 8.726 -6.248 4.867 196 HB3 ASP 26 HB2 ASP 26 7.244 -7.152 4.575 197 H LEU 27 H LEU 27 6.463 -8.544 6.167 198 HA LEU 27 HA LEU 27 3.732 -8.176 5.969 199 HB2 LEU 27 HB3 LEU 27 3.601 -10.580 6.646 200 HB3 LEU 27 HB2 LEU 27 4.660 -10.241 5.300 201 HG LEU 27 HG LEU 27 6.480 -10.168 7.243 202 HD11 LEU 27 HD11 LEU 27 4.267 -10.905 8.697 203 HD12 LEU 27 HD12 LEU 27 5.947 -11.145 9.176 204 HD13 LEU 27 HD13 LEU 27 5.064 -12.446 8.377 205 HD21 LEU 27 HD21 LEU 27 5.426 -12.269 5.485 206 HD22 LEU 27 HD22 LEU 27 6.403 -12.850 6.833 207 HD23 LEU 27 HD23 LEU 27 7.076 -11.683 5.696 208 H HIS 28 H HIS 28 5.663 -8.947 8.860 209 HA HIS 28 HA HIS 28 3.524 -9.115 10.663 210 HB2 HIS 28 HB3 HIS 28 6.340 -9.249 10.798 211 HB3 HIS 28 HB2 HIS 28 5.852 -8.012 11.951 212 HD1 HIS 28 HD1 HIS 28 7.020 -10.872 12.682 213 HD2 HIS 28 HD2 HIS 28 3.018 -9.757 12.765 214 HE1 HIS 28 HE1 HIS 28 5.914 -12.460 14.287 215 HE2 HIS 28 HE2 HIS 28 3.476 -11.823 14.253 216 H TYR 29 H TYR 29 5.721 -6.373 10.052 217 HA TYR 29 HA TYR 29 4.394 -4.531 11.690 218 HB2 TYR 29 HB3 TYR 29 6.709 -4.415 10.447 219 HB3 TYR 29 HB2 TYR 29 5.765 -3.633 9.184 220 HD1 TYR 29 HD1 TYR 29 6.259 -3.431 12.885 221 HD2 TYR 29 HD2 TYR 29 5.603 -1.333 9.243 222 HE1 TYR 29 HE1 TYR 29 6.433 -1.295 14.091 223 HE2 TYR 29 HE2 TYR 29 5.775 0.809 10.438 224 HH TYR 29 HH TYR 29 5.566 1.702 12.658 225 H PHE 30 H PHE 30 3.653 -5.710 8.517 226 HA PHE 30 HA PHE 30 2.080 -3.611 7.544 227 HB2 PHE 30 HB3 PHE 30 2.848 -6.037 6.577 228 HB3 PHE 30 HB2 PHE 30 1.143 -6.334 6.902 229 HD1 PHE 30 HD2 PHE 30 -0.446 -4.362 6.058 230 HD2 PHE 30 HD1 PHE 30 3.407 -5.270 4.496 231 HE1 PHE 30 HE2 PHE 30 -1.043 -3.249 3.947 232 HE2 PHE 30 HE1 PHE 30 2.817 -4.158 2.382 233 HZ PHE 30 HZ PHE 30 0.589 -3.145 2.105 234 H ARG 31 H ARG 31 1.014 -6.590 9.193 235 HA ARG 31 HA ARG 31 -1.639 -5.530 9.573 236 HB2 ARG 31 HB3 ARG 31 -0.891 -8.011 9.227 237 HB3 ARG 31 HB2 ARG 31 -0.613 -7.979 10.963 238 HG2 ARG 31 HG3 ARG 31 -3.102 -6.932 10.837 239 HG3 ARG 31 HG2 ARG 31 -3.128 -8.023 9.450 240 HD2 ARG 31 HD3 ARG 31 -3.915 -9.184 11.419 241 HD3 ARG 31 HD2 ARG 31 -2.367 -9.855 10.909 242 HE ARG 31 HE ARG 31 -2.130 -7.805 12.907 243 HH11 ARG 31 HH11 ARG 31 -2.647 -11.212 12.356 244 HH12 ARG 31 HH12 ARG 31 -2.070 -11.680 13.920 245 HH21 ARG 31 HH21 ARG 31 -1.371 -8.418 14.965 246 HH22 ARG 31 HH22 ARG 31 -1.346 -10.094 15.402 247 H ALA 32 H ALA 32 1.301 -5.777 11.413 248 HA ALA 32 HA ALA 32 0.273 -5.488 14.006 249 HB1 ALA 32 HB1 ALA 32 2.902 -4.362 13.073 250 HB2 ALA 32 HB2 ALA 32 2.637 -6.084 13.347 251 HB3 ALA 32 HB3 ALA 32 2.472 -4.943 14.682 252 H GLN 33 H GLN 33 0.924 -3.144 11.483 253 HA GLN 33 HA GLN 33 0.356 -0.913 13.269 254 HB2 GLN 33 HB3 GLN 33 1.379 -1.169 10.467 255 HB3 GLN 33 HB2 GLN 33 0.680 0.355 10.995 256 HG2 GLN 33 HG3 GLN 33 2.681 -0.809 12.805 257 HG3 GLN 33 HG2 GLN 33 3.285 -0.289 11.233 258 HE21 GLN 33 HE21 GLN 33 3.644 1.810 10.898 259 HE22 GLN 33 HE22 GLN 33 3.224 3.078 11.993 260 H THR 34 H THR 34 -1.123 -2.743 10.690 261 HA THR 34 HA THR 34 -3.391 -0.903 10.573 262 HB THR 34 HB THR 34 -4.145 -2.288 8.683 263 HG1 THR 34 HG1 THR 34 -2.471 -3.871 7.961 264 HG21 THR 34 HG21 THR 34 -2.056 -0.555 8.613 265 HG22 THR 34 HG22 THR 34 -2.803 -1.301 7.200 266 HG23 THR 34 HG23 THR 34 -1.345 -2.004 7.901 267 H VAL 35 H VAL 35 -3.157 -2.157 13.017 268 HA VAL 35 HA VAL 35 -4.904 -4.469 13.057 269 HB VAL 35 HB VAL 35 -3.879 -2.923 15.437 270 HG11 VAL 35 HG11 VAL 35 -5.354 -5.441 15.029 271 HG12 VAL 35 HG12 VAL 35 -5.350 -4.335 16.402 272 HG13 VAL 35 HG13 VAL 35 -4.043 -5.502 16.207 273 HG21 VAL 35 HG21 VAL 35 -1.967 -4.324 15.511 274 HG22 VAL 35 HG22 VAL 35 -2.062 -3.694 13.867 275 HG23 VAL 35 HG23 VAL 35 -2.578 -5.345 14.210 276 H GLY 36 H GLY 36 -6.982 -3.995 12.591 277 HA2 GLY 36 HA3 GLY 36 -9.129 -3.362 13.263 278 HA3 GLY 36 HA2 GLY 36 -8.416 -2.305 14.470 279 H LYS 37 H LYS 37 -6.716 -1.495 11.866 280 HA LYS 37 HA LYS 37 -8.322 0.850 11.364 281 HB2 LYS 37 HB3 LYS 37 -5.551 -0.009 10.849 282 HB3 LYS 37 HB2 LYS 37 -6.238 1.036 9.614 283 HG2 LYS 37 HG3 LYS 37 -6.127 2.842 10.917 284 HG3 LYS 37 HG2 LYS 37 -6.738 1.976 12.328 285 HD2 LYS 37 HD3 LYS 37 -4.584 1.162 12.877 286 HD3 LYS 37 HD2 LYS 37 -3.924 1.644 11.313 287 HE2 LYS 37 HE3 LYS 37 -4.801 4.026 12.210 288 HE3 LYS 37 HE2 LYS 37 -4.422 3.244 13.744 289 HZ1 LYS 37 HZ1 LYS 37 -2.197 3.015 13.163 290 HZ2 LYS 37 HZ2 LYS 37 -2.588 4.557 12.589 291 HZ3 LYS 37 HZ3 LYS 37 -2.486 3.256 11.513 292 H ILE 38 H ILE 38 -7.963 1.499 8.786 293 HA ILE 38 HA ILE 38 -9.253 -0.699 7.307 294 HB ILE 38 HB ILE 38 -9.887 1.800 6.080 295 HG12 ILE 38 HG13 ILE 38 -10.911 1.680 8.914 296 HG13 ILE 38 HG12 ILE 38 -9.490 2.623 8.478 297 HG21 ILE 38 HG21 ILE 38 -11.832 0.113 7.600 298 HG22 ILE 38 HG22 ILE 38 -11.056 -0.502 6.141 299 HG23 ILE 38 HG23 ILE 38 -12.043 0.957 6.066 300 HD11 ILE 38 HD11 ILE 38 -11.117 3.616 6.671 301 HD12 ILE 38 HD12 ILE 38 -11.100 4.219 8.329 302 HD13 ILE 38 HD13 ILE 38 -12.344 3.077 7.819 303 H MET 39 H MET 39 -8.250 -1.364 5.533 304 HA MET 39 HA MET 39 -6.190 0.387 4.357 305 HB2 MET 39 HB3 MET 39 -5.116 -1.516 5.306 306 HB3 MET 39 HB2 MET 39 -6.307 -2.614 4.627 307 HG2 MET 39 HG3 MET 39 -4.677 -0.967 2.767 308 HG3 MET 39 HG2 MET 39 -3.915 -2.338 3.571 309 HE1 MET 39 HE1 MET 39 -6.992 -4.603 3.142 310 HE2 MET 39 HE2 MET 39 -5.491 -4.325 4.025 311 HE3 MET 39 HE3 MET 39 -5.492 -5.348 2.588 312 H VAL 40 H VAL 40 -6.301 0.865 2.242 313 HA VAL 40 HA VAL 40 -8.595 -0.157 0.743 314 HB VAL 40 HB VAL 40 -6.734 2.081 -0.049 315 HG11 VAL 40 HG11 VAL 40 -8.090 2.463 -1.808 316 HG12 VAL 40 HG12 VAL 40 -9.548 2.026 -0.916 317 HG13 VAL 40 HG13 VAL 40 -8.514 0.765 -1.589 318 HG21 VAL 40 HG21 VAL 40 -9.405 2.360 1.318 319 HG22 VAL 40 HG22 VAL 40 -8.266 3.642 0.908 320 HG23 VAL 40 HG23 VAL 40 -7.858 2.467 2.158 321 H VAL 41 H VAL 41 -8.383 -1.621 -0.811 322 HA VAL 41 HA VAL 41 -5.714 -2.032 -1.989 323 HB VAL 41 HB VAL 41 -6.746 -3.847 -0.401 324 HG11 VAL 41 HG11 VAL 41 -8.059 -5.539 -1.529 325 HG12 VAL 41 HG12 VAL 41 -8.069 -4.581 -3.009 326 HG13 VAL 41 HG13 VAL 41 -8.902 -3.991 -1.572 327 HG21 VAL 41 HG21 VAL 41 -5.088 -4.001 -2.793 328 HG22 VAL 41 HG22 VAL 41 -5.818 -5.542 -2.342 329 HG23 VAL 41 HG23 VAL 41 -4.823 -4.665 -1.181 330 H GLY 42 H GLY 42 -5.640 -2.713 -4.198 331 HA2 GLY 42 HA3 GLY 42 -7.755 -1.523 -5.775 332 HA3 GLY 42 HA2 GLY 42 -6.235 -2.159 -6.381 333 H ARG 43 H ARG 43 -8.375 -2.679 -7.865 334 HA ARG 43 HA ARG 43 -9.903 -4.925 -7.222 335 HB2 ARG 43 HB3 ARG 43 -10.445 -3.424 -9.082 336 HB3 ARG 43 HB2 ARG 43 -9.020 -3.978 -9.950 337 HG2 ARG 43 HG3 ARG 43 -10.197 -6.336 -9.558 338 HG3 ARG 43 HG2 ARG 43 -11.628 -5.306 -9.536 339 HD2 ARG 43 HD3 ARG 43 -9.559 -5.433 -11.727 340 HD3 ARG 43 HD2 ARG 43 -11.176 -6.134 -11.783 341 HE ARG 43 HE ARG 43 -11.082 -3.285 -11.292 342 HH11 ARG 43 HH11 ARG 43 -11.327 -5.815 -13.688 343 HH12 ARG 43 HH12 ARG 43 -12.064 -4.791 -14.872 344 HH21 ARG 43 HH21 ARG 43 -12.046 -1.940 -12.852 345 HH22 ARG 43 HH22 ARG 43 -12.472 -2.592 -14.400 346 H ARG 44 H ARG 44 -7.111 -4.807 -9.436 347 HA ARG 44 HA ARG 44 -6.809 -7.564 -9.718 348 HB2 ARG 44 HB3 ARG 44 -5.131 -5.181 -10.218 349 HB3 ARG 44 HB2 ARG 44 -4.267 -6.704 -10.061 350 HG2 ARG 44 HG3 ARG 44 -5.551 -7.671 -11.855 351 HG3 ARG 44 HG2 ARG 44 -6.550 -6.221 -11.963 352 HD2 ARG 44 HD3 ARG 44 -3.584 -6.377 -12.492 353 HD3 ARG 44 HD2 ARG 44 -4.848 -6.261 -13.715 354 HE ARG 44 HE ARG 44 -5.212 -4.095 -12.057 355 HH11 ARG 44 HH11 ARG 44 -2.651 -5.312 -14.091 356 HH12 ARG 44 HH12 ARG 44 -2.009 -3.742 -14.436 357 HH21 ARG 44 HH21 ARG 44 -4.369 -2.029 -12.509 358 HH22 ARG 44 HH22 ARG 44 -2.984 -1.877 -13.538 359 H THR 45 H THR 45 -6.025 -5.516 -7.075 360 HA THR 45 HA THR 45 -4.005 -7.199 -5.942 361 HB THR 45 HB THR 45 -5.575 -5.221 -4.334 362 HG1 THR 45 HG1 THR 45 -5.213 -3.987 -6.079 363 HG21 THR 45 HG21 THR 45 -3.181 -4.628 -3.643 364 HG22 THR 45 HG22 THR 45 -2.737 -6.160 -4.396 365 HG23 THR 45 HG23 THR 45 -3.875 -6.136 -3.049 366 H TYR 46 H TYR 46 -7.394 -6.475 -4.978 367 HA TYR 46 HA TYR 46 -7.608 -8.201 -2.858 368 HB2 TYR 46 HB3 TYR 46 -9.977 -8.183 -3.141 369 HB3 TYR 46 HB2 TYR 46 -9.396 -6.617 -3.687 370 HD1 TYR 46 HD2 TYR 46 -10.019 -10.001 -5.197 371 HD2 TYR 46 HD1 TYR 46 -10.450 -5.780 -5.560 372 HE1 TYR 46 HE2 TYR 46 -11.169 -10.312 -7.331 373 HE2 TYR 46 HE1 TYR 46 -11.623 -6.089 -7.696 374 HH TYR 46 HH TYR 46 -11.607 -8.006 -9.550 375 H GLU 47 H GLU 47 -7.699 -8.969 -6.271 376 HA GLU 47 HA GLU 47 -8.344 -11.755 -5.797 377 HB2 GLU 47 HB3 GLU 47 -7.582 -11.728 -8.382 378 HB3 GLU 47 HB2 GLU 47 -9.205 -11.321 -7.848 379 HG2 GLU 47 HG3 GLU 47 -8.841 -9.032 -8.120 380 HG3 GLU 47 HG2 GLU 47 -7.088 -9.223 -8.150 381 H SER 48 H SER 48 -5.556 -9.792 -6.250 382 HA SER 48 HA SER 48 -3.842 -12.185 -6.378 383 HB2 SER 48 HB3 SER 48 -3.200 -9.328 -7.148 384 HB3 SER 48 HB2 SER 48 -2.079 -10.686 -7.245 385 HG SER 48 HG SER 48 -4.579 -10.690 -8.569 386 H PHE 49 H PHE 49 -5.037 -11.188 -3.930 387 HA PHE 49 HA PHE 49 -2.723 -10.091 -2.502 388 HB2 PHE 49 HB3 PHE 49 -5.304 -9.306 -2.382 389 HB3 PHE 49 HB2 PHE 49 -5.282 -10.476 -1.068 390 HD1 PHE 49 HD1 PHE 49 -2.936 -7.845 -2.310 391 HD2 PHE 49 HD2 PHE 49 -5.063 -9.501 0.983 392 HE1 PHE 49 HE1 PHE 49 -1.941 -6.156 -0.823 393 HE2 PHE 49 HE2 PHE 49 -4.073 -7.815 2.475 394 HZ PHE 49 HZ PHE 49 -2.510 -6.139 1.573 395 HA PRO 50 HA PRO 50 -1.811 -14.183 -0.960 396 HB2 PRO 50 HB3 PRO 50 -0.372 -12.722 1.172 397 HB3 PRO 50 HB2 PRO 50 0.232 -13.922 0.025 398 HG2 PRO 50 HG3 PRO 50 0.854 -11.333 -0.221 399 HG3 PRO 50 HG2 PRO 50 0.568 -12.355 -1.642 400 HD2 PRO 50 HD3 PRO 50 -1.238 -10.344 -0.356 401 HD3 PRO 50 HD2 PRO 50 -0.964 -10.677 -2.079 402 H LYS 51 H LYS 51 -3.123 -11.591 0.995 403 HA LYS 51 HA LYS 51 -4.549 -13.578 2.601 404 HB2 LYS 51 HB3 LYS 51 -2.559 -11.632 3.601 405 HB3 LYS 51 HB2 LYS 51 -4.052 -11.734 4.523 406 HG2 LYS 51 HG3 LYS 51 -2.609 -14.240 3.804 407 HG3 LYS 51 HG2 LYS 51 -2.012 -13.238 5.128 408 HD2 LYS 51 HD3 LYS 51 -4.907 -13.755 5.162 409 HD3 LYS 51 HD2 LYS 51 -3.891 -15.179 5.394 410 HE2 LYS 51 HE3 LYS 51 -2.649 -13.822 7.145 411 HE3 LYS 51 HE2 LYS 51 -3.970 -12.659 7.034 412 HZ1 LYS 51 HZ1 LYS 51 -4.056 -14.523 8.800 413 HZ2 LYS 51 HZ2 LYS 51 -4.562 -15.501 7.517 414 HZ3 LYS 51 HZ3 LYS 51 -5.462 -14.134 7.943 415 H ARG 52 H ARG 52 -6.317 -12.920 1.256 416 HA ARG 52 HA ARG 52 -7.438 -10.313 2.036 417 HB2 ARG 52 HB3 ARG 52 -8.714 -10.506 -0.191 418 HB3 ARG 52 HB2 ARG 52 -7.019 -10.048 -0.242 419 HG2 ARG 52 HG3 ARG 52 -6.716 -11.673 -1.717 420 HG3 ARG 52 HG2 ARG 52 -7.002 -12.826 -0.416 421 HD2 ARG 52 HD3 ARG 52 -9.218 -13.145 -1.008 422 HD3 ARG 52 HD2 ARG 52 -9.307 -11.619 -1.887 423 HE ARG 52 HE ARG 52 -7.542 -12.971 -3.360 424 HH11 ARG 52 HH11 ARG 52 -10.637 -13.934 -2.059 425 HH12 ARG 52 HH12 ARG 52 -10.964 -15.053 -3.339 426 HH21 ARG 52 HH21 ARG 52 -7.976 -14.441 -5.042 427 HH22 ARG 52 HH22 ARG 52 -9.455 -15.341 -5.031 428 HA PRO 53 HA PRO 53 -8.737 -9.437 2.941 429 HB2 PRO 53 HB3 PRO 53 -10.399 -9.044 4.994 430 HB3 PRO 53 HB2 PRO 53 -10.979 -9.025 3.326 431 HG2 PRO 53 HG3 PRO 53 -11.273 -11.121 5.409 432 HG3 PRO 53 HG2 PRO 53 -12.373 -10.677 4.093 433 HD2 PRO 53 HD3 PRO 53 -10.544 -12.833 4.122 434 HD3 PRO 53 HD2 PRO 53 -11.462 -12.236 2.727 435 H LEU 54 H LEU 54 -7.653 -8.466 4.750 436 HA LEU 54 HA LEU 54 -5.978 -10.258 6.177 437 HB2 LEU 54 HB3 LEU 54 -6.399 -7.285 6.294 438 HB3 LEU 54 HB2 LEU 54 -5.288 -8.100 7.379 439 HG LEU 54 HG LEU 54 -4.971 -8.593 4.463 440 HD11 LEU 54 HD11 LEU 54 -3.879 -6.574 4.012 441 HD12 LEU 54 HD12 LEU 54 -3.823 -6.120 5.715 442 HD13 LEU 54 HD13 LEU 54 -5.358 -6.100 4.847 443 HD21 LEU 54 HD21 LEU 54 -3.614 -9.558 6.457 444 HD22 LEU 54 HD22 LEU 54 -2.824 -7.982 6.451 445 HD23 LEU 54 HD23 LEU 54 -2.765 -9.003 5.015 446 HA PRO 55 HA PRO 55 -8.564 -10.943 9.711 447 HB2 PRO 55 HB3 PRO 55 -6.743 -12.020 11.381 448 HB3 PRO 55 HB2 PRO 55 -7.355 -12.885 9.966 449 HG2 PRO 55 HG3 PRO 55 -4.789 -11.378 10.302 450 HG3 PRO 55 HG2 PRO 55 -5.069 -12.952 9.534 451 HD2 PRO 55 HD3 PRO 55 -4.800 -10.639 8.126 452 HD3 PRO 55 HD2 PRO 55 -5.784 -12.005 7.566 453 H GLU 56 H GLU 56 -9.076 -10.082 11.677 454 HA GLU 56 HA GLU 56 -9.218 -8.506 13.299 455 HB2 GLU 56 HB3 GLU 56 -6.457 -9.462 13.315 456 HB3 GLU 56 HB2 GLU 56 -6.637 -7.864 14.023 457 HG2 GLU 56 HG3 GLU 56 -8.728 -9.347 15.094 458 HG3 GLU 56 HG2 GLU 56 -7.350 -10.446 15.088 459 H ARG 57 H ARG 57 -8.978 -7.570 10.494 460 HA ARG 57 HA ARG 57 -8.516 -4.789 11.154 461 HB2 ARG 57 HB3 ARG 57 -6.864 -4.308 9.570 462 HB3 ARG 57 HB2 ARG 57 -6.313 -5.795 10.323 463 HG2 ARG 57 HG3 ARG 57 -5.931 -6.231 8.106 464 HG3 ARG 57 HG2 ARG 57 -7.527 -6.946 8.333 465 HD2 ARG 57 HD3 ARG 57 -7.045 -5.405 6.276 466 HD3 ARG 57 HD2 ARG 57 -8.585 -5.303 7.123 467 HE ARG 57 HE ARG 57 -8.032 -3.189 7.821 468 HH11 ARG 57 HH11 ARG 57 -5.188 -4.741 6.526 469 HH12 ARG 57 HH12 ARG 57 -4.244 -3.290 6.528 470 HH21 ARG 57 HH21 ARG 57 -6.798 -1.282 7.821 471 HH22 ARG 57 HH22 ARG 57 -5.158 -1.324 7.267 472 H THR 58 H THR 58 -9.273 -3.312 9.462 473 HA THR 58 HA THR 58 -11.602 -4.446 8.113 474 HB THR 58 HB THR 58 -10.912 -1.522 8.218 475 HG1 THR 58 HG1 THR 58 -11.175 -1.533 10.282 476 HG21 THR 58 HG21 THR 58 -13.259 -1.158 8.157 477 HG22 THR 58 HG22 THR 58 -13.589 -2.878 8.358 478 HG23 THR 58 HG23 THR 58 -12.855 -2.290 6.866 479 H ASN 59 H ASN 59 -11.466 -4.995 6.040 480 HA ASN 59 HA ASN 59 -9.310 -3.877 4.417 481 HB2 ASN 59 HB3 ASN 59 -11.145 -6.239 4.006 482 HB3 ASN 59 HB2 ASN 59 -10.001 -5.680 2.789 483 HD21 ASN 59 HD21 ASN 59 -10.221 -6.766 6.138 484 HD22 ASN 59 HD22 ASN 59 -8.664 -7.512 6.185 485 H VAL 60 H VAL 60 -9.655 -3.062 2.325 486 HA VAL 60 HA VAL 60 -12.397 -2.296 1.638 487 HB VAL 60 HB VAL 60 -10.062 -0.389 1.832 488 HG11 VAL 60 HG11 VAL 60 -12.170 1.166 1.125 489 HG12 VAL 60 HG12 VAL 60 -12.482 -0.286 0.173 490 HG13 VAL 60 HG13 VAL 60 -10.948 0.568 0.003 491 HG21 VAL 60 HG21 VAL 60 -12.273 -1.025 3.554 492 HG22 VAL 60 HG22 VAL 60 -12.357 0.661 3.044 493 HG23 VAL 60 HG23 VAL 60 -10.905 0.052 3.838 494 H VAL 61 H VAL 61 -12.827 -2.648 -0.446 495 HA VAL 61 HA VAL 61 -10.578 -3.232 -2.245 496 HB VAL 61 HB VAL 61 -13.465 -4.111 -2.394 497 HG11 VAL 61 HG11 VAL 61 -11.434 -3.983 -4.435 498 HG12 VAL 61 HG12 VAL 61 -13.133 -4.437 -4.566 499 HG13 VAL 61 HG13 VAL 61 -11.927 -5.651 -4.141 500 HG21 VAL 61 HG21 VAL 61 -11.857 -5.136 -0.670 501 HG22 VAL 61 HG22 VAL 61 -11.075 -5.888 -2.060 502 HG23 VAL 61 HG23 VAL 61 -12.771 -6.227 -1.712 503 H LEU 62 H LEU 62 -10.388 -2.260 -4.208 504 HA LEU 62 HA LEU 62 -12.356 -0.170 -4.867 505 HB2 LEU 62 HB3 LEU 62 -10.079 0.608 -3.980 506 HB3 LEU 62 HB2 LEU 62 -9.422 0.029 -5.499 507 HG LEU 62 HG LEU 62 -11.094 1.575 -6.647 508 HD11 LEU 62 HD11 LEU 62 -11.687 2.114 -3.845 509 HD12 LEU 62 HD12 LEU 62 -12.631 2.462 -5.293 510 HD13 LEU 62 HD13 LEU 62 -11.358 3.570 -4.784 511 HD21 LEU 62 HD21 LEU 62 -8.854 2.680 -4.963 512 HD22 LEU 62 HD22 LEU 62 -9.659 3.569 -6.257 513 HD23 LEU 62 HD23 LEU 62 -8.757 2.099 -6.625 514 H THR 63 H THR 63 -13.468 -1.207 -6.444 515 HA THR 63 HA THR 63 -11.955 -1.964 -8.843 516 HB THR 63 HB THR 63 -12.672 -3.995 -7.617 517 HG1 THR 63 HG1 THR 63 -14.266 -3.801 -9.928 518 HG21 THR 63 HG21 THR 63 -15.369 -4.200 -8.187 519 HG22 THR 63 HG22 THR 63 -15.194 -2.596 -7.477 520 HG23 THR 63 HG23 THR 63 -14.634 -4.016 -6.594 521 H HIS 64 H HIS 64 -12.901 -1.408 -10.799 522 HA HIS 64 HA HIS 64 -14.686 0.777 -10.784 523 HB2 HIS 64 HB3 HIS 64 -13.760 -1.013 -13.034 524 HB3 HIS 64 HB2 HIS 64 -14.736 0.431 -13.275 525 HD1 HIS 64 HD1 HIS 64 -13.497 2.574 -13.530 526 HD2 HIS 64 HD2 HIS 64 -11.145 -0.408 -11.845 527 HE1 HIS 64 HE1 HIS 64 -11.184 3.548 -13.378 528 HE2 HIS 64 HE2 HIS 64 -9.803 1.764 -12.257 529 H GLN 65 H GLN 65 -15.167 -2.662 -11.146 530 HA GLN 65 HA GLN 65 -17.635 -2.825 -12.332 531 HB2 GLN 65 HB3 GLN 65 -16.271 -4.462 -10.233 532 HB3 GLN 65 HB2 GLN 65 -17.942 -4.821 -10.645 533 HG2 GLN 65 HG3 GLN 65 -17.412 -5.639 -12.685 534 HG3 GLN 65 HG2 GLN 65 -16.052 -4.537 -12.897 535 HE21 GLN 65 HE21 GLN 65 -14.081 -5.018 -11.769 536 HE22 GLN 65 HE22 GLN 65 -13.682 -6.655 -11.391 537 H GLU 66 H GLU 66 -19.670 -2.317 -11.815 538 HA GLU 66 HA GLU 66 -20.151 -0.859 -9.364 539 HB2 GLU 66 HB3 GLU 66 -22.430 -0.521 -10.327 540 HB3 GLU 66 HB2 GLU 66 -21.126 0.043 -11.363 541 HG2 GLU 66 HG3 GLU 66 -21.479 -1.580 -12.931 542 HG3 GLU 66 HG2 GLU 66 -22.164 -2.712 -11.766 543 H ASP 67 H ASP 67 -20.995 -3.952 -10.780 544 HA ASP 67 HA ASP 67 -22.707 -4.606 -8.509 545 HB2 ASP 67 HB3 ASP 67 -22.101 -6.219 -10.994 546 HB3 ASP 67 HB2 ASP 67 -23.319 -6.601 -9.780 547 H TYR 68 H TYR 68 -19.649 -4.414 -8.459 548 HA TYR 68 HA TYR 68 -18.713 -7.078 -8.043 549 HB2 TYR 68 HB3 TYR 68 -17.223 -5.181 -8.645 550 HB3 TYR 68 HB2 TYR 68 -17.516 -4.480 -7.057 551 HD1 TYR 68 HD1 TYR 68 -16.010 -7.360 -8.821 552 HD2 TYR 68 HD2 TYR 68 -16.339 -5.248 -5.142 553 HE1 TYR 68 HE1 TYR 68 -14.147 -8.678 -7.905 554 HE2 TYR 68 HE2 TYR 68 -14.475 -6.559 -4.217 555 HH TYR 68 HH TYR 68 -13.367 -9.369 -5.544 556 H GLN 69 H GLN 69 -18.707 -8.299 -6.239 557 HA GLN 69 HA GLN 69 -19.676 -7.052 -3.751 558 HB2 GLN 69 HB3 GLN 69 -20.305 -9.807 -4.821 559 HB3 GLN 69 HB2 GLN 69 -20.760 -9.228 -3.225 560 HG2 GLN 69 HG3 GLN 69 -21.625 -7.905 -5.781 561 HG3 GLN 69 HG2 GLN 69 -22.565 -9.142 -4.949 562 HE21 GLN 69 HE21 GLN 69 -21.126 -5.949 -4.571 563 HE22 GLN 69 HE22 GLN 69 -22.265 -5.373 -3.406 564 H ALA 70 H ALA 70 -17.921 -6.880 -2.512 565 HA ALA 70 HA ALA 70 -16.083 -9.168 -2.327 566 HB1 ALA 70 HB1 ALA 70 -15.127 -6.831 -0.954 567 HB2 ALA 70 HB2 ALA 70 -15.594 -6.421 -2.604 568 HB3 ALA 70 HB3 ALA 70 -14.416 -7.700 -2.315 569 H GLN 71 H GLN 71 -16.930 -10.481 -0.806 570 HA GLN 71 HA GLN 71 -18.225 -9.550 1.551 571 HB2 GLN 71 HB3 GLN 71 -17.243 -12.245 0.643 572 HB3 GLN 71 HB2 GLN 71 -17.924 -12.010 2.246 573 HG2 GLN 71 HG3 GLN 71 -19.886 -12.458 1.308 574 HG3 GLN 71 HG2 GLN 71 -19.794 -10.836 0.621 575 HE21 GLN 71 HE21 GLN 71 -21.163 -11.735 -1.051 576 HE22 GLN 71 HE22 GLN 71 -20.443 -12.600 -2.361 577 H GLY 72 H GLY 72 -17.360 -8.900 3.403 578 HA2 GLY 72 HA3 GLY 72 -15.865 -9.226 5.246 579 HA3 GLY 72 HA2 GLY 72 -14.677 -9.864 4.121 580 H ALA 73 H ALA 73 -15.251 -7.579 2.215 581 HA ALA 73 HA ALA 73 -13.906 -5.452 3.751 582 HB1 ALA 73 HB1 ALA 73 -12.737 -6.973 1.768 583 HB2 ALA 73 HB2 ALA 73 -12.171 -5.408 2.349 584 HB3 ALA 73 HB3 ALA 73 -13.212 -5.496 0.929 585 H VAL 74 H VAL 74 -13.989 -3.305 2.537 586 HA VAL 74 HA VAL 74 -16.754 -2.779 1.854 587 HB VAL 74 HB VAL 74 -14.516 -0.762 1.806 588 HG11 VAL 74 HG11 VAL 74 -16.968 -0.393 0.957 589 HG12 VAL 74 HG12 VAL 74 -16.148 0.848 1.905 590 HG13 VAL 74 HG13 VAL 74 -17.315 -0.225 2.678 591 HG21 VAL 74 HG21 VAL 74 -15.408 -2.271 4.062 592 HG22 VAL 74 HG22 VAL 74 -15.913 -0.593 4.259 593 HG23 VAL 74 HG23 VAL 74 -14.212 -0.977 3.998 594 H VAL 75 H VAL 75 -17.529 -2.136 -0.123 595 HA VAL 75 HA VAL 75 -15.626 -2.369 -2.361 596 HB VAL 75 HB VAL 75 -18.586 -2.958 -2.352 597 HG11 VAL 75 HG11 VAL 75 -16.537 -2.937 -4.545 598 HG12 VAL 75 HG12 VAL 75 -18.134 -2.191 -4.515 599 HG13 VAL 75 HG13 VAL 75 -17.983 -3.943 -4.643 600 HG21 VAL 75 HG21 VAL 75 -17.067 -5.196 -3.117 601 HG22 VAL 75 HG22 VAL 75 -17.999 -4.977 -1.636 602 HG23 VAL 75 HG23 VAL 75 -16.291 -4.538 -1.677 603 H VAL 76 H VAL 76 -15.343 -0.750 -3.696 604 HA VAL 76 HA VAL 76 -17.384 1.291 -4.066 605 HB VAL 76 HB VAL 76 -15.828 3.148 -3.727 606 HG11 VAL 76 HG11 VAL 76 -17.211 1.920 -1.828 607 HG12 VAL 76 HG12 VAL 76 -16.166 3.298 -1.480 608 HG13 VAL 76 HG13 VAL 76 -15.595 1.658 -1.171 609 HG21 VAL 76 HG21 VAL 76 -13.825 1.641 -2.232 610 HG22 VAL 76 HG22 VAL 76 -13.627 2.934 -3.416 611 HG23 VAL 76 HG23 VAL 76 -13.842 1.269 -3.956 612 H HIS 77 H HIS 77 -16.477 2.924 -5.823 613 HA HIS 77 HA HIS 77 -14.798 1.443 -7.722 614 HB2 HIS 77 HB3 HIS 77 -17.156 2.887 -8.829 615 HB3 HIS 77 HB2 HIS 77 -16.314 1.467 -9.443 616 HD1 HIS 77 HD1 HIS 77 -16.607 -0.552 -7.284 617 HD2 HIS 77 HD2 HIS 77 -19.669 2.080 -8.261 618 HE1 HIS 77 HE1 HIS 77 -18.717 -1.642 -6.460 619 HE2 HIS 77 HE2 HIS 77 -20.566 -0.067 -7.131 620 H ASP 78 H ASP 78 -15.605 4.442 -6.292 621 HA ASP 78 HA ASP 78 -13.820 5.788 -8.209 622 HB2 ASP 78 HB3 ASP 78 -16.462 6.341 -8.061 623 HB3 ASP 78 HB2 ASP 78 -15.845 7.462 -6.851 624 H VAL 79 H VAL 79 -12.673 7.650 -7.361 625 HA VAL 79 HA VAL 79 -11.467 7.131 -4.876 626 HB VAL 79 HB VAL 79 -10.552 9.518 -5.226 627 HG11 VAL 79 HG11 VAL 79 -8.781 8.595 -6.279 628 HG12 VAL 79 HG12 VAL 79 -9.777 7.878 -7.546 629 HG13 VAL 79 HG13 VAL 79 -9.665 7.101 -5.966 630 HG21 VAL 79 HG21 VAL 79 -11.522 9.109 -8.030 631 HG22 VAL 79 HG22 VAL 79 -10.809 10.551 -7.308 632 HG23 VAL 79 HG23 VAL 79 -12.439 10.055 -6.858 633 H ALA 80 H ALA 80 -13.986 9.351 -5.903 634 HA ALA 80 HA ALA 80 -14.123 10.791 -3.447 635 HB1 ALA 80 HB1 ALA 80 -15.140 12.095 -4.971 636 HB2 ALA 80 HB2 ALA 80 -16.577 11.157 -4.563 637 HB3 ALA 80 HB3 ALA 80 -15.613 10.724 -5.975 638 H ALA 81 H ALA 81 -15.835 8.022 -4.806 639 HA ALA 81 HA ALA 81 -17.852 7.717 -2.928 640 HB1 ALA 81 HB1 ALA 81 -18.083 6.276 -4.700 641 HB2 ALA 81 HB2 ALA 81 -17.455 5.176 -3.472 642 HB3 ALA 81 HB3 ALA 81 -16.376 5.832 -4.703 643 H VAL 82 H VAL 82 -14.774 5.898 -2.935 644 HA VAL 82 HA VAL 82 -14.954 4.766 -0.446 645 HB VAL 82 HB VAL 82 -13.149 4.497 -2.289 646 HG11 VAL 82 HG11 VAL 82 -11.222 5.756 -2.213 647 HG12 VAL 82 HG12 VAL 82 -11.510 6.290 -0.556 648 HG13 VAL 82 HG13 VAL 82 -12.454 6.972 -1.880 649 HG21 VAL 82 HG21 VAL 82 -12.177 4.427 0.555 650 HG22 VAL 82 HG22 VAL 82 -11.711 3.376 -0.782 651 HG23 VAL 82 HG23 VAL 82 -13.332 3.265 -0.097 652 H PHE 83 H PHE 83 -13.971 8.052 -1.264 653 HA PHE 83 HA PHE 83 -12.869 8.776 1.205 654 HB2 PHE 83 HB3 PHE 83 -13.931 10.201 -1.151 655 HB3 PHE 83 HB2 PHE 83 -13.981 11.117 0.352 656 HD1 PHE 83 HD2 PHE 83 -11.607 10.447 1.756 657 HD2 PHE 83 HD1 PHE 83 -12.169 10.896 -2.438 658 HE1 PHE 83 HE2 PHE 83 -9.223 10.998 1.500 659 HE2 PHE 83 HE1 PHE 83 -9.785 11.447 -2.702 660 HZ PHE 83 HZ PHE 83 -8.309 11.499 -0.731 661 H ALA 84 H ALA 84 -16.224 8.821 0.076 662 HA ALA 84 HA ALA 84 -17.340 10.124 2.300 663 HB1 ALA 84 HB1 ALA 84 -18.685 9.853 0.349 664 HB2 ALA 84 HB2 ALA 84 -19.453 8.933 1.643 665 HB3 ALA 84 HB3 ALA 84 -18.517 8.098 0.404 666 H TYR 85 H TYR 85 -16.644 6.741 1.640 667 HA TYR 85 HA TYR 85 -17.771 5.651 3.968 668 HB2 TYR 85 HB3 TYR 85 -17.087 3.739 3.016 669 HB3 TYR 85 HB2 TYR 85 -16.265 4.681 1.782 670 HD1 TYR 85 HD1 TYR 85 -15.695 3.460 5.277 671 HD2 TYR 85 HD2 TYR 85 -14.027 4.299 1.460 672 HE1 TYR 85 HE1 TYR 85 -13.533 2.560 6.032 673 HE2 TYR 85 HE2 TYR 85 -11.859 3.403 2.200 674 HH TYR 85 HH TYR 85 -10.881 2.057 3.829 675 H ALA 86 H ALA 86 -14.311 6.380 3.346 676 HA ALA 86 HA ALA 86 -13.292 6.033 5.835 677 HB1 ALA 86 HB1 ALA 86 -12.248 6.963 3.581 678 HB2 ALA 86 HB2 ALA 86 -11.454 7.187 5.139 679 HB3 ALA 86 HB3 ALA 86 -12.405 8.496 4.438 680 H LYS 87 H LYS 87 -15.327 8.665 4.776 681 HA LYS 87 HA LYS 87 -14.894 10.369 7.008 682 HB2 LYS 87 HB3 LYS 87 -16.360 10.472 4.622 683 HB3 LYS 87 HB2 LYS 87 -17.571 10.559 5.892 684 HG2 LYS 87 HG3 LYS 87 -17.098 12.692 6.236 685 HG3 LYS 87 HG2 LYS 87 -15.410 12.294 6.563 686 HD2 LYS 87 HD3 LYS 87 -15.598 12.096 3.814 687 HD3 LYS 87 HD2 LYS 87 -16.628 13.477 4.197 688 HE2 LYS 87 HE3 LYS 87 -14.886 14.763 4.789 689 HE3 LYS 87 HE2 LYS 87 -14.074 13.444 5.631 690 HZ1 LYS 87 HZ1 LYS 87 -14.014 14.057 2.734 691 HZ2 LYS 87 HZ2 LYS 87 -13.481 12.580 3.363 692 HZ3 LYS 87 HZ3 LYS 87 -12.714 14.018 3.817 693 H GLN 88 H GLN 88 -17.355 7.985 6.193 694 HA GLN 88 HA GLN 88 -18.890 8.155 8.526 695 HB2 GLN 88 HB3 GLN 88 -19.487 6.954 6.382 696 HB3 GLN 88 HB2 GLN 88 -18.451 5.638 6.918 697 HG2 GLN 88 HG3 GLN 88 -20.738 5.124 7.430 698 HG3 GLN 88 HG2 GLN 88 -19.847 5.390 8.928 699 HE21 GLN 88 HE21 GLN 88 -21.742 7.228 6.554 700 HE22 GLN 88 HE22 GLN 88 -22.593 8.181 7.717 701 H HIS 89 H HIS 89 -15.770 6.822 8.025 702 HA HIS 89 HA HIS 89 -15.910 5.402 10.599 703 HB2 HIS 89 HB3 HIS 89 -14.459 4.886 8.067 704 HB3 HIS 89 HB2 HIS 89 -13.580 4.537 9.552 705 HD1 HIS 89 HD1 HIS 89 -15.707 3.291 11.288 706 HD2 HIS 89 HD2 HIS 89 -15.337 2.470 7.231 707 HE1 HIS 89 HE1 HIS 89 -16.815 1.059 10.950 708 HE2 HIS 89 HE2 HIS 89 -16.655 0.623 8.474 709 HA PRO 90 HA PRO 90 -13.203 9.109 11.318 710 HB2 PRO 90 HB3 PRO 90 -14.413 10.012 13.537 711 HB3 PRO 90 HB2 PRO 90 -15.037 10.380 11.924 712 HG2 PRO 90 HG3 PRO 90 -15.953 8.304 13.879 713 HG3 PRO 90 HG2 PRO 90 -16.922 9.409 12.887 714 HD2 PRO 90 HD3 PRO 90 -16.463 6.800 12.222 715 HD3 PRO 90 HD2 PRO 90 -16.761 8.078 11.027 716 H ASP 91 H ASP 91 -13.865 6.189 12.831 717 HA ASP 91 HA ASP 91 -12.116 6.674 15.114 718 HB2 ASP 91 HB3 ASP 91 -14.263 4.833 14.516 719 HB3 ASP 91 HB2 ASP 91 -12.837 3.962 15.071 720 H GLN 92 H GLN 92 -12.003 5.329 11.950 721 HA GLN 92 HA GLN 92 -9.374 4.140 12.550 722 HB2 GLN 92 HB3 GLN 92 -11.449 3.350 10.510 723 HB3 GLN 92 HB2 GLN 92 -9.791 2.768 10.457 724 HG2 GLN 92 HG3 GLN 92 -10.172 1.246 12.027 725 HG3 GLN 92 HG2 GLN 92 -10.986 2.410 13.071 726 HE21 GLN 92 HE21 GLN 92 -13.012 1.950 13.495 727 HE22 GLN 92 HE22 GLN 92 -14.095 1.060 12.485 728 H GLU 93 H GLU 93 -7.915 4.079 10.584 729 HA GLU 93 HA GLU 93 -8.090 6.658 9.171 730 HB2 GLU 93 HB3 GLU 93 -6.073 5.713 10.842 731 HB3 GLU 93 HB2 GLU 93 -5.437 5.463 9.222 732 HG2 GLU 93 HG3 GLU 93 -6.438 7.989 9.040 733 HG3 GLU 93 HG2 GLU 93 -5.882 7.936 10.712 734 H LEU 94 H LEU 94 -7.040 6.710 7.024 735 HA LEU 94 HA LEU 94 -7.620 4.225 5.580 736 HB2 LEU 94 HB3 LEU 94 -8.187 6.950 5.077 737 HB3 LEU 94 HB2 LEU 94 -7.050 6.437 3.844 738 HG LEU 94 HG LEU 94 -8.553 4.597 3.217 739 HD11 LEU 94 HD11 LEU 94 -10.118 5.642 5.532 740 HD12 LEU 94 HD12 LEU 94 -9.759 3.977 5.075 741 HD13 LEU 94 HD13 LEU 94 -10.961 4.900 4.172 742 HD21 LEU 94 HD21 LEU 94 -10.008 7.236 3.276 743 HD22 LEU 94 HD22 LEU 94 -10.214 5.926 2.113 744 HD23 LEU 94 HD23 LEU 94 -8.707 6.842 2.153 745 H VAL 95 H VAL 95 -6.039 3.025 4.771 746 HA VAL 95 HA VAL 95 -3.446 4.270 4.180 747 HB VAL 95 HB VAL 95 -3.730 1.640 5.639 748 HG11 VAL 95 HG11 VAL 95 -1.498 3.060 4.371 749 HG12 VAL 95 HG12 VAL 95 -1.686 1.350 4.755 750 HG13 VAL 95 HG13 VAL 95 -1.173 2.483 6.006 751 HG21 VAL 95 HG21 VAL 95 -4.186 2.990 7.391 752 HG22 VAL 95 HG22 VAL 95 -3.499 4.415 6.611 753 HG23 VAL 95 HG23 VAL 95 -2.440 3.235 7.382 754 H ILE 96 H ILE 96 -2.789 3.790 2.192 755 HA ILE 96 HA ILE 96 -4.150 1.728 0.676 756 HB ILE 96 HB ILE 96 -1.888 3.463 -0.299 757 HG12 ILE 96 HG13 ILE 96 -3.641 4.897 0.671 758 HG13 ILE 96 HG12 ILE 96 -3.570 5.059 -1.081 759 HG21 ILE 96 HG21 ILE 96 -4.157 2.079 -1.722 760 HG22 ILE 96 HG22 ILE 96 -2.466 1.578 -1.719 761 HG23 ILE 96 HG23 ILE 96 -2.934 3.096 -2.485 762 HD11 ILE 96 HD11 ILE 96 -5.449 3.273 -1.059 763 HD12 ILE 96 HD12 ILE 96 -5.830 4.955 -0.687 764 HD13 ILE 96 HD13 ILE 96 -5.657 3.780 0.617 765 H ALA 97 H ALA 97 -3.355 -0.225 0.156 766 HA ALA 97 HA ALA 97 -0.595 -0.830 0.990 767 HB1 ALA 97 HB1 ALA 97 -1.695 -3.269 0.829 768 HB2 ALA 97 HB2 ALA 97 -3.131 -2.323 1.220 769 HB3 ALA 97 HB3 ALA 97 -1.732 -2.285 2.292 770 H GLY 98 H GLY 98 -2.906 -1.013 -1.620 771 HA2 GLY 98 HA3 GLY 98 -1.089 -1.083 -3.675 772 HA3 GLY 98 HA2 GLY 98 -1.348 -2.771 -3.262 773 H GLY 99 H GLY 99 -3.702 -1.978 -5.980 774 HA2 GLY 99 HA3 GLY 99 -0.910 -2.519 -5.315 775 HA3 GLY 99 HA2 GLY 99 -1.671 -2.737 -6.880 776 H ALA 100 H ALA 100 0.146 -1.682 -7.823 777 HA ALA 100 HA ALA 100 1.027 0.892 -7.186 778 HB1 ALA 100 HB1 ALA 100 2.419 0.654 -8.938 779 HB2 ALA 100 HB2 ALA 100 1.125 0.171 -10.035 780 HB3 ALA 100 HB3 ALA 100 1.832 -1.009 -8.931 781 H GLN 101 H GLN 101 -1.644 -0.201 -9.181 782 HA GLN 101 HA GLN 101 -2.193 2.246 -10.470 783 HB2 GLN 101 HB3 GLN 101 -3.319 -0.360 -10.377 784 HB3 GLN 101 HB2 GLN 101 -4.615 0.782 -10.047 785 HG2 GLN 101 HG3 GLN 101 -2.775 0.855 -12.428 786 HG3 GLN 101 HG2 GLN 101 -4.435 0.262 -12.422 787 HE21 GLN 101 HE21 GLN 101 -6.125 1.712 -12.322 788 HE22 GLN 101 HE22 GLN 101 -5.916 3.407 -12.579 789 H ILE 102 H ILE 102 -3.344 0.851 -7.431 790 HA ILE 102 HA ILE 102 -5.252 2.842 -6.840 791 HB ILE 102 HB ILE 102 -3.699 1.159 -4.871 792 HG12 ILE 102 HG13 ILE 102 -4.820 -0.197 -6.615 793 HG13 ILE 102 HG12 ILE 102 -5.530 -0.440 -5.022 794 HG21 ILE 102 HG21 ILE 102 -6.336 2.603 -4.644 795 HG22 ILE 102 HG22 ILE 102 -4.841 2.984 -3.788 796 HG23 ILE 102 HG23 ILE 102 -5.695 1.480 -3.443 797 HD11 ILE 102 HD11 ILE 102 -6.770 1.635 -6.710 798 HD12 ILE 102 HD12 ILE 102 -7.506 0.461 -5.620 799 HD13 ILE 102 HD13 ILE 102 -6.974 -0.038 -7.226 800 H PHE 103 H PHE 103 -1.861 2.465 -5.836 801 HA PHE 103 HA PHE 103 -1.664 4.670 -4.168 802 HB2 PHE 103 HB3 PHE 103 0.395 3.412 -5.986 803 HB3 PHE 103 HB2 PHE 103 0.780 4.664 -4.809 804 HD1 PHE 103 HD1 PHE 103 -0.615 3.986 -2.440 805 HD2 PHE 103 HD2 PHE 103 1.186 1.382 -5.282 806 HE1 PHE 103 HE1 PHE 103 -0.357 2.268 -0.698 807 HE2 PHE 103 HE2 PHE 103 1.447 -0.340 -3.546 808 HZ PHE 103 HZ PHE 103 0.673 0.102 -1.250 809 H THR 104 H THR 104 -1.681 4.499 -7.657 810 HA THR 104 HA THR 104 -0.679 7.080 -8.195 811 HB THR 104 HB THR 104 -2.649 5.532 -9.880 812 HG1 THR 104 HG1 THR 104 -0.911 4.467 -10.730 813 HG21 THR 104 HG21 THR 104 -0.486 6.915 -11.224 814 HG22 THR 104 HG22 THR 104 -1.546 8.007 -10.333 815 HG23 THR 104 HG23 THR 104 -2.218 6.923 -11.552 816 H ALA 105 H ALA 105 -4.053 5.897 -8.096 817 HA ALA 105 HA ALA 105 -5.325 8.311 -8.576 818 HB1 ALA 105 HB1 ALA 105 -7.214 7.296 -7.178 819 HB2 ALA 105 HB2 ALA 105 -6.154 5.899 -6.997 820 HB3 ALA 105 HB3 ALA 105 -6.680 6.404 -8.602 821 H PHE 106 H PHE 106 -4.711 6.902 -5.330 822 HA PHE 106 HA PHE 106 -5.476 9.282 -4.010 823 HB2 PHE 106 HB3 PHE 106 -3.907 6.878 -3.066 824 HB3 PHE 106 HB2 PHE 106 -4.456 8.175 -2.009 825 HD1 PHE 106 HD2 PHE 106 -5.578 5.457 -4.239 826 HD2 PHE 106 HD1 PHE 106 -6.678 8.248 -1.220 827 HE1 PHE 106 HE2 PHE 106 -7.733 4.302 -3.963 828 HE2 PHE 106 HE1 PHE 106 -8.834 7.097 -0.937 829 HZ PHE 106 HZ PHE 106 -9.364 5.122 -2.310 830 H LYS 107 H LYS 107 -2.619 8.438 -5.674 831 HA LYS 107 HA LYS 107 -0.578 9.545 -4.227 832 HB2 LYS 107 HB3 LYS 107 0.649 9.437 -6.128 833 HB3 LYS 107 HB2 LYS 107 -0.743 8.552 -6.716 834 HG2 LYS 107 HG3 LYS 107 -1.055 10.030 -8.335 835 HG3 LYS 107 HG2 LYS 107 -1.123 11.360 -7.186 836 HD2 LYS 107 HD3 LYS 107 1.551 10.797 -7.250 837 HD3 LYS 107 HD2 LYS 107 1.063 10.469 -8.914 838 HE2 LYS 107 HE3 LYS 107 0.553 13.020 -7.385 839 HE3 LYS 107 HE2 LYS 107 1.779 12.789 -8.631 840 HZ1 LYS 107 HZ1 LYS 107 0.256 12.880 -10.276 841 HZ2 LYS 107 HZ2 LYS 107 -0.616 13.780 -9.140 842 HZ3 LYS 107 HZ3 LYS 107 -0.964 12.140 -9.365 843 H ASP 108 H ASP 108 -3.136 11.194 -5.921 844 HA ASP 108 HA ASP 108 -1.977 13.814 -5.428 845 HB2 ASP 108 HB3 ASP 108 -4.424 12.829 -6.869 846 HB3 ASP 108 HB2 ASP 108 -4.264 14.530 -6.440 847 H ASP 109 H ASP 109 -4.652 11.798 -4.330 848 HA ASP 109 HA ASP 109 -5.536 13.830 -2.441 849 HB2 ASP 109 HB3 ASP 109 -6.773 11.682 -3.788 850 HB3 ASP 109 HB2 ASP 109 -6.847 11.299 -2.071 851 H VAL 110 H VAL 110 -2.977 11.923 -2.308 852 HA VAL 110 HA VAL 110 -3.394 10.696 0.281 853 HB VAL 110 HB VAL 110 -2.029 9.566 -1.436 854 HG11 VAL 110 HG11 VAL 110 -1.010 11.842 -2.173 855 HG12 VAL 110 HG12 VAL 110 -0.032 10.377 -2.266 856 HG13 VAL 110 HG13 VAL 110 0.190 11.501 -0.925 857 HG21 VAL 110 HG21 VAL 110 -0.339 10.292 0.948 858 HG22 VAL 110 HG22 VAL 110 -0.328 8.786 0.031 859 HG23 VAL 110 HG23 VAL 110 -1.721 9.199 1.030 860 H ASP 111 H ASP 111 -1.947 11.083 2.100 861 HA ASP 111 HA ASP 111 -0.958 13.855 2.209 862 HB2 ASP 111 HB3 ASP 111 -3.173 13.051 3.526 863 HB3 ASP 111 HB2 ASP 111 -1.948 12.648 4.726 864 H THR 112 H THR 112 -0.690 10.582 3.563 865 HA THR 112 HA THR 112 2.055 11.253 4.392 866 HB THR 112 HB THR 112 0.285 9.084 5.531 867 HG1 THR 112 HG1 THR 112 -0.471 11.124 6.129 868 HG21 THR 112 HG21 THR 112 2.369 8.334 6.089 869 HG22 THR 112 HG22 THR 112 2.041 9.413 7.444 870 HG23 THR 112 HG23 THR 112 3.070 9.952 6.117 871 H LEU 113 H LEU 113 3.653 9.538 4.215 872 HA LEU 113 HA LEU 113 3.006 7.428 2.299 873 HB2 LEU 113 HB3 LEU 113 4.385 9.789 1.645 874 HB3 LEU 113 HB2 LEU 113 5.600 8.529 1.724 875 HG LEU 113 HG LEU 113 4.388 7.222 0.061 876 HD11 LEU 113 HD11 LEU 113 2.113 7.991 0.690 877 HD12 LEU 113 HD12 LEU 113 2.422 8.062 -1.045 878 HD13 LEU 113 HD13 LEU 113 2.463 9.538 -0.081 879 HD21 LEU 113 HD21 LEU 113 5.869 8.459 -1.109 880 HD22 LEU 113 HD22 LEU 113 5.306 9.980 -0.416 881 HD23 LEU 113 HD23 LEU 113 4.404 9.221 -1.729 882 H LEU 114 H LEU 114 3.964 5.546 2.725 883 HA LEU 114 HA LEU 114 6.317 5.460 4.475 884 HB2 LEU 114 HB3 LEU 114 3.829 3.779 4.826 885 HB3 LEU 114 HB2 LEU 114 5.329 3.555 5.707 886 HG LEU 114 HG LEU 114 4.095 6.243 5.875 887 HD11 LEU 114 HD11 LEU 114 2.212 4.540 6.033 888 HD12 LEU 114 HD12 LEU 114 2.399 5.654 7.387 889 HD13 LEU 114 HD13 LEU 114 2.981 3.995 7.524 890 HD21 LEU 114 HD21 LEU 114 6.190 5.621 7.029 891 HD22 LEU 114 HD22 LEU 114 5.295 4.408 7.944 892 HD23 LEU 114 HD23 LEU 114 4.914 6.118 8.140 893 H VAL 115 H VAL 115 7.842 4.496 3.267 894 HA VAL 115 HA VAL 115 7.021 2.161 1.665 895 HB VAL 115 HB VAL 115 8.606 2.801 -0.076 896 HG11 VAL 115 HG11 VAL 115 6.245 3.522 -0.180 897 HG12 VAL 115 HG12 VAL 115 7.339 4.618 -1.024 898 HG13 VAL 115 HG13 VAL 115 6.709 5.052 0.565 899 HG21 VAL 115 HG21 VAL 115 9.513 5.146 -0.032 900 HG22 VAL 115 HG22 VAL 115 10.254 4.028 1.114 901 HG23 VAL 115 HG23 VAL 115 9.066 5.206 1.673 902 H THR 116 H THR 116 8.543 0.564 1.272 903 HA THR 116 HA THR 116 10.885 0.551 3.063 904 HB THR 116 HB THR 116 8.954 -1.672 2.384 905 HG1 THR 116 HG1 THR 116 8.453 -1.588 4.461 906 HG21 THR 116 HG21 THR 116 11.098 -2.707 2.254 907 HG22 THR 116 HG22 THR 116 10.362 -3.139 3.798 908 HG23 THR 116 HG23 THR 116 11.627 -1.911 3.737 909 H ARG 117 H ARG 117 12.466 1.056 1.597 910 HA ARG 117 HA ARG 117 12.476 -0.160 -1.029 911 HB2 ARG 117 HB3 ARG 117 13.310 2.245 -0.171 912 HB3 ARG 117 HB2 ARG 117 14.832 1.369 -0.083 913 HG2 ARG 117 HG3 ARG 117 15.049 1.978 -2.222 914 HG3 ARG 117 HG2 ARG 117 13.952 0.633 -2.540 915 HD2 ARG 117 HD3 ARG 117 12.372 2.013 -3.279 916 HD3 ARG 117 HD2 ARG 117 12.473 2.995 -1.819 917 HE ARG 117 HE ARG 117 14.656 3.661 -3.393 918 HH11 ARG 117 HH11 ARG 117 11.177 3.830 -3.601 919 HH12 ARG 117 HH12 ARG 117 11.180 5.229 -4.621 920 HH21 ARG 117 HH21 ARG 117 14.663 5.502 -4.735 921 HH22 ARG 117 HH22 ARG 117 13.160 6.178 -5.266 922 H LEU 118 H LEU 118 13.045 -2.238 -1.113 923 HA LEU 118 HA LEU 118 14.874 -3.482 0.664 924 HB2 LEU 118 HB3 LEU 118 13.320 -4.250 -1.727 925 HB3 LEU 118 HB2 LEU 118 14.778 -5.182 -1.447 926 HG LEU 118 HG LEU 118 13.746 -5.338 1.006 927 HD11 LEU 118 HD11 LEU 118 11.201 -5.842 0.359 928 HD12 LEU 118 HD12 LEU 118 11.521 -4.509 -0.750 929 HD13 LEU 118 HD13 LEU 118 11.745 -4.286 0.985 930 HD21 LEU 118 HD21 LEU 118 12.408 -7.389 -0.126 931 HD22 LEU 118 HD22 LEU 118 14.145 -7.391 0.174 932 HD23 LEU 118 HD23 LEU 118 13.527 -6.979 -1.426 933 H ALA 119 H ALA 119 17.003 -4.033 0.411 934 HA ALA 119 HA ALA 119 18.586 -2.412 -1.319 935 HB1 ALA 119 HB1 ALA 119 20.262 -2.983 0.043 936 HB2 ALA 119 HB2 ALA 119 19.964 -4.707 -0.177 937 HB3 ALA 119 HB3 ALA 119 19.038 -3.796 1.018 938 H GLY 120 H GLY 120 18.025 -5.927 -1.146 939 HA2 GLY 120 HA3 GLY 120 19.529 -6.786 -3.267 940 HA3 GLY 120 HA2 GLY 120 18.000 -7.518 -2.809 941 H SER 121 H SER 121 18.999 -7.377 -5.445 942 HA SER 121 HA SER 121 17.221 -5.402 -6.703 943 HB2 SER 121 HB3 SER 121 19.825 -5.750 -7.226 944 HB3 SER 121 HB2 SER 121 19.166 -6.945 -8.343 945 HG SER 121 HG SER 121 18.157 -5.382 -9.452 946 H PHE 122 H PHE 122 15.619 -6.002 -8.073 947 HA PHE 122 HA PHE 122 15.360 -8.789 -8.877 948 HB2 PHE 122 HB3 PHE 122 13.175 -7.366 -7.341 949 HB3 PHE 122 HB2 PHE 122 13.078 -8.986 -8.023 950 HD1 PHE 122 HD1 PHE 122 14.309 -10.835 -7.016 951 HD2 PHE 122 HD2 PHE 122 14.368 -6.938 -5.313 952 HE1 PHE 122 HE1 PHE 122 15.193 -11.770 -4.919 953 HE2 PHE 122 HE2 PHE 122 15.253 -7.864 -3.211 954 HZ PHE 122 HZ PHE 122 15.667 -10.284 -3.013 955 H GLU 123 H GLU 123 13.538 -9.090 -10.422 956 HA GLU 123 HA GLU 123 12.936 -6.607 -11.888 957 HB2 GLU 123 HB3 GLU 123 13.238 -7.780 -13.996 958 HB3 GLU 123 HB2 GLU 123 14.710 -7.873 -13.038 959 HG2 GLU 123 HG3 GLU 123 13.291 -10.141 -12.322 960 HG3 GLU 123 HG2 GLU 123 13.023 -9.987 -14.058 961 H GLY 124 H GLY 124 10.885 -6.345 -12.563 962 HA2 GLY 124 HA3 GLY 124 9.074 -8.637 -12.626 963 HA3 GLY 124 HA2 GLY 124 8.695 -7.353 -11.488 964 H ASP 125 H ASP 125 6.844 -6.584 -12.393 965 HA ASP 125 HA ASP 125 7.162 -5.101 -14.878 966 HB2 ASP 125 HB3 ASP 125 5.433 -7.485 -14.552 967 HB3 ASP 125 HB2 ASP 125 4.706 -6.106 -15.372 968 H THR 126 H THR 126 6.757 -4.546 -11.966 969 HA THR 126 HA THR 126 4.618 -2.610 -12.325 970 HB THR 126 HB THR 126 4.410 -3.915 -9.712 971 HG1 THR 126 HG1 THR 126 3.693 -5.832 -10.368 972 HG21 THR 126 HG21 THR 126 2.569 -2.666 -9.990 973 HG22 THR 126 HG22 THR 126 1.968 -4.108 -10.809 974 HG23 THR 126 HG23 THR 126 2.630 -2.772 -11.749 975 H LYS 127 H LYS 127 5.692 -0.795 -11.951 976 HA LYS 127 HA LYS 127 7.428 -0.645 -9.570 977 HB2 LYS 127 HB3 LYS 127 7.721 0.405 -12.325 978 HB3 LYS 127 HB2 LYS 127 8.211 1.491 -11.032 979 HG2 LYS 127 HG3 LYS 127 10.183 0.432 -11.374 980 HG3 LYS 127 HG2 LYS 127 9.480 -0.680 -10.197 981 HD2 LYS 127 HD3 LYS 127 9.249 -2.334 -11.710 982 HD3 LYS 127 HD2 LYS 127 8.774 -1.225 -12.998 983 HE2 LYS 127 HE3 LYS 127 10.896 -2.300 -13.518 984 HE3 LYS 127 HE2 LYS 127 11.110 -0.565 -13.292 985 HZ1 LYS 127 HZ1 LYS 127 12.816 -2.007 -12.203 986 HZ2 LYS 127 HZ2 LYS 127 11.611 -2.549 -11.148 987 HZ3 LYS 127 HZ3 LYS 127 12.046 -0.915 -11.165 988 H MET 128 H MET 128 7.547 1.601 -8.626 989 HA MET 128 HA MET 128 4.959 2.475 -7.929 990 HB2 MET 128 HB3 MET 128 7.016 2.700 -6.512 991 HB3 MET 128 HB2 MET 128 7.539 4.004 -7.570 992 HG2 MET 128 HG3 MET 128 6.488 4.810 -5.504 993 HG3 MET 128 HG2 MET 128 5.635 5.335 -6.955 994 HE1 MET 128 HE1 MET 128 3.071 5.788 -5.736 995 HE2 MET 128 HE2 MET 128 4.350 5.856 -4.523 996 HE3 MET 128 HE3 MET 128 2.883 4.929 -4.207 997 H ILE 129 H ILE 129 4.153 4.718 -8.156 998 HA ILE 129 HA ILE 129 4.529 5.633 -10.917 999 HB ILE 129 HB ILE 129 2.389 6.766 -10.690 1000 HG12 ILE 129 HG13 ILE 129 1.125 5.973 -8.455 1001 HG13 ILE 129 HG12 ILE 129 2.768 6.061 -7.828 1002 HG21 ILE 129 HG21 ILE 129 1.407 4.291 -9.622 1003 HG22 ILE 129 HG22 ILE 129 2.786 3.990 -10.679 1004 HG23 ILE 129 HG23 ILE 129 1.388 4.878 -11.285 1005 HD11 ILE 129 HD11 ILE 129 2.928 8.356 -8.290 1006 HD12 ILE 129 HD12 ILE 129 1.336 8.122 -7.569 1007 HD13 ILE 129 HD13 ILE 129 1.492 8.331 -9.313 1008 HA PRO 130 HA PRO 130 6.513 9.396 -9.741 1009 HB2 PRO 130 HB3 PRO 130 5.368 11.180 -11.472 1010 HB3 PRO 130 HB2 PRO 130 6.621 10.026 -11.940 1011 HG2 PRO 130 HG3 PRO 130 3.654 9.848 -12.291 1012 HG3 PRO 130 HG2 PRO 130 4.945 9.418 -13.429 1013 HD2 PRO 130 HD3 PRO 130 3.634 7.555 -11.996 1014 HD3 PRO 130 HD2 PRO 130 5.358 7.392 -12.390 1015 H LEU 131 H LEU 131 6.175 10.654 -8.023 1016 HA LEU 131 HA LEU 131 3.463 11.721 -7.571 1017 HB2 LEU 131 HB3 LEU 131 5.226 11.328 -5.229 1018 HB3 LEU 131 HB2 LEU 131 3.491 11.134 -5.373 1019 HG LEU 131 HG LEU 131 5.116 9.102 -6.778 1020 HD11 LEU 131 HD11 LEU 131 5.040 9.292 -3.774 1021 HD12 LEU 131 HD12 LEU 131 6.468 9.317 -4.808 1022 HD13 LEU 131 HD13 LEU 131 5.500 7.849 -4.677 1023 HD21 LEU 131 HD21 LEU 131 2.903 8.639 -4.821 1024 HD22 LEU 131 HD22 LEU 131 3.351 7.702 -6.247 1025 HD23 LEU 131 HD23 LEU 131 2.554 9.264 -6.433 1026 H ASN 132 H ASN 132 3.428 13.659 -6.138 1027 HA ASN 132 HA ASN 132 5.445 15.551 -7.017 1028 HB2 ASN 132 HB3 ASN 132 2.777 15.820 -6.642 1029 HB3 ASN 132 HB2 ASN 132 3.361 16.407 -5.088 1030 HD21 ASN 132 HD21 ASN 132 5.579 17.749 -5.630 1031 HD22 ASN 132 HD22 ASN 132 5.277 19.063 -6.710 1032 H TRP 133 H TRP 133 7.204 14.615 -5.858 1033 HA TRP 133 HA TRP 133 7.261 14.228 -3.092 1034 HB2 TRP 133 HB3 TRP 133 9.531 14.807 -4.997 1035 HB3 TRP 133 HB2 TRP 133 9.724 14.217 -3.348 1036 HD1 TRP 133 HD1 TRP 133 8.373 13.090 -6.772 1037 HE1 TRP 133 HE1 TRP 133 8.320 10.517 -6.817 1038 HE3 TRP 133 HE3 TRP 133 9.664 12.164 -1.911 1039 HZ2 TRP 133 HZ2 TRP 133 8.772 8.379 -5.032 1040 HZ3 TRP 133 HZ3 TRP 133 9.832 9.827 -1.161 1041 HH2 TRP 133 HH2 TRP 133 9.394 7.975 -2.690 1042 H ASP 134 H ASP 134 7.857 17.169 -4.988 1043 HA ASP 134 HA ASP 134 9.162 18.662 -3.037 1044 HB2 ASP 134 HB3 ASP 134 8.369 19.135 -5.585 1045 HB3 ASP 134 HB2 ASP 134 7.193 20.106 -4.705 1046 H ASP 135 H ASP 135 5.696 18.207 -3.616 1047 HA ASP 135 HA ASP 135 4.893 19.970 -1.514 1048 HB2 ASP 135 HB3 ASP 135 3.524 18.078 -3.363 1049 HB3 ASP 135 HB2 ASP 135 2.670 18.556 -1.899 1050 H PHE 136 H PHE 136 6.381 17.044 -1.349 1051 HA PHE 136 HA PHE 136 5.089 16.404 1.219 1052 HB2 PHE 136 HB3 PHE 136 6.072 14.581 -0.958 1053 HB3 PHE 136 HB2 PHE 136 5.970 14.017 0.707 1054 HD1 PHE 136 HD2 PHE 136 3.799 15.991 -1.607 1055 HD2 PHE 136 HD1 PHE 136 4.112 12.767 1.152 1056 HE1 PHE 136 HE2 PHE 136 1.412 15.489 -1.931 1057 HE2 PHE 136 HE1 PHE 136 1.726 12.257 0.833 1058 HZ PHE 136 HZ PHE 136 0.373 13.620 -0.710 1059 H THR 137 H THR 137 6.368 16.250 2.951 1060 HA THR 137 HA THR 137 9.277 16.428 2.517 1061 HB THR 137 HB THR 137 7.565 17.563 4.735 1062 HG1 THR 137 HG1 THR 137 7.625 18.796 2.831 1063 HG21 THR 137 HG21 THR 137 10.558 17.699 4.465 1064 HG22 THR 137 HG22 THR 137 9.669 16.794 5.690 1065 HG23 THR 137 HG23 THR 137 9.577 18.555 5.655 1066 H LYS 138 H LYS 138 10.578 14.971 3.462 1067 HA LYS 138 HA LYS 138 9.552 12.565 4.466 1068 HB2 LYS 138 HB3 LYS 138 11.778 12.783 3.426 1069 HB3 LYS 138 HB2 LYS 138 12.331 13.703 4.819 1070 HG2 LYS 138 HG3 LYS 138 12.568 11.870 6.106 1071 HG3 LYS 138 HG2 LYS 138 11.164 11.063 5.406 1072 HD2 LYS 138 HD3 LYS 138 12.696 9.749 4.416 1073 HD3 LYS 138 HD2 LYS 138 12.865 11.096 3.288 1074 HE2 LYS 138 HE3 LYS 138 14.515 11.782 5.404 1075 HE3 LYS 138 HE2 LYS 138 14.751 10.044 5.230 1076 HZ1 LYS 138 HZ1 LYS 138 15.698 10.280 3.204 1077 HZ2 LYS 138 HZ2 LYS 138 16.110 11.799 3.822 1078 HZ3 LYS 138 HZ3 LYS 138 14.781 11.640 2.788 1079 H VAL 139 H VAL 139 8.799 12.032 6.398 1080 HA VAL 139 HA VAL 139 9.102 13.911 8.605 1081 HB VAL 139 HB VAL 139 7.511 11.388 8.829 1082 HG11 VAL 139 HG11 VAL 139 7.967 13.330 10.594 1083 HG12 VAL 139 HG12 VAL 139 6.448 12.437 10.536 1084 HG13 VAL 139 HG13 VAL 139 6.566 14.026 9.780 1085 HG21 VAL 139 HG21 VAL 139 6.688 12.107 6.757 1086 HG22 VAL 139 HG22 VAL 139 6.778 13.809 7.211 1087 HG23 VAL 139 HG23 VAL 139 5.552 12.767 7.933 1088 H SER 140 H SER 140 10.029 10.657 7.675 1089 HA SER 140 HA SER 140 12.064 10.615 9.698 1090 HB2 SER 140 HB3 SER 140 9.977 8.453 9.947 1091 HB3 SER 140 HB2 SER 140 11.297 8.829 11.054 1092 HG SER 140 HG SER 140 10.005 10.158 12.019 1093 H SER 141 H SER 141 13.304 8.537 9.665 1094 HA SER 141 HA SER 141 12.964 6.799 7.404 1095 HB2 SER 141 HB3 SER 141 15.376 7.417 6.598 1096 HB3 SER 141 HB2 SER 141 14.007 8.396 6.071 1097 HG SER 141 HG SER 141 14.520 9.852 7.780 1098 H ARG 142 H ARG 142 13.613 4.856 8.023 1099 HA ARG 142 HA ARG 142 15.890 4.617 9.862 1100 HB2 ARG 142 HB3 ARG 142 13.664 4.407 11.055 1101 HB3 ARG 142 HB2 ARG 142 13.384 2.951 10.111 1102 HG2 ARG 142 HG3 ARG 142 14.969 1.745 11.238 1103 HG3 ARG 142 HG2 ARG 142 15.906 3.175 11.673 1104 HD2 ARG 142 HD3 ARG 142 13.456 3.555 12.920 1105 HD3 ARG 142 HD2 ARG 142 13.782 1.834 13.121 1106 HE ARG 142 HE ARG 142 16.040 3.473 13.760 1107 HH11 ARG 142 HH11 ARG 142 13.043 2.181 14.996 1108 HH12 ARG 142 HH12 ARG 142 13.543 2.269 16.651 1109 HH21 ARG 142 HH21 ARG 142 16.699 3.589 15.937 1110 HH22 ARG 142 HH22 ARG 142 15.618 3.069 17.186 1111 H THR 143 H THR 143 17.383 3.270 9.100 1112 HA THR 143 HA THR 143 16.645 1.458 6.918 1113 HB THR 143 HB THR 143 19.485 1.921 7.698 1114 HG1 THR 143 HG1 THR 143 18.895 4.004 7.677 1115 HG21 THR 143 HG21 THR 143 19.981 1.319 5.603 1116 HG22 THR 143 HG22 THR 143 18.619 2.203 4.914 1117 HG23 THR 143 HG23 THR 143 18.368 0.606 5.621 1118 H VAL 144 H VAL 144 16.282 -0.589 7.422 1119 HA VAL 144 HA VAL 144 17.701 -1.759 9.719 1120 HB VAL 144 HB VAL 144 15.749 -3.562 9.226 1121 HG11 VAL 144 HG11 VAL 144 15.635 -1.108 10.962 1122 HG12 VAL 144 HG12 VAL 144 16.203 -2.718 11.403 1123 HG13 VAL 144 HG13 VAL 144 14.491 -2.445 11.081 1124 HG21 VAL 144 HG21 VAL 144 14.694 -2.295 7.464 1125 HG22 VAL 144 HG22 VAL 144 14.570 -0.882 8.511 1126 HG23 VAL 144 HG23 VAL 144 13.635 -2.333 8.874 1127 H GLU 145 H GLU 145 18.996 -3.482 9.419 1128 HA GLU 145 HA GLU 145 19.001 -4.739 6.754 1129 HB2 GLU 145 HB3 GLU 145 21.515 -5.115 7.293 1130 HB3 GLU 145 HB2 GLU 145 20.988 -3.542 6.711 1131 HG2 GLU 145 HG3 GLU 145 21.119 -2.593 8.866 1132 HG3 GLU 145 HG2 GLU 145 21.293 -4.174 9.628 1133 H ASP 146 H ASP 146 19.362 -6.933 6.638 1134 HA ASP 146 HA ASP 146 19.241 -8.375 9.204 1135 HB2 ASP 146 HB3 ASP 146 17.671 -8.613 6.734 1136 HB3 ASP 146 HB2 ASP 146 18.271 -10.151 7.345 1137 H THR 147 H THR 147 19.712 -10.913 8.427 1138 HA THR 147 HA THR 147 22.506 -11.008 8.149 1139 HB THR 147 HB THR 147 21.858 -13.517 7.498 1140 HG1 THR 147 HG1 THR 147 19.679 -13.231 7.251 1141 HG21 THR 147 HG21 THR 147 22.875 -13.484 9.510 1142 HG22 THR 147 HG22 THR 147 21.225 -13.758 10.069 1143 HG23 THR 147 HG23 THR 147 21.910 -12.133 10.103 1144 H ASN 148 H ASN 148 19.891 -11.426 5.821 1145 HA ASN 148 HA ASN 148 21.708 -12.034 3.660 1146 HB2 ASN 148 HB3 ASN 148 18.742 -11.787 3.947 1147 HB3 ASN 148 HB2 ASN 148 19.450 -11.680 2.338 1148 HD21 ASN 148 HD21 ASN 148 17.762 -13.715 3.820 1149 HD22 ASN 148 HD22 ASN 148 18.579 -15.212 3.542 1150 HA PRO 149 HA PRO 149 22.580 -7.817 2.546 1151 HB2 PRO 149 HB3 PRO 149 22.844 -8.857 -0.213 1152 HB3 PRO 149 HB2 PRO 149 24.027 -8.007 0.786 1153 HG2 PRO 149 HG3 PRO 149 24.259 -10.623 0.292 1154 HG3 PRO 149 HG2 PRO 149 24.698 -9.937 1.865 1155 HD2 PRO 149 HD3 PRO 149 22.242 -11.451 1.080 1156 HD3 PRO 149 HD2 PRO 149 23.194 -11.540 2.577 1157 H ALA 150 H ALA 150 20.334 -9.797 0.726 1158 HA ALA 150 HA ALA 150 19.078 -7.510 -0.538 1159 HB1 ALA 150 HB1 ALA 150 18.461 -10.456 -0.600 1160 HB2 ALA 150 HB2 ALA 150 19.205 -9.480 -1.867 1161 HB3 ALA 150 HB3 ALA 150 17.508 -9.238 -1.448 1162 H LEU 151 H LEU 151 18.794 -9.183 2.410 1163 HA LEU 151 HA LEU 151 15.979 -8.651 2.782 1164 HB2 LEU 151 HB3 LEU 151 18.136 -9.957 4.366 1165 HB3 LEU 151 HB2 LEU 151 16.727 -9.363 5.220 1166 HG LEU 151 HG LEU 151 16.845 -11.847 4.372 1167 HD11 LEU 151 HD11 LEU 151 14.473 -11.946 4.407 1168 HD12 LEU 151 HD12 LEU 151 14.335 -10.248 3.948 1169 HD13 LEU 151 HD13 LEU 151 14.968 -10.684 5.535 1170 HD21 LEU 151 HD21 LEU 151 17.294 -11.242 2.025 1171 HD22 LEU 151 HD22 LEU 151 15.725 -10.440 1.949 1172 HD23 LEU 151 HD23 LEU 151 15.813 -12.183 2.208 1173 H THR 152 H THR 152 18.468 -6.607 2.677 1174 HA THR 152 HA THR 152 17.897 -5.111 5.103 1175 HB THR 152 HB THR 152 19.731 -4.422 2.797 1176 HG1 THR 152 HG1 THR 152 20.370 -5.562 5.312 1177 HG21 THR 152 HG21 THR 152 19.375 -2.426 3.968 1178 HG22 THR 152 HG22 THR 152 20.892 -3.071 4.594 1179 HG23 THR 152 HG23 THR 152 19.408 -3.239 5.532 1180 H HIS 153 H HIS 153 16.314 -3.661 5.203 1181 HA HIS 153 HA HIS 153 15.479 -2.329 2.711 1182 HB2 HIS 153 HB3 HIS 153 13.425 -2.607 4.810 1183 HB3 HIS 153 HB2 HIS 153 13.286 -2.782 3.065 1184 HD1 HIS 153 HD1 HIS 153 12.563 -4.713 5.773 1185 HD2 HIS 153 HD2 HIS 153 15.041 -5.399 2.509 1186 HE1 HIS 153 HE1 HIS 153 12.785 -7.213 5.608 1187 HE2 HIS 153 HE2 HIS 153 14.359 -7.600 3.682 1188 H THR 154 H THR 154 14.264 -0.279 3.115 1189 HA THR 154 HA THR 154 15.205 1.100 5.535 1190 HB THR 154 HB THR 154 15.249 2.276 2.749 1191 HG1 THR 154 HG1 THR 154 16.887 0.698 3.094 1192 HG21 THR 154 HG21 THR 154 16.360 4.148 3.651 1193 HG22 THR 154 HG22 THR 154 16.525 3.380 5.230 1194 HG23 THR 154 HG23 THR 154 14.935 3.880 4.655 1195 H TYR 155 H TYR 155 13.526 1.852 6.625 1196 HA TYR 155 HA TYR 155 10.990 2.312 5.260 1197 HB2 TYR 155 HB3 TYR 155 11.838 1.873 8.082 1198 HB3 TYR 155 HB2 TYR 155 10.387 2.833 7.814 1199 HD1 TYR 155 HD1 TYR 155 8.414 1.821 6.731 1200 HD2 TYR 155 HD2 TYR 155 11.855 -0.491 7.687 1201 HE1 TYR 155 HE1 TYR 155 7.096 -0.239 6.468 1202 HE2 TYR 155 HE2 TYR 155 10.547 -2.557 7.426 1203 HH TYR 155 HH TYR 155 7.476 -2.620 5.988 1204 H GLU 156 H GLU 156 10.090 4.292 4.955 1205 HA GLU 156 HA GLU 156 11.348 6.602 6.248 1206 HB2 GLU 156 HB3 GLU 156 10.857 6.348 3.277 1207 HB3 GLU 156 HB2 GLU 156 11.347 7.827 4.092 1208 HG2 GLU 156 HG3 GLU 156 13.465 7.244 3.884 1209 HG3 GLU 156 HG2 GLU 156 13.166 5.796 4.844 1210 H VAL 157 H VAL 157 10.033 8.363 6.572 1211 HA VAL 157 HA VAL 157 7.179 7.930 6.013 1212 HB VAL 157 HB VAL 157 8.282 9.699 8.190 1213 HG11 VAL 157 HG11 VAL 157 5.572 8.805 7.324 1214 HG12 VAL 157 HG12 VAL 157 6.114 10.388 7.881 1215 HG13 VAL 157 HG13 VAL 157 5.864 9.085 9.041 1216 HG21 VAL 157 HG21 VAL 157 7.914 7.946 9.769 1217 HG22 VAL 157 HG22 VAL 157 8.935 7.298 8.485 1218 HG23 VAL 157 HG23 VAL 157 7.217 6.901 8.531 1219 H TRP 158 H TRP 158 5.937 9.647 5.371 1220 HA TRP 158 HA TRP 158 7.234 12.167 4.682 1221 HB2 TRP 158 HB3 TRP 158 5.933 10.427 2.587 1222 HB3 TRP 158 HB2 TRP 158 6.441 12.091 2.333 1223 HD1 TRP 158 HD1 TRP 158 7.921 8.597 3.003 1224 HE1 TRP 158 HE1 TRP 158 10.354 8.578 2.164 1225 HE3 TRP 158 HE3 TRP 158 8.393 13.535 1.765 1226 HZ2 TRP 158 HZ2 TRP 158 12.226 10.413 1.116 1227 HZ3 TRP 158 HZ3 TRP 158 10.537 14.322 0.851 1228 HH2 TRP 158 HH2 TRP 158 12.413 12.792 0.534 1229 H GLN 159 H GLN 159 5.913 13.896 4.690 1230 HA GLN 159 HA GLN 159 3.014 13.472 4.733 1231 HB2 GLN 159 HB3 GLN 159 4.689 14.465 6.956 1232 HB3 GLN 159 HB2 GLN 159 3.249 15.415 6.618 1233 HG2 GLN 159 HG3 GLN 159 2.227 12.908 6.595 1234 HG3 GLN 159 HG2 GLN 159 3.520 12.739 7.783 1235 HE21 GLN 159 HE21 GLN 159 3.385 13.822 9.720 1236 HE22 GLN 159 HE22 GLN 159 1.943 14.608 10.258 1237 H LYS 160 H LYS 160 1.943 14.959 3.542 1238 HA LYS 160 HA LYS 160 3.286 16.760 1.905 1239 HB2 LYS 160 HB3 LYS 160 0.810 15.770 1.898 1240 HB3 LYS 160 HB2 LYS 160 0.455 17.335 2.617 1241 HG2 LYS 160 HG3 LYS 160 1.264 18.493 0.717 1242 HG3 LYS 160 HG2 LYS 160 1.974 17.025 0.043 1243 HD2 LYS 160 HD3 LYS 160 0.078 16.945 -1.167 1244 HD3 LYS 160 HD2 LYS 160 -0.620 16.274 0.309 1245 HE2 LYS 160 HE3 LYS 160 -1.450 18.417 0.971 1246 HE3 LYS 160 HE2 LYS 160 -0.578 19.216 -0.338 1247 HZ1 LYS 160 HZ1 LYS 160 -2.915 17.407 -0.557 1248 HZ2 LYS 160 HZ2 LYS 160 -1.973 17.850 -1.890 1249 HZ3 LYS 160 HZ3 LYS 160 -2.812 19.032 -1.019 1250 H LYS 161 H LYS 161 3.585 18.963 1.929 1251 HA LYS 161 HA LYS 161 4.074 20.163 4.432 1252 HB2 LYS 161 HB3 LYS 161 3.784 21.530 1.751 1253 HB3 LYS 161 HB2 LYS 161 4.594 22.177 3.171 1254 HG2 LYS 161 HG3 LYS 161 6.323 20.535 3.018 1255 HG3 LYS 161 HG2 LYS 161 5.461 19.678 1.739 1256 HD2 LYS 161 HD3 LYS 161 6.771 20.869 0.355 1257 HD3 LYS 161 HD2 LYS 161 5.642 22.183 0.687 1258 HE2 LYS 161 HE3 LYS 161 8.229 21.645 2.142 1259 HE3 LYS 161 HE2 LYS 161 7.948 22.922 0.960 1260 HZ1 LYS 161 HZ1 LYS 161 7.633 24.045 2.908 1261 HZ2 LYS 161 HZ2 LYS 161 6.998 22.709 3.727 1262 HZ3 LYS 161 HZ3 LYS 161 6.044 23.546 2.609 1263 H ALA 162 H ALA 162 2.838 21.344 5.749 1264 HA ALA 162 HA ALA 162 1.014 22.369 6.642 1265 HB1 ALA 162 HB1 ALA 162 -0.252 23.900 5.149 1266 HB2 ALA 162 HB2 ALA 162 0.665 23.262 3.784 1267 HB3 ALA 162 HB3 ALA 162 1.496 24.126 5.077 1268 H51A NDP 170 H51A NDP 170 -5.347 -0.717 -9.251 1269 H52A NDP 170 H52A NDP 170 -5.837 -2.300 -8.635 1270 H4B NDP 170 H4B NDP 170 -7.199 -2.607 -10.754 1271 H3B NDP 170 H3B NDP 170 -6.323 0.239 -11.274 1272 HO3A NDP 170 HO3A NDP 170 -6.405 -0.658 -13.413 1273 H2B NDP 170 H2B NDP 170 -8.511 0.656 -12.155 1274 H1B NDP 170 H1B NDP 170 -9.886 -0.574 -10.109 1275 H8A NDP 170 H8A NDP 170 -6.664 1.099 -8.963 1276 H61A NDP 170 H61A NDP 170 -10.224 6.068 -7.891 1277 H62A NDP 170 H62A NDP 170 -8.603 5.421 -7.798 1278 H2A NDP 170 H2A NDP 170 -12.737 2.974 -9.951 1279 H51N NDP 170 H51N NDP 170 -1.261 -4.644 -9.873 1280 H52N NDP 170 H52N NDP 170 -1.141 -4.042 -8.211 1281 H4D NDP 170 H4D NDP 170 1.143 -5.227 -9.849 1282 H3D NDP 170 H3D NDP 170 -0.453 -6.353 -7.538 1283 HO3N NDP 170 HO3N NDP 170 -0.971 -7.527 -9.259 1284 H2D NDP 170 H2D NDP 170 1.562 -7.453 -6.842 1285 HO2N NDP 170 HO2N NDP 170 3.096 -7.995 -8.170 1286 H1D NDP 170 H1D NDP 170 3.208 -5.258 -7.211 1287 H2N NDP 170 H2N NDP 170 3.609 -5.093 -4.849 1288 H71N NDP 170 H71N NDP 170 5.293 -4.612 -2.146 1289 H72N NDP 170 H72N NDP 170 4.908 -5.239 -3.728 1290 H41N NDP 170 H41N NDP 170 0.536 -3.545 -2.841 1291 H42N NDP 170 H42N NDP 170 0.393 -5.307 -2.513 1292 H5N NDP 170 H5N NDP 170 -1.286 -4.559 -4.196 1293 H6N NDP 170 H6N NDP 170 -0.436 -5.065 -6.494 Start of MODEL 15 1 H1 THR 1 HT1 THR 1 -6.155 9.114 5.223 2 H2 THR 1 HT2 THR 1 -4.604 9.733 5.619 3 H3 THR 1 HT3 THR 1 -5.024 8.125 6.047 4 HA THR 1 HA THR 1 -5.086 7.457 3.820 5 HB THR 1 HB THR 1 -4.586 9.087 2.021 6 HG1 THR 1 HG1 THR 1 -4.797 11.010 4.094 7 HG21 THR 1 HG21 THR 1 -6.868 10.211 3.597 8 HG22 THR 1 HG22 THR 1 -6.966 8.631 2.819 9 HG23 THR 1 HG23 THR 1 -6.683 10.076 1.848 10 H ALA 2 H ALA 2 -3.325 6.230 4.153 11 HA ALA 2 HA ALA 2 -0.703 7.548 3.961 12 HB1 ALA 2 HB1 ALA 2 -0.601 7.098 6.194 13 HB2 ALA 2 HB2 ALA 2 -0.009 5.561 5.565 14 HB3 ALA 2 HB3 ALA 2 -1.689 5.714 6.079 15 H PHE 3 H PHE 3 0.894 6.410 2.887 16 HA PHE 3 HA PHE 3 -0.060 4.107 1.327 17 HB2 PHE 3 HB3 PHE 3 1.993 6.240 0.825 18 HB3 PHE 3 HB2 PHE 3 2.085 4.709 -0.036 19 HD1 PHE 3 HD1 PHE 3 -1.011 6.506 0.916 20 HD2 PHE 3 HD2 PHE 3 1.652 5.421 -2.221 21 HE1 PHE 3 HE1 PHE 3 -2.625 7.346 -0.739 22 HE2 PHE 3 HE2 PHE 3 0.042 6.260 -3.881 23 HZ PHE 3 HZ PHE 3 -2.097 7.225 -3.142 24 H LEU 4 H LEU 4 0.871 2.142 1.558 25 HA LEU 4 HA LEU 4 3.494 1.949 2.824 26 HB2 LEU 4 HB3 LEU 4 2.045 1.756 4.703 27 HB3 LEU 4 HB2 LEU 4 0.981 0.654 3.851 28 HG LEU 4 HG LEU 4 2.882 -1.004 3.819 29 HD11 LEU 4 HD11 LEU 4 4.513 -0.511 5.788 30 HD12 LEU 4 HD12 LEU 4 4.115 1.172 5.448 31 HD13 LEU 4 HD13 LEU 4 4.832 0.165 4.190 32 HD21 LEU 4 HD21 LEU 4 0.932 -0.629 5.601 33 HD22 LEU 4 HD22 LEU 4 2.325 -0.419 6.663 34 HD23 LEU 4 HD23 LEU 4 2.130 -1.915 5.751 35 H TRP 5 H TRP 5 4.687 0.797 1.462 36 HA TRP 5 HA TRP 5 3.823 -1.812 0.627 37 HB2 TRP 5 HB3 TRP 5 3.652 -1.523 -1.676 38 HB3 TRP 5 HB2 TRP 5 2.851 -0.086 -1.052 39 HD1 TRP 5 HD1 TRP 5 5.992 -1.195 -2.916 40 HE1 TRP 5 HE1 TRP 5 7.127 0.877 -3.935 41 HE3 TRP 5 HE3 TRP 5 3.139 2.434 -0.738 42 HZ2 TRP 5 HZ2 TRP 5 6.847 3.679 -3.828 43 HZ3 TRP 5 HZ3 TRP 5 3.633 4.792 -1.252 44 HH2 TRP 5 HH2 TRP 5 5.450 5.400 -2.766 45 H ALA 6 H ALA 6 5.523 -3.016 -0.498 46 HA ALA 6 HA ALA 6 8.178 -2.072 0.335 47 HB1 ALA 6 HB1 ALA 6 7.426 -4.859 -0.526 48 HB2 ALA 6 HB2 ALA 6 7.313 -4.291 1.140 49 HB3 ALA 6 HB3 ALA 6 8.879 -4.346 0.332 50 H GLN 7 H GLN 7 9.924 -1.997 -1.098 51 HA GLN 7 HA GLN 7 9.435 -2.679 -3.892 52 HB2 GLN 7 HB3 GLN 7 10.334 -0.416 -4.588 53 HB3 GLN 7 HB2 GLN 7 8.705 -0.430 -3.927 54 HG2 GLN 7 HG3 GLN 7 10.531 -0.038 -1.788 55 HG3 GLN 7 HG2 GLN 7 10.942 1.081 -3.086 56 HE21 GLN 7 HE21 GLN 7 8.374 0.000 -0.956 57 HE22 GLN 7 HE22 GLN 7 7.439 1.451 -1.037 58 H ASP 8 H ASP 8 11.369 -2.574 -5.235 59 HA ASP 8 HA ASP 8 13.751 -3.284 -3.683 60 HB2 ASP 8 HB3 ASP 8 14.550 -4.381 -5.700 61 HB3 ASP 8 HB2 ASP 8 12.910 -4.913 -5.353 62 H ARG 9 H ARG 9 15.725 -2.839 -5.612 63 HA ARG 9 HA ARG 9 16.301 -0.109 -5.195 64 HB2 ARG 9 HB3 ARG 9 17.526 -2.040 -7.175 65 HB3 ARG 9 HB2 ARG 9 18.211 -0.490 -6.707 66 HG2 ARG 9 HG3 ARG 9 17.846 -1.728 -4.291 67 HG3 ARG 9 HG2 ARG 9 18.296 -3.067 -5.349 68 HD2 ARG 9 HD3 ARG 9 20.365 -2.349 -4.668 69 HD3 ARG 9 HD2 ARG 9 20.160 -1.403 -6.142 70 HE ARG 9 HE ARG 9 19.163 0.221 -4.223 71 HH11 ARG 9 HH11 ARG 9 22.180 -1.500 -4.561 72 HH12 ARG 9 HH12 ARG 9 23.090 -0.333 -3.663 73 HH21 ARG 9 HH21 ARG 9 20.358 1.757 -3.042 74 HH22 ARG 9 HH22 ARG 9 22.056 1.516 -2.800 75 H ASP 10 H ASP 10 14.851 -1.853 -7.861 76 HA ASP 10 HA ASP 10 14.875 0.420 -9.643 77 HB2 ASP 10 HB3 ASP 10 14.214 -2.426 -9.817 78 HB3 ASP 10 HB2 ASP 10 13.105 -1.402 -10.725 79 H GLY 11 H GLY 11 13.180 -0.131 -6.957 80 HA2 GLY 11 HA3 GLY 11 11.336 1.018 -6.126 81 HA3 GLY 11 HA2 GLY 11 11.055 1.659 -7.738 82 H LEU 12 H LEU 12 11.418 -1.665 -7.876 83 HA LEU 12 HA LEU 12 8.925 -2.265 -8.854 84 HB2 LEU 12 HB3 LEU 12 11.133 -3.667 -8.624 85 HB3 LEU 12 HB2 LEU 12 10.378 -4.261 -7.160 86 HG LEU 12 HG LEU 12 8.569 -5.245 -8.396 87 HD11 LEU 12 HD11 LEU 12 9.156 -4.987 -11.080 88 HD12 LEU 12 HD12 LEU 12 9.414 -3.362 -10.445 89 HD13 LEU 12 HD13 LEU 12 7.860 -4.163 -10.213 90 HD21 LEU 12 HD21 LEU 12 10.763 -6.016 -10.203 91 HD22 LEU 12 HD22 LEU 12 9.744 -7.007 -9.157 92 HD23 LEU 12 HD23 LEU 12 11.114 -6.126 -8.477 93 H ILE 13 H ILE 13 7.444 -3.989 -7.698 94 HA ILE 13 HA ILE 13 7.089 -3.549 -4.886 95 HB ILE 13 HB ILE 13 4.876 -2.677 -4.903 96 HG12 ILE 13 HG13 ILE 13 4.742 -2.134 -7.815 97 HG13 ILE 13 HG12 ILE 13 4.493 -3.806 -7.334 98 HG21 ILE 13 HG21 ILE 13 6.725 -1.065 -5.066 99 HG22 ILE 13 HG22 ILE 13 5.228 -0.452 -5.771 100 HG23 ILE 13 HG23 ILE 13 6.522 -1.035 -6.818 101 HD11 ILE 13 HD11 ILE 13 2.636 -3.224 -5.975 102 HD12 ILE 13 HD12 ILE 13 2.418 -2.446 -7.542 103 HD13 ILE 13 HD13 ILE 13 2.970 -1.502 -6.160 104 H GLY 14 H GLY 14 5.967 -4.951 -7.904 105 HA2 GLY 14 HA3 GLY 14 5.474 -7.454 -6.484 106 HA3 GLY 14 HA2 GLY 14 4.125 -6.759 -7.369 107 H LYS 15 H LYS 15 4.653 -9.127 -8.174 108 HA LYS 15 HA LYS 15 6.074 -8.781 -10.717 109 HB2 LYS 15 HB3 LYS 15 6.866 -11.149 -10.524 110 HB3 LYS 15 HB2 LYS 15 7.597 -10.052 -9.361 111 HG2 LYS 15 HG3 LYS 15 6.973 -11.394 -7.721 112 HG3 LYS 15 HG2 LYS 15 5.283 -11.119 -8.148 113 HD2 LYS 15 HD3 LYS 15 5.699 -12.921 -9.960 114 HD3 LYS 15 HD2 LYS 15 7.111 -13.340 -8.989 115 HE2 LYS 15 HE3 LYS 15 4.807 -13.044 -7.300 116 HE3 LYS 15 HE2 LYS 15 4.451 -14.165 -8.613 117 HZ1 LYS 15 HZ1 LYS 15 5.669 -14.865 -6.348 118 HZ2 LYS 15 HZ2 LYS 15 7.017 -14.541 -7.317 119 HZ3 LYS 15 HZ3 LYS 15 5.875 -15.686 -7.814 120 H ASP 16 H ASP 16 3.525 -8.333 -10.776 121 HA ASP 16 HA ASP 16 1.664 -8.919 -11.972 122 HB2 ASP 16 HB3 ASP 16 3.486 -10.744 -12.928 123 HB3 ASP 16 HB2 ASP 16 2.226 -11.786 -12.275 124 H GLY 17 H GLY 17 2.045 -9.153 -9.094 125 HA2 GLY 17 HA3 GLY 17 -0.446 -10.275 -8.397 126 HA3 GLY 17 HA2 GLY 17 0.830 -11.410 -7.982 127 H HIS 18 H HIS 18 2.767 -10.204 -6.851 128 HA HIS 18 HA HIS 18 2.245 -7.941 -5.259 129 HB2 HIS 18 HB3 HIS 18 1.972 -9.012 -3.067 130 HB3 HIS 18 HB2 HIS 18 0.652 -9.435 -4.150 131 HD1 HIS 18 HD1 HIS 18 -0.004 -11.725 -3.470 132 HD2 HIS 18 HD2 HIS 18 4.120 -11.313 -3.773 133 HE1 HIS 18 HE1 HIS 18 0.931 -14.030 -3.102 134 HE2 HIS 18 HE2 HIS 18 3.424 -13.768 -3.355 135 H LEU 19 H LEU 19 3.813 -8.311 -3.083 136 HA LEU 19 HA LEU 19 6.412 -8.301 -4.188 137 HB2 LEU 19 HB3 LEU 19 7.171 -8.208 -1.811 138 HB3 LEU 19 HB2 LEU 19 6.019 -6.969 -2.266 139 HG LEU 19 HG LEU 19 4.313 -8.786 -1.265 140 HD11 LEU 19 HD11 LEU 19 6.946 -9.620 -0.372 141 HD12 LEU 19 HD12 LEU 19 5.394 -10.448 -0.250 142 HD13 LEU 19 HD13 LEU 19 5.861 -9.265 0.972 143 HD21 LEU 19 HD21 LEU 19 4.504 -7.508 0.890 144 HD22 LEU 19 HD22 LEU 19 4.327 -6.516 -0.558 145 HD23 LEU 19 HD23 LEU 19 5.910 -6.696 0.200 146 HA PRO 20 HA PRO 20 6.882 -12.778 -3.996 147 HB2 PRO 20 HB3 PRO 20 9.068 -12.959 -5.532 148 HB3 PRO 20 HB2 PRO 20 7.483 -12.586 -6.221 149 HG2 PRO 20 HG3 PRO 20 9.744 -10.737 -5.559 150 HG3 PRO 20 HG2 PRO 20 8.706 -10.764 -6.996 151 HD2 PRO 20 HD3 PRO 20 8.341 -9.061 -4.878 152 HD3 PRO 20 HD2 PRO 20 7.037 -9.587 -5.960 153 H TRP 21 H TRP 21 9.150 -10.353 -2.975 154 HA TRP 21 HA TRP 21 11.087 -12.183 -1.914 155 HB2 TRP 21 HB3 TRP 21 11.962 -10.087 -0.773 156 HB3 TRP 21 HB2 TRP 21 11.915 -10.047 -2.533 157 HD1 TRP 21 HD1 TRP 21 9.406 -9.049 0.268 158 HE1 TRP 21 HE1 TRP 21 8.398 -6.766 -0.359 159 HE3 TRP 21 HE3 TRP 21 11.858 -8.271 -4.148 160 HZ2 TRP 21 HZ2 TRP 21 8.613 -4.887 -2.456 161 HZ3 TRP 21 HZ3 TRP 21 11.398 -6.206 -5.404 162 HH2 TRP 21 HH2 TRP 21 9.809 -4.549 -4.574 163 H HIS 22 H HIS 22 11.551 -12.558 0.292 164 HA HIS 22 HA HIS 22 9.163 -12.642 1.954 165 HB2 HIS 22 HB3 HIS 22 11.202 -14.434 1.554 166 HB3 HIS 22 HB2 HIS 22 11.665 -13.695 3.084 167 HD1 HIS 22 HD1 HIS 22 8.726 -13.337 4.177 168 HD2 HIS 22 HD2 HIS 22 10.322 -16.828 2.586 169 HE1 HIS 22 HE1 HIS 22 7.345 -15.206 5.138 170 HE2 HIS 22 HE2 HIS 22 8.275 -17.302 4.094 171 H LEU 23 H LEU 23 8.777 -10.755 2.961 172 HA LEU 23 HA LEU 23 11.015 -9.459 4.366 173 HB2 LEU 23 HB3 LEU 23 8.895 -8.431 2.684 174 HB3 LEU 23 HB2 LEU 23 8.879 -7.659 4.258 175 HG LEU 23 HG LEU 23 11.322 -7.157 3.930 176 HD11 LEU 23 HD11 LEU 23 11.451 -7.149 1.138 177 HD12 LEU 23 HD12 LEU 23 10.869 -8.752 1.586 178 HD13 LEU 23 HD13 LEU 23 12.384 -8.146 2.255 179 HD21 LEU 23 HD21 LEU 23 10.334 -5.658 1.731 180 HD22 LEU 23 HD22 LEU 23 10.535 -5.151 3.407 181 HD23 LEU 23 HD23 LEU 23 9.017 -5.877 2.883 182 HA PRO 24 HA PRO 24 8.410 -11.275 7.739 183 HB2 PRO 24 HB3 PRO 24 10.972 -10.808 9.160 184 HB3 PRO 24 HB2 PRO 24 9.949 -12.249 9.127 185 HG2 PRO 24 HG3 PRO 24 12.260 -12.173 7.794 186 HG3 PRO 24 HG2 PRO 24 10.839 -12.996 7.124 187 HD2 PRO 24 HD3 PRO 24 11.993 -10.329 6.421 188 HD3 PRO 24 HD2 PRO 24 11.276 -11.563 5.366 189 H ASP 25 H ASP 25 10.714 -8.572 7.910 190 HA ASP 25 HA ASP 25 9.605 -7.334 10.169 191 HB2 ASP 25 HB3 ASP 25 10.934 -5.411 9.496 192 HB3 ASP 25 HB2 ASP 25 11.869 -6.884 9.317 193 H ASP 26 H ASP 26 8.930 -7.031 6.719 194 HA ASP 26 HA ASP 26 7.268 -4.751 6.903 195 HB2 ASP 26 HB3 ASP 26 8.350 -5.849 4.815 196 HB3 ASP 26 HB2 ASP 26 6.913 -6.867 4.800 197 H LEU 27 H LEU 27 6.383 -8.188 6.483 198 HA LEU 27 HA LEU 27 3.645 -7.888 6.772 199 HB2 LEU 27 HB3 LEU 27 3.760 -10.309 7.551 200 HB3 LEU 27 HB2 LEU 27 4.379 -9.944 5.958 201 HG LEU 27 HG LEU 27 6.636 -9.728 7.492 202 HD11 LEU 27 HD11 LEU 27 4.944 -10.800 9.279 203 HD12 LEU 27 HD12 LEU 27 6.677 -11.129 9.254 204 HD13 LEU 27 HD13 LEU 27 5.552 -12.268 8.514 205 HD21 LEU 27 HD21 LEU 27 7.362 -11.284 6.063 206 HD22 LEU 27 HD22 LEU 27 5.737 -11.243 5.381 207 HD23 LEU 27 HD23 LEU 27 6.155 -12.456 6.591 208 H HIS 28 H HIS 28 6.103 -8.581 9.246 209 HA HIS 28 HA HIS 28 4.381 -8.831 11.433 210 HB2 HIS 28 HB3 HIS 28 6.949 -9.258 11.221 211 HB3 HIS 28 HB2 HIS 28 7.092 -7.574 11.714 212 HD1 HIS 28 HD1 HIS 28 5.743 -7.040 14.067 213 HD2 HIS 28 HD2 HIS 28 6.817 -10.980 13.302 214 HE1 HIS 28 HE1 HIS 28 5.657 -8.204 16.294 215 HE2 HIS 28 HE2 HIS 28 6.396 -10.566 15.820 216 H TYR 29 H TYR 29 6.064 -5.970 10.170 217 HA TYR 29 HA TYR 29 5.013 -4.171 12.097 218 HB2 TYR 29 HB3 TYR 29 7.053 -3.933 10.469 219 HB3 TYR 29 HB2 TYR 29 5.851 -3.285 9.358 220 HD1 TYR 29 HD1 TYR 29 6.420 -2.868 13.032 221 HD2 TYR 29 HD2 TYR 29 6.046 -0.993 9.232 222 HE1 TYR 29 HE1 TYR 29 6.626 -0.666 14.106 223 HE2 TYR 29 HE2 TYR 29 6.252 1.215 10.295 224 HH TYR 29 HH TYR 29 7.329 2.102 12.503 225 H PHE 30 H PHE 30 3.867 -5.394 9.044 226 HA PHE 30 HA PHE 30 1.929 -3.437 8.475 227 HB2 PHE 30 HB3 PHE 30 2.844 -5.710 7.230 228 HB3 PHE 30 HB2 PHE 30 1.213 -6.177 7.699 229 HD1 PHE 30 HD2 PHE 30 -0.601 -4.277 7.189 230 HD2 PHE 30 HD1 PHE 30 3.111 -4.762 5.167 231 HE1 PHE 30 HE2 PHE 30 -1.506 -3.067 5.247 232 HE2 PHE 30 HE1 PHE 30 2.213 -3.553 3.221 233 HZ PHE 30 HZ PHE 30 -0.098 -2.704 3.259 234 H ARG 31 H ARG 31 1.408 -6.702 9.819 235 HA ARG 31 HA ARG 31 -1.254 -6.336 10.545 236 HB2 ARG 31 HB3 ARG 31 0.703 -8.356 10.811 237 HB3 ARG 31 HB2 ARG 31 0.043 -8.087 12.418 238 HG2 ARG 31 HG3 ARG 31 -2.191 -8.506 11.621 239 HG3 ARG 31 HG2 ARG 31 -1.606 -8.641 9.961 240 HD2 ARG 31 HD3 ARG 31 -0.327 -10.404 11.958 241 HD3 ARG 31 HD2 ARG 31 -2.010 -10.756 11.567 242 HE ARG 31 HE ARG 31 -0.870 -10.504 9.135 243 HH11 ARG 31 HH11 ARG 31 -0.026 -12.371 11.961 244 HH12 ARG 31 HH12 ARG 31 0.712 -13.646 11.052 245 HH21 ARG 31 HH21 ARG 31 0.099 -12.181 7.938 246 HH22 ARG 31 HH22 ARG 31 0.784 -13.539 8.768 247 H ALA 32 H ALA 32 1.638 -5.227 12.086 248 HA ALA 32 HA ALA 32 0.552 -4.863 14.694 249 HB1 ALA 32 HB1 ALA 32 2.611 -4.142 15.275 250 HB2 ALA 32 HB2 ALA 32 2.780 -3.128 13.842 251 HB3 ALA 32 HB3 ALA 32 3.056 -4.866 13.730 252 H GLN 33 H GLN 33 0.605 -2.933 11.781 253 HA GLN 33 HA GLN 33 -0.509 -0.642 13.234 254 HB2 GLN 33 HB3 GLN 33 1.115 -0.965 10.834 255 HB3 GLN 33 HB2 GLN 33 -0.251 0.113 10.580 256 HG2 GLN 33 HG3 GLN 33 1.193 0.612 13.066 257 HG3 GLN 33 HG2 GLN 33 2.170 0.827 11.614 258 HE21 GLN 33 HE21 GLN 33 1.618 2.431 10.138 259 HE22 GLN 33 HE22 GLN 33 0.539 3.719 10.541 260 H THR 34 H THR 34 -1.352 -3.110 10.933 261 HA THR 34 HA THR 34 -3.827 -1.793 10.180 262 HB THR 34 HB THR 34 -4.200 -3.838 8.816 263 HG1 THR 34 HG1 THR 34 -1.615 -4.600 9.671 264 HG21 THR 34 HG21 THR 34 -2.469 -3.493 7.200 265 HG22 THR 34 HG22 THR 34 -1.443 -2.712 8.403 266 HG23 THR 34 HG23 THR 34 -2.936 -1.933 7.877 267 H VAL 35 H VAL 35 -3.376 -2.640 13.001 268 HA VAL 35 HA VAL 35 -5.323 -4.786 13.321 269 HB VAL 35 HB VAL 35 -4.726 -3.821 15.879 270 HG11 VAL 35 HG11 VAL 35 -4.847 -6.199 14.641 271 HG12 VAL 35 HG12 VAL 35 -4.160 -5.972 16.250 272 HG13 VAL 35 HG13 VAL 35 -3.100 -6.053 14.843 273 HG21 VAL 35 HG21 VAL 35 -2.242 -3.871 14.167 274 HG22 VAL 35 HG22 VAL 35 -2.248 -3.893 15.931 275 HG23 VAL 35 HG23 VAL 35 -2.885 -2.496 15.064 276 H GLY 36 H GLY 36 -7.296 -3.987 12.820 277 HA2 GLY 36 HA3 GLY 36 -9.328 -3.080 13.537 278 HA3 GLY 36 HA2 GLY 36 -8.458 -2.138 14.739 279 H LYS 37 H LYS 37 -7.369 -2.112 11.445 280 HA LYS 37 HA LYS 37 -8.465 0.611 11.153 281 HB2 LYS 37 HB3 LYS 37 -5.888 -0.469 10.000 282 HB3 LYS 37 HB2 LYS 37 -6.491 1.175 9.836 283 HG2 LYS 37 HG3 LYS 37 -6.440 0.720 12.577 284 HG3 LYS 37 HG2 LYS 37 -4.963 -0.029 11.969 285 HD2 LYS 37 HD3 LYS 37 -4.018 1.953 11.522 286 HD3 LYS 37 HD2 LYS 37 -5.491 2.584 10.784 287 HE2 LYS 37 HE3 LYS 37 -6.035 3.708 12.631 288 HE3 LYS 37 HE2 LYS 37 -5.768 2.296 13.652 289 HZ1 LYS 37 HZ1 LYS 37 -3.266 2.953 13.146 290 HZ2 LYS 37 HZ2 LYS 37 -4.130 3.615 14.441 291 HZ3 LYS 37 HZ3 LYS 37 -3.961 4.489 13.003 292 H ILE 38 H ILE 38 -8.054 1.179 8.596 293 HA ILE 38 HA ILE 38 -9.369 -0.981 7.085 294 HB ILE 38 HB ILE 38 -10.031 1.562 5.938 295 HG12 ILE 38 HG13 ILE 38 -11.643 1.679 8.281 296 HG13 ILE 38 HG12 ILE 38 -9.966 1.663 8.803 297 HG21 ILE 38 HG21 ILE 38 -11.163 -0.693 5.751 298 HG22 ILE 38 HG22 ILE 38 -12.221 0.705 5.941 299 HG23 ILE 38 HG23 ILE 38 -11.894 -0.345 7.317 300 HD11 ILE 38 HD11 ILE 38 -11.177 3.580 6.830 301 HD12 ILE 38 HD12 ILE 38 -9.497 3.571 7.363 302 HD13 ILE 38 HD13 ILE 38 -10.785 3.926 8.514 303 H MET 39 H MET 39 -8.250 -1.623 5.370 304 HA MET 39 HA MET 39 -6.200 0.186 4.281 305 HB2 MET 39 HB3 MET 39 -5.266 -1.857 5.164 306 HB3 MET 39 HB2 MET 39 -6.395 -2.829 4.234 307 HG2 MET 39 HG3 MET 39 -5.321 -1.800 2.169 308 HG3 MET 39 HG2 MET 39 -4.053 -1.234 3.255 309 HE1 MET 39 HE1 MET 39 -5.658 -5.137 3.729 310 HE2 MET 39 HE2 MET 39 -5.179 -5.444 2.060 311 HE3 MET 39 HE3 MET 39 -6.258 -4.100 2.434 312 H VAL 40 H VAL 40 -6.306 0.866 2.240 313 HA VAL 40 HA VAL 40 -8.581 0.067 0.614 314 HB VAL 40 HB VAL 40 -6.462 2.104 -0.070 315 HG11 VAL 40 HG11 VAL 40 -9.057 1.275 -1.236 316 HG12 VAL 40 HG12 VAL 40 -7.585 1.839 -2.028 317 HG13 VAL 40 HG13 VAL 40 -8.671 2.995 -1.257 318 HG21 VAL 40 HG21 VAL 40 -7.320 2.895 1.964 319 HG22 VAL 40 HG22 VAL 40 -8.959 2.373 1.576 320 HG23 VAL 40 HG23 VAL 40 -8.248 3.747 0.730 321 H VAL 41 H VAL 41 -8.389 -1.638 -0.679 322 HA VAL 41 HA VAL 41 -5.770 -2.160 -1.916 323 HB VAL 41 HB VAL 41 -7.087 -3.854 -0.285 324 HG11 VAL 41 HG11 VAL 41 -7.920 -4.718 -3.051 325 HG12 VAL 41 HG12 VAL 41 -8.998 -4.073 -1.814 326 HG13 VAL 41 HG13 VAL 41 -8.173 -5.607 -1.549 327 HG21 VAL 41 HG21 VAL 41 -4.974 -4.025 -2.231 328 HG22 VAL 41 HG22 VAL 41 -5.814 -5.568 -2.075 329 HG23 VAL 41 HG23 VAL 41 -5.115 -4.795 -0.652 330 H GLY 42 H GLY 42 -5.628 -2.546 -4.096 331 HA2 GLY 42 HA3 GLY 42 -7.766 -1.484 -5.705 332 HA3 GLY 42 HA2 GLY 42 -6.206 -2.051 -6.283 333 H ARG 43 H ARG 43 -8.177 -2.680 -7.875 334 HA ARG 43 HA ARG 43 -9.700 -4.949 -7.309 335 HB2 ARG 43 HB3 ARG 43 -10.112 -3.484 -9.239 336 HB3 ARG 43 HB2 ARG 43 -8.622 -4.049 -9.983 337 HG2 ARG 43 HG3 ARG 43 -9.836 -6.403 -9.587 338 HG3 ARG 43 HG2 ARG 43 -11.251 -5.364 -9.763 339 HD2 ARG 43 HD3 ARG 43 -8.969 -5.635 -11.717 340 HD3 ARG 43 HD2 ARG 43 -10.597 -6.282 -11.913 341 HE ARG 43 HE ARG 43 -10.473 -3.425 -11.528 342 HH11 ARG 43 HH11 ARG 43 -10.460 -6.032 -13.851 343 HH12 ARG 43 HH12 ARG 43 -11.006 -5.035 -15.157 344 HH21 ARG 43 HH21 ARG 43 -11.189 -2.116 -13.244 345 HH22 ARG 43 HH22 ARG 43 -11.420 -2.813 -14.813 346 H ARG 44 H ARG 44 -6.735 -4.805 -9.287 347 HA ARG 44 HA ARG 44 -6.356 -7.554 -9.504 348 HB2 ARG 44 HB3 ARG 44 -4.989 -5.220 -10.290 349 HB3 ARG 44 HB2 ARG 44 -3.821 -6.189 -9.404 350 HG2 ARG 44 HG3 ARG 44 -3.741 -6.671 -11.783 351 HG3 ARG 44 HG2 ARG 44 -4.261 -8.086 -10.866 352 HD2 ARG 44 HD3 ARG 44 -5.752 -8.080 -12.628 353 HD3 ARG 44 HD2 ARG 44 -6.654 -7.217 -11.384 354 HE ARG 44 HE ARG 44 -6.648 -5.392 -12.740 355 HH11 ARG 44 HH11 ARG 44 -4.010 -7.464 -13.701 356 HH12 ARG 44 HH12 ARG 44 -3.574 -6.488 -15.063 357 HH21 ARG 44 HH21 ARG 44 -6.077 -4.107 -14.532 358 HH22 ARG 44 HH22 ARG 44 -4.747 -4.582 -15.535 359 H THR 45 H THR 45 -5.819 -5.477 -6.811 360 HA THR 45 HA THR 45 -3.869 -7.132 -5.527 361 HB THR 45 HB THR 45 -5.565 -5.206 -4.000 362 HG1 THR 45 HG1 THR 45 -5.164 -3.909 -5.673 363 HG21 THR 45 HG21 THR 45 -3.872 -6.150 -2.687 364 HG22 THR 45 HG22 THR 45 -3.269 -4.558 -3.148 365 HG23 THR 45 HG23 THR 45 -2.675 -5.999 -3.973 366 H TYR 46 H TYR 46 -7.334 -6.486 -4.814 367 HA TYR 46 HA TYR 46 -7.656 -8.240 -2.726 368 HB2 TYR 46 HB3 TYR 46 -9.997 -8.248 -3.164 369 HB3 TYR 46 HB2 TYR 46 -9.406 -6.672 -3.670 370 HD1 TYR 46 HD2 TYR 46 -9.940 -10.066 -5.182 371 HD2 TYR 46 HD1 TYR 46 -10.269 -5.846 -5.644 372 HE1 TYR 46 HE2 TYR 46 -10.943 -10.394 -7.389 373 HE2 TYR 46 HE1 TYR 46 -11.292 -6.171 -7.854 374 HH TYR 46 HH TYR 46 -11.069 -8.492 -9.667 375 H GLU 47 H GLU 47 -7.544 -8.959 -6.155 376 HA GLU 47 HA GLU 47 -8.140 -11.767 -5.758 377 HB2 GLU 47 HB3 GLU 47 -7.232 -11.672 -8.297 378 HB3 GLU 47 HB2 GLU 47 -8.895 -11.328 -7.849 379 HG2 GLU 47 HG3 GLU 47 -8.586 -9.021 -8.053 380 HG3 GLU 47 HG2 GLU 47 -6.830 -9.163 -8.007 381 H SER 48 H SER 48 -5.388 -9.727 -6.009 382 HA SER 48 HA SER 48 -3.581 -12.028 -6.240 383 HB2 SER 48 HB3 SER 48 -2.989 -9.067 -6.448 384 HB3 SER 48 HB2 SER 48 -1.812 -10.361 -6.667 385 HG SER 48 HG SER 48 -2.633 -10.808 -8.577 386 H PHE 49 H PHE 49 -5.113 -11.183 -3.781 387 HA PHE 49 HA PHE 49 -2.846 -10.617 -1.997 388 HB2 PHE 49 HB3 PHE 49 -5.224 -9.337 -2.092 389 HB3 PHE 49 HB2 PHE 49 -5.598 -10.584 -0.908 390 HD1 PHE 49 HD1 PHE 49 -3.178 -7.873 -1.674 391 HD2 PHE 49 HD2 PHE 49 -4.931 -10.354 1.308 392 HE1 PHE 49 HE1 PHE 49 -2.077 -6.541 0.077 393 HE2 PHE 49 HE2 PHE 49 -3.833 -9.026 3.063 394 HZ PHE 49 HZ PHE 49 -2.404 -7.117 2.449 395 HA PRO 50 HA PRO 50 -3.184 -14.807 -0.560 396 HB2 PRO 50 HB3 PRO 50 -1.443 -14.709 1.467 397 HB3 PRO 50 HB2 PRO 50 -0.909 -14.554 -0.212 398 HG2 PRO 50 HG3 PRO 50 -1.335 -12.425 1.845 399 HG3 PRO 50 HG2 PRO 50 -0.028 -12.591 0.660 400 HD2 PRO 50 HD3 PRO 50 -2.221 -10.948 0.347 401 HD3 PRO 50 HD2 PRO 50 -1.244 -11.584 -0.990 402 H LYS 51 H LYS 51 -3.930 -12.072 1.463 403 HA LYS 51 HA LYS 51 -5.578 -13.828 3.152 404 HB2 LYS 51 HB3 LYS 51 -3.317 -12.650 4.090 405 HB3 LYS 51 HB2 LYS 51 -4.504 -11.405 4.454 406 HG2 LYS 51 HG3 LYS 51 -4.425 -12.705 6.381 407 HG3 LYS 51 HG2 LYS 51 -5.867 -13.275 5.539 408 HD2 LYS 51 HD3 LYS 51 -4.686 -15.197 6.310 409 HD3 LYS 51 HD2 LYS 51 -4.459 -15.108 4.563 410 HE2 LYS 51 HE3 LYS 51 -2.343 -13.647 5.520 411 HE3 LYS 51 HE2 LYS 51 -2.503 -14.923 6.725 412 HZ1 LYS 51 HZ1 LYS 51 -2.699 -16.350 4.504 413 HZ2 LYS 51 HZ2 LYS 51 -1.219 -16.023 5.255 414 HZ3 LYS 51 HZ3 LYS 51 -1.716 -15.097 3.930 415 H ARG 52 H ARG 52 -7.300 -13.207 1.714 416 HA ARG 52 HA ARG 52 -8.298 -10.487 2.244 417 HB2 ARG 52 HB3 ARG 52 -9.547 -10.792 0.037 418 HB3 ARG 52 HB2 ARG 52 -7.813 -10.515 -0.055 419 HG2 ARG 52 HG3 ARG 52 -7.367 -12.640 -0.769 420 HG3 ARG 52 HG2 ARG 52 -8.798 -13.319 0.009 421 HD2 ARG 52 HD3 ARG 52 -9.425 -11.372 -2.072 422 HD3 ARG 52 HD2 ARG 52 -8.526 -12.765 -2.671 423 HE ARG 52 HE ARG 52 -10.758 -13.449 -0.989 424 HH11 ARG 52 HH11 ARG 52 -9.734 -12.740 -4.249 425 HH12 ARG 52 HH12 ARG 52 -11.053 -13.589 -4.982 426 HH21 ARG 52 HH21 ARG 52 -12.494 -14.567 -1.951 427 HH22 ARG 52 HH22 ARG 52 -12.620 -14.626 -3.678 428 HA PRO 53 HA PRO 53 -9.341 -9.644 3.435 429 HB2 PRO 53 HB3 PRO 53 -10.765 -9.265 5.671 430 HB3 PRO 53 HB2 PRO 53 -11.470 -9.028 4.068 431 HG2 PRO 53 HG3 PRO 53 -11.851 -11.252 5.994 432 HG3 PRO 53 HG2 PRO 53 -12.978 -10.588 4.799 433 HD2 PRO 53 HD3 PRO 53 -11.403 -12.921 4.537 434 HD3 PRO 53 HD2 PRO 53 -12.348 -12.126 3.265 435 H LEU 54 H LEU 54 -8.327 -8.843 5.507 436 HA LEU 54 HA LEU 54 -6.609 -10.915 6.559 437 HB2 LEU 54 HB3 LEU 54 -6.691 -7.932 6.808 438 HB3 LEU 54 HB2 LEU 54 -5.626 -8.890 7.816 439 HG LEU 54 HG LEU 54 -5.409 -9.514 4.962 440 HD11 LEU 54 HD11 LEU 54 -5.898 -7.048 4.948 441 HD12 LEU 54 HD12 LEU 54 -4.344 -7.516 4.258 442 HD13 LEU 54 HD13 LEU 54 -4.417 -6.826 5.879 443 HD21 LEU 54 HD21 LEU 54 -3.358 -8.673 7.005 444 HD22 LEU 54 HD22 LEU 54 -3.056 -9.469 5.461 445 HD23 LEU 54 HD23 LEU 54 -3.898 -10.332 6.748 446 HA PRO 55 HA PRO 55 -8.692 -11.476 10.392 447 HB2 PRO 55 HB3 PRO 55 -6.700 -12.322 11.975 448 HB3 PRO 55 HB2 PRO 55 -7.282 -13.284 10.611 449 HG2 PRO 55 HG3 PRO 55 -4.866 -11.526 10.795 450 HG3 PRO 55 HG2 PRO 55 -5.025 -13.136 10.070 451 HD2 PRO 55 HD3 PRO 55 -5.065 -10.808 8.629 452 HD3 PRO 55 HD2 PRO 55 -5.868 -12.302 8.110 453 H GLU 56 H GLU 56 -9.383 -10.286 12.002 454 HA GLU 56 HA GLU 56 -9.586 -8.712 13.607 455 HB2 GLU 56 HB3 GLU 56 -6.607 -9.114 13.697 456 HB3 GLU 56 HB2 GLU 56 -7.445 -8.027 14.795 457 HG2 GLU 56 HG3 GLU 56 -8.832 -9.930 15.550 458 HG3 GLU 56 HG2 GLU 56 -7.869 -10.993 14.525 459 H ARG 57 H ARG 57 -9.199 -7.816 10.757 460 HA ARG 57 HA ARG 57 -8.806 -5.024 11.443 461 HB2 ARG 57 HB3 ARG 57 -7.179 -4.579 9.765 462 HB3 ARG 57 HB2 ARG 57 -6.583 -5.926 10.721 463 HG2 ARG 57 HG3 ARG 57 -6.607 -7.335 8.992 464 HG3 ARG 57 HG2 ARG 57 -8.149 -6.732 8.388 465 HD2 ARG 57 HD3 ARG 57 -5.388 -5.767 7.844 466 HD3 ARG 57 HD2 ARG 57 -6.687 -6.130 6.719 467 HE ARG 57 HE ARG 57 -7.697 -4.021 7.972 468 HH11 ARG 57 HH11 ARG 57 -4.522 -4.553 6.623 469 HH12 ARG 57 HH12 ARG 57 -4.223 -2.872 6.341 470 HH21 ARG 57 HH21 ARG 57 -7.313 -1.813 7.594 471 HH22 ARG 57 HH22 ARG 57 -5.810 -1.312 6.894 472 H THR 58 H THR 58 -9.163 -3.685 9.271 473 HA THR 58 HA THR 58 -11.590 -4.812 8.042 474 HB THR 58 HB THR 58 -10.928 -1.886 8.040 475 HG1 THR 58 HG1 THR 58 -12.323 -3.216 10.115 476 HG21 THR 58 HG21 THR 58 -12.836 -2.648 6.704 477 HG22 THR 58 HG22 THR 58 -13.321 -1.591 8.030 478 HG23 THR 58 HG23 THR 58 -13.562 -3.333 8.157 479 H ASN 59 H ASN 59 -11.811 -4.866 5.850 480 HA ASN 59 HA ASN 59 -9.454 -4.040 4.289 481 HB2 ASN 59 HB3 ASN 59 -11.220 -6.435 4.153 482 HB3 ASN 59 HB2 ASN 59 -10.553 -5.818 2.645 483 HD21 ASN 59 HD21 ASN 59 -9.260 -6.089 5.933 484 HD22 ASN 59 HD22 ASN 59 -7.855 -6.989 5.488 485 H VAL 60 H VAL 60 -9.765 -3.216 2.193 486 HA VAL 60 HA VAL 60 -12.476 -2.351 1.492 487 HB VAL 60 HB VAL 60 -10.074 -0.521 1.634 488 HG11 VAL 60 HG11 VAL 60 -12.268 1.039 1.050 489 HG12 VAL 60 HG12 VAL 60 -12.493 -0.380 0.026 490 HG13 VAL 60 HG13 VAL 60 -11.004 0.559 -0.082 491 HG21 VAL 60 HG21 VAL 60 -12.046 -1.159 3.540 492 HG22 VAL 60 HG22 VAL 60 -12.418 0.460 2.948 493 HG23 VAL 60 HG23 VAL 60 -10.826 0.112 3.623 494 H VAL 61 H VAL 61 -12.904 -2.655 -0.613 495 HA VAL 61 HA VAL 61 -10.643 -3.295 -2.385 496 HB VAL 61 HB VAL 61 -13.526 -4.184 -2.526 497 HG11 VAL 61 HG11 VAL 61 -13.241 -4.489 -4.708 498 HG12 VAL 61 HG12 VAL 61 -11.986 -5.670 -4.332 499 HG13 VAL 61 HG13 VAL 61 -11.555 -3.983 -4.612 500 HG21 VAL 61 HG21 VAL 61 -12.626 -5.593 -0.976 501 HG22 VAL 61 HG22 VAL 61 -10.989 -5.429 -1.614 502 HG23 VAL 61 HG23 VAL 61 -12.161 -6.452 -2.445 503 H LEU 62 H LEU 62 -10.365 -2.259 -4.278 504 HA LEU 62 HA LEU 62 -12.371 -0.248 -5.052 505 HB2 LEU 62 HB3 LEU 62 -10.192 0.612 -3.964 506 HB3 LEU 62 HB2 LEU 62 -9.423 0.148 -5.470 507 HG LEU 62 HG LEU 62 -11.105 1.646 -6.645 508 HD11 LEU 62 HD11 LEU 62 -12.356 1.707 -4.240 509 HD12 LEU 62 HD12 LEU 62 -12.579 2.902 -5.518 510 HD13 LEU 62 HD13 LEU 62 -11.453 3.221 -4.198 511 HD21 LEU 62 HD21 LEU 62 -9.168 2.924 -4.720 512 HD22 LEU 62 HD22 LEU 62 -9.839 3.673 -6.168 513 HD23 LEU 62 HD23 LEU 62 -8.770 2.278 -6.313 514 H THR 63 H THR 63 -13.285 -1.320 -6.734 515 HA THR 63 HA THR 63 -11.527 -1.929 -9.006 516 HB THR 63 HB THR 63 -12.134 -4.061 -8.029 517 HG1 THR 63 HG1 THR 63 -12.269 -3.735 -10.379 518 HG21 THR 63 HG21 THR 63 -14.835 -4.399 -8.432 519 HG22 THR 63 HG22 THR 63 -14.722 -2.817 -7.660 520 HG23 THR 63 HG23 THR 63 -14.019 -4.233 -6.878 521 H HIS 64 H HIS 64 -12.354 -1.419 -11.033 522 HA HIS 64 HA HIS 64 -14.237 0.671 -11.150 523 HB2 HIS 64 HB3 HIS 64 -12.800 -0.996 -13.163 524 HB3 HIS 64 HB2 HIS 64 -14.183 -0.055 -13.707 525 HD1 HIS 64 HD1 HIS 64 -13.404 2.338 -11.606 526 HD2 HIS 64 HD2 HIS 64 -11.060 0.677 -14.606 527 HE1 HIS 64 HE1 HIS 64 -11.688 4.087 -12.167 528 HE2 HIS 64 HE2 HIS 64 -10.335 3.092 -14.043 529 H GLN 65 H GLN 65 -14.547 -2.788 -11.466 530 HA GLN 65 HA GLN 65 -16.936 -3.065 -12.796 531 HB2 GLN 65 HB3 GLN 65 -15.586 -4.636 -10.646 532 HB3 GLN 65 HB2 GLN 65 -17.234 -5.061 -11.089 533 HG2 GLN 65 HG3 GLN 65 -16.597 -6.019 -12.996 534 HG3 GLN 65 HG2 GLN 65 -15.481 -4.711 -13.388 535 HE21 GLN 65 HE21 GLN 65 -13.439 -4.701 -12.094 536 HE22 GLN 65 HE22 GLN 65 -12.698 -6.228 -11.772 537 H GLU 66 H GLU 66 -18.985 -2.561 -12.414 538 HA GLU 66 HA GLU 66 -19.675 -1.187 -9.965 539 HB2 GLU 66 HB3 GLU 66 -21.435 -1.868 -12.327 540 HB3 GLU 66 HB2 GLU 66 -21.795 -0.712 -11.052 541 HG2 GLU 66 HG3 GLU 66 -19.347 0.108 -12.090 542 HG3 GLU 66 HG2 GLU 66 -20.306 -0.360 -13.493 543 H ASP 67 H ASP 67 -20.309 -4.252 -11.525 544 HA ASP 67 HA ASP 67 -22.178 -5.031 -9.425 545 HB2 ASP 67 HB3 ASP 67 -21.509 -6.033 -12.139 546 HB3 ASP 67 HB2 ASP 67 -22.057 -7.223 -10.962 547 H TYR 68 H TYR 68 -19.135 -4.739 -9.103 548 HA TYR 68 HA TYR 68 -18.214 -7.417 -8.631 549 HB2 TYR 68 HB3 TYR 68 -16.644 -5.606 -9.197 550 HB3 TYR 68 HB2 TYR 68 -17.061 -4.777 -7.701 551 HD1 TYR 68 HD1 TYR 68 -15.587 -7.924 -9.020 552 HD2 TYR 68 HD2 TYR 68 -15.919 -5.267 -5.715 553 HE1 TYR 68 HE1 TYR 68 -13.828 -9.177 -7.845 554 HE2 TYR 68 HE2 TYR 68 -14.159 -6.510 -4.532 555 HH TYR 68 HH TYR 68 -12.470 -8.046 -4.819 556 H GLN 69 H GLN 69 -18.072 -8.522 -6.707 557 HA GLN 69 HA GLN 69 -19.292 -7.235 -4.356 558 HB2 GLN 69 HB3 GLN 69 -19.698 -10.120 -5.149 559 HB3 GLN 69 HB2 GLN 69 -20.463 -9.271 -3.813 560 HG2 GLN 69 HG3 GLN 69 -20.861 -8.636 -6.728 561 HG3 GLN 69 HG2 GLN 69 -21.963 -9.580 -5.727 562 HE21 GLN 69 HE21 GLN 69 -21.393 -6.599 -6.971 563 HE22 GLN 69 HE22 GLN 69 -22.305 -5.639 -5.861 564 H ALA 70 H ALA 70 -17.719 -7.002 -2.918 565 HA ALA 70 HA ALA 70 -15.740 -9.155 -2.604 566 HB1 ALA 70 HB1 ALA 70 -14.165 -7.609 -2.203 567 HB2 ALA 70 HB2 ALA 70 -15.234 -6.638 -1.191 568 HB3 ALA 70 HB3 ALA 70 -15.304 -6.488 -2.946 569 H GLN 71 H GLN 71 -16.748 -10.547 -1.222 570 HA GLN 71 HA GLN 71 -18.221 -9.708 1.064 571 HB2 GLN 71 HB3 GLN 71 -17.084 -12.391 0.270 572 HB3 GLN 71 HB2 GLN 71 -18.087 -12.141 1.693 573 HG2 GLN 71 HG3 GLN 71 -19.547 -12.935 0.055 574 HG3 GLN 71 HG2 GLN 71 -19.831 -11.196 0.110 575 HE21 GLN 71 HE21 GLN 71 -17.852 -13.601 -1.582 576 HE22 GLN 71 HE22 GLN 71 -17.937 -12.837 -3.129 577 H GLY 72 H GLY 72 -17.508 -9.135 3.006 578 HA2 GLY 72 HA3 GLY 72 -16.142 -9.513 4.938 579 HA3 GLY 72 HA2 GLY 72 -14.864 -10.081 3.876 580 H ALA 73 H ALA 73 -15.328 -7.752 2.022 581 HA ALA 73 HA ALA 73 -14.171 -5.640 3.719 582 HB1 ALA 73 HB1 ALA 73 -12.668 -5.053 1.876 583 HB2 ALA 73 HB2 ALA 73 -13.291 -6.412 0.939 584 HB3 ALA 73 HB3 ALA 73 -12.400 -6.705 2.433 585 H VAL 74 H VAL 74 -14.200 -3.467 2.541 586 HA VAL 74 HA VAL 74 -16.920 -2.980 1.689 587 HB VAL 74 HB VAL 74 -14.703 -0.940 1.804 588 HG11 VAL 74 HG11 VAL 74 -17.192 -0.665 0.842 589 HG12 VAL 74 HG12 VAL 74 -16.311 0.640 1.635 590 HG13 VAL 74 HG13 VAL 74 -17.491 -0.306 2.543 591 HG21 VAL 74 HG21 VAL 74 -15.807 -2.461 3.974 592 HG22 VAL 74 HG22 VAL 74 -16.254 -0.763 4.143 593 HG23 VAL 74 HG23 VAL 74 -14.556 -1.219 4.005 594 H VAL 75 H VAL 75 -17.601 -2.251 -0.301 595 HA VAL 75 HA VAL 75 -15.613 -2.455 -2.468 596 HB VAL 75 HB VAL 75 -18.577 -2.985 -2.669 597 HG11 VAL 75 HG11 VAL 75 -16.371 -2.830 -4.617 598 HG12 VAL 75 HG12 VAL 75 -18.101 -2.564 -4.834 599 HG13 VAL 75 HG13 VAL 75 -17.459 -4.206 -4.796 600 HG21 VAL 75 HG21 VAL 75 -18.244 -5.116 -2.095 601 HG22 VAL 75 HG22 VAL 75 -16.684 -4.593 -1.460 602 HG23 VAL 75 HG23 VAL 75 -16.797 -5.241 -3.096 603 H VAL 76 H VAL 76 -15.349 -0.838 -3.834 604 HA VAL 76 HA VAL 76 -17.377 1.120 -4.380 605 HB VAL 76 HB VAL 76 -16.134 3.086 -3.674 606 HG11 VAL 76 HG11 VAL 76 -16.355 1.206 -1.332 607 HG12 VAL 76 HG12 VAL 76 -17.738 1.969 -2.116 608 HG13 VAL 76 HG13 VAL 76 -16.516 2.962 -1.323 609 HG21 VAL 76 HG21 VAL 76 -14.220 2.296 -1.889 610 HG22 VAL 76 HG22 VAL 76 -13.915 2.848 -3.537 611 HG23 VAL 76 HG23 VAL 76 -14.024 1.121 -3.191 612 H HIS 77 H HIS 77 -16.657 2.641 -6.099 613 HA HIS 77 HA HIS 77 -14.351 1.571 -7.587 614 HB2 HIS 77 HB3 HIS 77 -16.583 2.656 -9.192 615 HB3 HIS 77 HB2 HIS 77 -15.533 1.278 -9.504 616 HD1 HIS 77 HD1 HIS 77 -16.124 -0.691 -7.421 617 HD2 HIS 77 HD2 HIS 77 -19.109 1.747 -8.974 618 HE1 HIS 77 HE1 HIS 77 -18.285 -1.884 -6.940 619 HE2 HIS 77 HE2 HIS 77 -20.082 -0.351 -7.815 620 H ASP 78 H ASP 78 -15.826 4.349 -6.303 621 HA ASP 78 HA ASP 78 -14.254 6.054 -8.103 622 HB2 ASP 78 HB3 ASP 78 -16.808 6.496 -6.607 623 HB3 ASP 78 HB2 ASP 78 -15.783 7.877 -6.984 624 H VAL 79 H VAL 79 -13.186 7.902 -7.190 625 HA VAL 79 HA VAL 79 -11.730 7.248 -4.819 626 HB VAL 79 HB VAL 79 -11.709 9.867 -6.320 627 HG11 VAL 79 HG11 VAL 79 -9.817 10.424 -5.170 628 HG12 VAL 79 HG12 VAL 79 -9.350 8.744 -4.902 629 HG13 VAL 79 HG13 VAL 79 -10.639 9.466 -3.939 630 HG21 VAL 79 HG21 VAL 79 -10.349 9.014 -7.908 631 HG22 VAL 79 HG22 VAL 79 -11.154 7.504 -7.483 632 HG23 VAL 79 HG23 VAL 79 -9.576 7.886 -6.794 633 H ALA 80 H ALA 80 -14.191 9.607 -5.676 634 HA ALA 80 HA ALA 80 -14.212 10.940 -3.160 635 HB1 ALA 80 HB1 ALA 80 -16.655 11.495 -4.143 636 HB2 ALA 80 HB2 ALA 80 -15.842 10.992 -5.625 637 HB3 ALA 80 HB3 ALA 80 -15.188 12.321 -4.668 638 H ALA 81 H ALA 81 -15.916 8.222 -4.567 639 HA ALA 81 HA ALA 81 -17.946 7.884 -2.678 640 HB1 ALA 81 HB1 ALA 81 -16.584 6.147 -4.646 641 HB2 ALA 81 HB2 ALA 81 -18.303 6.459 -4.405 642 HB3 ALA 81 HB3 ALA 81 -17.455 5.332 -3.346 643 H VAL 82 H VAL 82 -15.000 5.877 -2.836 644 HA VAL 82 HA VAL 82 -15.128 4.796 -0.311 645 HB VAL 82 HB VAL 82 -13.489 4.310 -2.256 646 HG11 VAL 82 HG11 VAL 82 -12.575 6.751 -1.954 647 HG12 VAL 82 HG12 VAL 82 -11.501 5.432 -2.419 648 HG13 VAL 82 HG13 VAL 82 -11.548 5.982 -0.744 649 HG21 VAL 82 HG21 VAL 82 -13.585 3.148 -0.042 650 HG22 VAL 82 HG22 VAL 82 -12.343 4.265 0.525 651 HG23 VAL 82 HG23 VAL 82 -11.994 3.160 -0.804 652 H PHE 83 H PHE 83 -14.139 7.980 -1.290 653 HA PHE 83 HA PHE 83 -12.707 8.741 1.006 654 HB2 PHE 83 HB3 PHE 83 -13.738 10.001 -1.381 655 HB3 PHE 83 HB2 PHE 83 -14.032 11.030 0.015 656 HD1 PHE 83 HD2 PHE 83 -11.131 8.797 -0.058 657 HD2 PHE 83 HD1 PHE 83 -12.551 12.733 -0.832 658 HE1 PHE 83 HE2 PHE 83 -8.812 9.610 -0.157 659 HE2 PHE 83 HE1 PHE 83 -10.234 13.553 -0.933 660 HZ PHE 83 HZ PHE 83 -8.361 11.991 -0.594 661 H ALA 84 H ALA 84 -16.152 9.016 0.185 662 HA ALA 84 HA ALA 84 -16.937 10.395 2.505 663 HB1 ALA 84 HB1 ALA 84 -18.277 9.854 0.344 664 HB2 ALA 84 HB2 ALA 84 -19.131 9.956 1.883 665 HB3 ALA 84 HB3 ALA 84 -18.729 8.380 1.201 666 H TYR 85 H TYR 85 -16.483 6.994 1.818 667 HA TYR 85 HA TYR 85 -17.532 6.006 4.254 668 HB2 TYR 85 HB3 TYR 85 -17.146 4.051 3.226 669 HB3 TYR 85 HB2 TYR 85 -16.307 4.903 1.939 670 HD1 TYR 85 HD1 TYR 85 -15.656 3.605 5.391 671 HD2 TYR 85 HD2 TYR 85 -14.148 4.291 1.477 672 HE1 TYR 85 HE1 TYR 85 -13.563 2.467 6.005 673 HE2 TYR 85 HE2 TYR 85 -12.050 3.154 2.077 674 HH TYR 85 HH TYR 85 -10.806 2.755 4.502 675 H ALA 86 H ALA 86 -14.125 6.424 3.247 676 HA ALA 86 HA ALA 86 -12.833 6.007 5.580 677 HB1 ALA 86 HB1 ALA 86 -11.020 7.083 4.685 678 HB2 ALA 86 HB2 ALA 86 -11.987 8.413 4.049 679 HB3 ALA 86 HB3 ALA 86 -11.993 6.851 3.232 680 H LYS 87 H LYS 87 -14.635 8.933 4.739 681 HA LYS 87 HA LYS 87 -13.830 10.388 7.062 682 HB2 LYS 87 HB3 LYS 87 -15.116 11.065 4.761 683 HB3 LYS 87 HB2 LYS 87 -16.472 10.994 5.877 684 HG2 LYS 87 HG3 LYS 87 -15.816 13.208 5.984 685 HG3 LYS 87 HG2 LYS 87 -15.025 12.493 7.390 686 HD2 LYS 87 HD3 LYS 87 -13.042 13.145 6.625 687 HD3 LYS 87 HD2 LYS 87 -13.292 12.214 5.147 688 HE2 LYS 87 HE3 LYS 87 -14.855 14.405 4.701 689 HE3 LYS 87 HE2 LYS 87 -13.524 15.096 5.628 690 HZ1 LYS 87 HZ1 LYS 87 -13.467 13.787 2.996 691 HZ2 LYS 87 HZ2 LYS 87 -12.083 13.751 3.967 692 HZ3 LYS 87 HZ3 LYS 87 -12.742 15.234 3.490 693 H GLN 88 H GLN 88 -16.605 8.429 6.177 694 HA GLN 88 HA GLN 88 -18.120 8.730 8.509 695 HB2 GLN 88 HB3 GLN 88 -18.661 7.572 6.215 696 HB3 GLN 88 HB2 GLN 88 -18.093 6.125 7.035 697 HG2 GLN 88 HG3 GLN 88 -20.529 6.384 7.142 698 HG3 GLN 88 HG2 GLN 88 -19.777 6.370 8.736 699 HE21 GLN 88 HE21 GLN 88 -20.311 8.864 6.267 700 HE22 GLN 88 HE22 GLN 88 -21.087 9.988 7.325 701 H HIS 89 H HIS 89 -15.205 6.990 7.966 702 HA HIS 89 HA HIS 89 -15.558 5.529 10.497 703 HB2 HIS 89 HB3 HIS 89 -14.166 4.908 7.958 704 HB3 HIS 89 HB2 HIS 89 -13.346 4.404 9.432 705 HD1 HIS 89 HD1 HIS 89 -15.730 3.470 11.104 706 HD2 HIS 89 HD2 HIS 89 -15.240 2.577 7.076 707 HE1 HIS 89 HE1 HIS 89 -17.090 1.392 10.706 708 HE2 HIS 89 HE2 HIS 89 -16.848 0.920 8.243 709 HA PRO 90 HA PRO 90 -12.383 8.794 11.389 710 HB2 PRO 90 HB3 PRO 90 -13.491 9.787 13.618 711 HB3 PRO 90 HB2 PRO 90 -14.046 10.279 12.012 712 HG2 PRO 90 HG3 PRO 90 -15.247 8.290 13.902 713 HG3 PRO 90 HG2 PRO 90 -16.052 9.539 12.935 714 HD2 PRO 90 HD3 PRO 90 -15.923 6.905 12.203 715 HD3 PRO 90 HD2 PRO 90 -16.060 8.243 11.046 716 H ASP 91 H ASP 91 -13.473 5.946 12.796 717 HA ASP 91 HA ASP 91 -11.709 6.107 15.113 718 HB2 ASP 91 HB3 ASP 91 -14.057 4.552 14.386 719 HB3 ASP 91 HB2 ASP 91 -12.770 3.535 15.026 720 H GLN 92 H GLN 92 -11.174 5.548 11.981 721 HA GLN 92 HA GLN 92 -8.898 3.823 12.553 722 HB2 GLN 92 HB3 GLN 92 -10.961 3.195 10.435 723 HB3 GLN 92 HB2 GLN 92 -9.389 2.417 10.548 724 HG2 GLN 92 HG3 GLN 92 -10.496 0.877 11.727 725 HG3 GLN 92 HG2 GLN 92 -10.320 2.026 13.053 726 HE21 GLN 92 HE21 GLN 92 -12.453 1.736 10.227 727 HE22 GLN 92 HE22 GLN 92 -13.928 1.918 11.109 728 H GLU 93 H GLU 93 -7.515 3.606 10.489 729 HA GLU 93 HA GLU 93 -7.499 6.210 9.108 730 HB2 GLU 93 HB3 GLU 93 -5.463 4.888 10.639 731 HB3 GLU 93 HB2 GLU 93 -4.920 5.049 8.975 732 HG2 GLU 93 HG3 GLU 93 -4.161 6.982 10.014 733 HG3 GLU 93 HG2 GLU 93 -5.622 7.495 9.170 734 H LEU 94 H LEU 94 -6.499 6.191 6.947 735 HA LEU 94 HA LEU 94 -7.250 3.744 5.515 736 HB2 LEU 94 HB3 LEU 94 -7.569 6.545 4.995 737 HB3 LEU 94 HB2 LEU 94 -6.633 5.826 3.699 738 HG LEU 94 HG LEU 94 -8.444 4.119 3.426 739 HD11 LEU 94 HD11 LEU 94 -9.677 5.796 5.572 740 HD12 LEU 94 HD12 LEU 94 -9.598 4.040 5.429 741 HD13 LEU 94 HD13 LEU 94 -10.691 4.961 4.395 742 HD21 LEU 94 HD21 LEU 94 -10.149 6.032 2.663 743 HD22 LEU 94 HD22 LEU 94 -8.671 5.656 1.779 744 HD23 LEU 94 HD23 LEU 94 -8.705 7.017 2.900 745 H VAL 95 H VAL 95 -5.707 2.426 4.837 746 HA VAL 95 HA VAL 95 -3.033 3.544 4.303 747 HB VAL 95 HB VAL 95 -3.602 0.767 5.342 748 HG11 VAL 95 HG11 VAL 95 -1.115 0.875 5.828 749 HG12 VAL 95 HG12 VAL 95 -1.074 2.296 4.785 750 HG13 VAL 95 HG13 VAL 95 -1.579 0.738 4.132 751 HG21 VAL 95 HG21 VAL 95 -3.400 1.467 7.469 752 HG22 VAL 95 HG22 VAL 95 -3.870 3.035 6.813 753 HG23 VAL 95 HG23 VAL 95 -2.166 2.661 7.065 754 H ILE 96 H ILE 96 -2.598 3.476 2.203 755 HA ILE 96 HA ILE 96 -3.961 1.616 0.453 756 HB ILE 96 HB ILE 96 -1.757 3.468 -0.411 757 HG12 ILE 96 HG13 ILE 96 -3.253 4.853 0.908 758 HG13 ILE 96 HG12 ILE 96 -3.499 5.199 -0.801 759 HG21 ILE 96 HG21 ILE 96 -3.093 3.521 -2.492 760 HG22 ILE 96 HG22 ILE 96 -4.214 2.369 -1.766 761 HG23 ILE 96 HG23 ILE 96 -2.540 1.901 -2.064 762 HD11 ILE 96 HD11 ILE 96 -5.500 3.811 -0.796 763 HD12 ILE 96 HD12 ILE 96 -5.606 5.101 0.401 764 HD13 ILE 96 HD13 ILE 96 -5.249 3.451 0.912 765 H ALA 97 H ALA 97 -3.233 -0.392 0.232 766 HA ALA 97 HA ALA 97 -0.368 -0.920 0.566 767 HB1 ALA 97 HB1 ALA 97 -1.966 -2.194 1.958 768 HB2 ALA 97 HB2 ALA 97 -0.968 -3.224 0.932 769 HB3 ALA 97 HB3 ALA 97 -2.643 -2.896 0.489 770 H GLY 98 H GLY 98 -2.916 -0.971 -1.799 771 HA2 GLY 98 HA3 GLY 98 -1.276 -1.016 -4.015 772 HA3 GLY 98 HA2 GLY 98 -1.610 -2.704 -3.659 773 H GLY 99 H GLY 99 -4.140 -1.747 -6.103 774 HA2 GLY 99 HA3 GLY 99 -1.353 -2.423 -5.735 775 HA3 GLY 99 HA2 GLY 99 -2.252 -2.451 -7.242 776 H ALA 100 H ALA 100 -0.518 -1.454 -8.324 777 HA ALA 100 HA ALA 100 0.623 1.007 -7.542 778 HB1 ALA 100 HB1 ALA 100 1.432 -0.769 -9.265 779 HB2 ALA 100 HB2 ALA 100 1.808 0.936 -9.520 780 HB3 ALA 100 HB3 ALA 100 0.484 0.181 -10.409 781 H GLN 101 H GLN 101 -2.113 0.193 -9.623 782 HA GLN 101 HA GLN 101 -2.548 2.796 -10.629 783 HB2 GLN 101 HB3 GLN 101 -3.717 0.254 -10.941 784 HB3 GLN 101 HB2 GLN 101 -5.009 1.314 -10.398 785 HG2 GLN 101 HG3 GLN 101 -3.201 1.890 -12.732 786 HG3 GLN 101 HG2 GLN 101 -4.798 1.155 -12.858 787 HE21 GLN 101 HE21 GLN 101 -6.603 2.425 -11.951 788 HE22 GLN 101 HE22 GLN 101 -6.556 4.144 -12.121 789 H ILE 102 H ILE 102 -3.415 1.222 -7.651 790 HA ILE 102 HA ILE 102 -5.430 3.086 -6.866 791 HB ILE 102 HB ILE 102 -3.780 1.327 -5.053 792 HG12 ILE 102 HG13 ILE 102 -4.795 0.012 -6.884 793 HG13 ILE 102 HG12 ILE 102 -5.511 -0.369 -5.321 794 HG21 ILE 102 HG21 ILE 102 -5.224 1.824 -3.399 795 HG22 ILE 102 HG22 ILE 102 -6.610 1.897 -4.486 796 HG23 ILE 102 HG23 ILE 102 -5.515 3.273 -4.362 797 HD11 ILE 102 HD11 ILE 102 -7.530 0.464 -5.893 798 HD12 ILE 102 HD12 ILE 102 -6.955 0.056 -7.510 799 HD13 ILE 102 HD13 ILE 102 -6.847 1.717 -6.927 800 H PHE 103 H PHE 103 -1.963 2.771 -6.313 801 HA PHE 103 HA PHE 103 -1.679 4.809 -4.400 802 HB2 PHE 103 HB3 PHE 103 0.289 3.830 -6.480 803 HB3 PHE 103 HB2 PHE 103 0.701 4.860 -5.114 804 HD1 PHE 103 HD1 PHE 103 -0.969 3.537 -3.008 805 HD2 PHE 103 HD2 PHE 103 1.548 1.921 -6.035 806 HE1 PHE 103 HE1 PHE 103 -0.586 1.542 -1.620 807 HE2 PHE 103 HE2 PHE 103 1.934 -0.077 -4.654 808 HZ PHE 103 HZ PHE 103 0.867 -0.268 -2.443 809 H THR 104 H THR 104 -1.597 4.848 -7.927 810 HA THR 104 HA THR 104 -0.789 7.484 -8.318 811 HB THR 104 HB THR 104 -2.667 5.840 -10.023 812 HG1 THR 104 HG1 THR 104 0.134 6.154 -10.280 813 HG21 THR 104 HG21 THR 104 -2.575 7.367 -11.631 814 HG22 THR 104 HG22 THR 104 -0.854 7.657 -11.378 815 HG23 THR 104 HG23 THR 104 -2.045 8.485 -10.375 816 H ALA 105 H ALA 105 -4.101 6.173 -8.082 817 HA ALA 105 HA ALA 105 -5.473 8.561 -8.489 818 HB1 ALA 105 HB1 ALA 105 -7.215 7.376 -6.914 819 HB2 ALA 105 HB2 ALA 105 -6.128 6.002 -7.117 820 HB3 ALA 105 HB3 ALA 105 -6.876 6.749 -8.528 821 H PHE 106 H PHE 106 -4.746 7.070 -5.296 822 HA PHE 106 HA PHE 106 -5.504 9.422 -3.913 823 HB2 PHE 106 HB3 PHE 106 -4.017 6.937 -3.067 824 HB3 PHE 106 HB2 PHE 106 -4.427 8.238 -1.953 825 HD1 PHE 106 HD2 PHE 106 -5.909 5.787 -4.310 826 HD2 PHE 106 HD1 PHE 106 -6.530 8.322 -0.948 827 HE1 PHE 106 HE2 PHE 106 -8.130 4.782 -3.967 828 HE2 PHE 106 HE1 PHE 106 -8.751 7.322 -0.599 829 HZ PHE 106 HZ PHE 106 -9.554 5.550 -2.111 830 H LYS 107 H LYS 107 -2.679 8.601 -5.621 831 HA LYS 107 HA LYS 107 -0.574 9.607 -4.214 832 HB2 LYS 107 HB3 LYS 107 0.556 9.727 -6.198 833 HB3 LYS 107 HB2 LYS 107 -0.827 8.786 -6.733 834 HG2 LYS 107 HG3 LYS 107 -1.884 10.954 -7.457 835 HG3 LYS 107 HG2 LYS 107 -0.327 11.721 -7.140 836 HD2 LYS 107 HD3 LYS 107 0.753 10.407 -8.801 837 HD3 LYS 107 HD2 LYS 107 -0.652 9.353 -8.972 838 HE2 LYS 107 HE3 LYS 107 -1.674 10.757 -10.388 839 HE3 LYS 107 HE2 LYS 107 -1.245 12.175 -9.433 840 HZ1 LYS 107 HZ1 LYS 107 0.594 10.758 -11.285 841 HZ2 LYS 107 HZ2 LYS 107 0.935 12.174 -10.425 842 HZ3 LYS 107 HZ3 LYS 107 -0.234 12.188 -11.648 843 H ASP 108 H ASP 108 -3.119 11.423 -5.802 844 HA ASP 108 HA ASP 108 -1.919 13.976 -5.100 845 HB2 ASP 108 HB3 ASP 108 -4.194 13.080 -6.790 846 HB3 ASP 108 HB2 ASP 108 -4.325 14.678 -6.062 847 H ASP 109 H ASP 109 -4.671 11.960 -4.203 848 HA ASP 109 HA ASP 109 -5.588 13.880 -2.227 849 HB2 ASP 109 HB3 ASP 109 -6.693 11.594 -3.597 850 HB3 ASP 109 HB2 ASP 109 -6.954 11.451 -1.861 851 H VAL 110 H VAL 110 -3.008 11.998 -2.149 852 HA VAL 110 HA VAL 110 -3.424 10.668 0.388 853 HB VAL 110 HB VAL 110 -2.054 9.592 -1.339 854 HG11 VAL 110 HG11 VAL 110 -0.310 10.546 -2.385 855 HG12 VAL 110 HG12 VAL 110 0.277 11.326 -0.916 856 HG13 VAL 110 HG13 VAL 110 -1.037 12.057 -1.837 857 HG21 VAL 110 HG21 VAL 110 -0.251 8.876 0.074 858 HG22 VAL 110 HG22 VAL 110 -1.674 9.148 1.079 859 HG23 VAL 110 HG23 VAL 110 -0.374 10.339 1.050 860 H ASP 111 H ASP 111 -2.003 11.000 2.223 861 HA ASP 111 HA ASP 111 -1.025 13.769 2.442 862 HB2 ASP 111 HB3 ASP 111 -3.181 12.653 3.830 863 HB3 ASP 111 HB2 ASP 111 -1.856 12.658 4.990 864 H THR 112 H THR 112 -0.706 10.428 3.567 865 HA THR 112 HA THR 112 2.015 11.080 4.489 866 HB THR 112 HB THR 112 0.303 8.768 5.409 867 HG1 THR 112 HG1 THR 112 0.031 10.021 7.299 868 HG21 THR 112 HG21 THR 112 3.030 9.683 6.068 869 HG22 THR 112 HG22 THR 112 2.335 8.062 6.082 870 HG23 THR 112 HG23 THR 112 2.009 9.173 7.412 871 H LEU 113 H LEU 113 3.649 9.428 4.188 872 HA LEU 113 HA LEU 113 3.084 7.442 2.117 873 HB2 LEU 113 HB3 LEU 113 4.295 9.868 1.562 874 HB3 LEU 113 HB2 LEU 113 5.649 8.772 1.743 875 HG LEU 113 HG LEU 113 4.816 7.359 -0.027 876 HD11 LEU 113 HD11 LEU 113 2.692 7.301 -0.684 877 HD12 LEU 113 HD12 LEU 113 2.684 9.034 -1.011 878 HD13 LEU 113 HD13 LEU 113 2.325 8.441 0.610 879 HD21 LEU 113 HD21 LEU 113 6.097 8.857 -1.110 880 HD22 LEU 113 HD22 LEU 113 5.258 10.239 -0.404 881 HD23 LEU 113 HD23 LEU 113 4.555 9.389 -1.782 882 H LEU 114 H LEU 114 4.039 5.544 2.521 883 HA LEU 114 HA LEU 114 6.421 5.457 4.229 884 HB2 LEU 114 HB3 LEU 114 4.091 3.571 4.578 885 HB3 LEU 114 HB2 LEU 114 5.546 3.650 5.553 886 HG LEU 114 HG LEU 114 3.822 6.075 5.428 887 HD11 LEU 114 HD11 LEU 114 2.176 5.301 6.815 888 HD12 LEU 114 HD12 LEU 114 3.168 3.985 7.442 889 HD13 LEU 114 HD13 LEU 114 2.462 3.866 5.831 890 HD21 LEU 114 HD21 LEU 114 6.101 5.627 6.685 891 HD22 LEU 114 HD22 LEU 114 5.023 4.928 7.893 892 HD23 LEU 114 HD23 LEU 114 4.828 6.612 7.405 893 H VAL 115 H VAL 115 7.951 4.535 3.025 894 HA VAL 115 HA VAL 115 7.184 2.222 1.365 895 HB VAL 115 HB VAL 115 8.806 2.928 -0.332 896 HG11 VAL 115 HG11 VAL 115 6.877 5.167 0.237 897 HG12 VAL 115 HG12 VAL 115 6.386 3.598 -0.401 898 HG13 VAL 115 HG13 VAL 115 7.476 4.626 -1.331 899 HG21 VAL 115 HG21 VAL 115 10.215 4.253 1.285 900 HG22 VAL 115 HG22 VAL 115 9.016 5.539 1.149 901 HG23 VAL 115 HG23 VAL 115 9.918 5.021 -0.275 902 H THR 116 H THR 116 8.574 0.537 1.233 903 HA THR 116 HA THR 116 10.920 0.613 3.013 904 HB THR 116 HB THR 116 9.095 -1.665 2.222 905 HG1 THR 116 HG1 THR 116 8.510 -1.640 4.304 906 HG21 THR 116 HG21 THR 116 11.185 -2.718 2.251 907 HG22 THR 116 HG22 THR 116 10.492 -3.008 3.847 908 HG23 THR 116 HG23 THR 116 11.735 -1.775 3.637 909 H ARG 117 H ARG 117 12.547 1.171 1.628 910 HA ARG 117 HA ARG 117 12.713 0.013 -1.011 911 HB2 ARG 117 HB3 ARG 117 13.660 2.344 0.187 912 HB3 ARG 117 HB2 ARG 117 15.107 1.397 -0.128 913 HG2 ARG 117 HG3 ARG 117 15.050 2.162 -2.205 914 HG3 ARG 117 HG2 ARG 117 13.603 1.184 -2.459 915 HD2 ARG 117 HD3 ARG 117 12.310 3.158 -1.486 916 HD3 ARG 117 HD2 ARG 117 13.793 4.086 -1.702 917 HE ARG 117 HE ARG 117 13.203 2.817 -4.119 918 HH11 ARG 117 HH11 ARG 117 11.885 5.305 -2.058 919 HH12 ARG 117 HH12 ARG 117 11.141 6.167 -3.363 920 HH21 ARG 117 HH21 ARG 117 12.225 3.949 -5.837 921 HH22 ARG 117 HH22 ARG 117 11.333 5.397 -5.508 922 H LEU 118 H LEU 118 13.274 -2.063 -1.124 923 HA LEU 118 HA LEU 118 15.000 -3.361 0.725 924 HB2 LEU 118 HB3 LEU 118 13.476 -4.070 -1.676 925 HB3 LEU 118 HB2 LEU 118 14.971 -4.969 -1.508 926 HG LEU 118 HG LEU 118 14.259 -5.698 0.744 927 HD11 LEU 118 HD11 LEU 118 12.386 -4.998 1.777 928 HD12 LEU 118 HD12 LEU 118 11.467 -4.896 0.275 929 HD13 LEU 118 HD13 LEU 118 12.572 -3.597 0.723 930 HD21 LEU 118 HD21 LEU 118 13.159 -7.471 -0.100 931 HD22 LEU 118 HD22 LEU 118 13.547 -6.718 -1.647 932 HD23 LEU 118 HD23 LEU 118 11.959 -6.473 -0.920 933 H ALA 119 H ALA 119 16.981 -4.568 -0.023 934 HA ALA 119 HA ALA 119 18.764 -2.683 -1.335 935 HB1 ALA 119 HB1 ALA 119 19.068 -4.461 0.771 936 HB2 ALA 119 HB2 ALA 119 20.348 -3.550 -0.029 937 HB3 ALA 119 HB3 ALA 119 19.978 -5.194 -0.550 938 H GLY 120 H GLY 120 17.668 -6.032 -1.727 939 HA2 GLY 120 HA3 GLY 120 19.196 -6.647 -4.001 940 HA3 GLY 120 HA2 GLY 120 17.701 -7.441 -3.534 941 H SER 121 H SER 121 18.675 -6.751 -6.185 942 HA SER 121 HA SER 121 16.683 -4.763 -7.032 943 HB2 SER 121 HB3 SER 121 19.251 -5.744 -8.242 944 HB3 SER 121 HB2 SER 121 18.019 -5.001 -9.263 945 HG SER 121 HG SER 121 19.332 -3.850 -7.028 946 H PHE 122 H PHE 122 14.807 -5.612 -7.639 947 HA PHE 122 HA PHE 122 14.817 -8.220 -9.007 948 HB2 PHE 122 HB3 PHE 122 12.628 -6.902 -7.388 949 HB3 PHE 122 HB2 PHE 122 12.458 -8.427 -8.250 950 HD1 PHE 122 HD2 PHE 122 14.657 -6.809 -5.709 951 HD2 PHE 122 HD1 PHE 122 12.802 -10.381 -7.093 952 HE1 PHE 122 HE2 PHE 122 15.509 -8.011 -3.738 953 HE2 PHE 122 HE1 PHE 122 13.650 -11.589 -5.124 954 HZ PHE 122 HZ PHE 122 15.006 -10.404 -3.444 955 H GLU 123 H GLU 123 13.046 -8.529 -10.601 956 HA GLU 123 HA GLU 123 12.347 -6.026 -11.982 957 HB2 GLU 123 HB3 GLU 123 12.803 -7.068 -14.133 958 HB3 GLU 123 HB2 GLU 123 14.246 -7.101 -13.128 959 HG2 GLU 123 HG3 GLU 123 12.966 -9.498 -12.574 960 HG3 GLU 123 HG2 GLU 123 12.765 -9.278 -14.312 961 H GLY 124 H GLY 124 10.292 -5.881 -12.703 962 HA2 GLY 124 HA3 GLY 124 8.675 -8.276 -13.038 963 HA3 GLY 124 HA2 GLY 124 8.189 -7.210 -11.729 964 H ASP 125 H ASP 125 6.356 -6.288 -12.415 965 HA ASP 125 HA ASP 125 6.497 -4.641 -14.822 966 HB2 ASP 125 HB3 ASP 125 4.836 -7.040 -14.510 967 HB3 ASP 125 HB2 ASP 125 3.932 -5.614 -15.009 968 H THR 126 H THR 126 6.436 -4.180 -11.895 969 HA THR 126 HA THR 126 4.299 -2.208 -11.916 970 HB THR 126 HB THR 126 4.508 -3.794 -9.409 971 HG1 THR 126 HG1 THR 126 2.966 -4.671 -11.617 972 HG21 THR 126 HG21 THR 126 3.011 -1.945 -9.375 973 HG22 THR 126 HG22 THR 126 2.053 -3.425 -9.406 974 HG23 THR 126 HG23 THR 126 2.245 -2.468 -10.874 975 H LYS 127 H LYS 127 5.517 -0.449 -11.697 976 HA LYS 127 HA LYS 127 7.412 -0.341 -9.443 977 HB2 LYS 127 HB3 LYS 127 8.481 -0.366 -11.722 978 HB3 LYS 127 HB2 LYS 127 7.676 1.161 -12.052 979 HG2 LYS 127 HG3 LYS 127 9.178 1.199 -9.562 980 HG3 LYS 127 HG2 LYS 127 10.180 0.842 -10.968 981 HD2 LYS 127 HD3 LYS 127 9.348 2.843 -12.086 982 HD3 LYS 127 HD2 LYS 127 8.305 3.192 -10.707 983 HE2 LYS 127 HE3 LYS 127 10.142 3.654 -9.305 984 HE3 LYS 127 HE2 LYS 127 11.285 2.929 -10.435 985 HZ1 LYS 127 HZ1 LYS 127 10.984 4.728 -11.938 986 HZ2 LYS 127 HZ2 LYS 127 11.282 5.398 -10.414 987 HZ3 LYS 127 HZ3 LYS 127 9.708 5.370 -11.032 988 H MET 128 H MET 128 7.718 1.794 -8.503 989 HA MET 128 HA MET 128 5.422 3.053 -7.705 990 HB2 MET 128 HB3 MET 128 7.369 3.460 -6.448 991 HB3 MET 128 HB2 MET 128 8.273 3.997 -7.853 992 HG2 MET 128 HG3 MET 128 7.907 6.036 -7.021 993 HG3 MET 128 HG2 MET 128 6.320 5.876 -7.761 994 HE1 MET 128 HE1 MET 128 4.049 4.889 -4.773 995 HE2 MET 128 HE2 MET 128 4.714 3.944 -6.105 996 HE3 MET 128 HE3 MET 128 4.064 5.555 -6.406 997 H ILE 129 H ILE 129 4.299 4.893 -8.262 998 HA ILE 129 HA ILE 129 4.575 5.724 -11.058 999 HB ILE 129 HB ILE 129 2.319 6.672 -10.818 1000 HG12 ILE 129 HG13 ILE 129 1.162 5.699 -8.598 1001 HG13 ILE 129 HG12 ILE 129 2.786 5.957 -7.971 1002 HG21 ILE 129 HG21 ILE 129 2.015 4.599 -11.654 1003 HG22 ILE 129 HG22 ILE 129 1.262 4.315 -10.084 1004 HG23 ILE 129 HG23 ILE 129 2.934 3.825 -10.362 1005 HD11 ILE 129 HD11 ILE 129 2.680 8.250 -8.310 1006 HD12 ILE 129 HD12 ILE 129 1.074 7.831 -7.713 1007 HD13 ILE 129 HD13 ILE 129 1.329 8.118 -9.435 1008 HA PRO 130 HA PRO 130 5.988 9.822 -10.276 1009 HB2 PRO 130 HB3 PRO 130 3.620 10.967 -11.640 1010 HB3 PRO 130 HB2 PRO 130 5.335 11.145 -12.022 1011 HG2 PRO 130 HG3 PRO 130 3.747 9.623 -13.531 1012 HG3 PRO 130 HG2 PRO 130 5.419 9.141 -13.185 1013 HD2 PRO 130 HD3 PRO 130 2.868 8.148 -11.973 1014 HD3 PRO 130 HD2 PRO 130 4.319 7.239 -12.445 1015 H LEU 131 H LEU 131 5.889 11.244 -8.633 1016 HA LEU 131 HA LEU 131 3.298 11.984 -7.500 1017 HB2 LEU 131 HB3 LEU 131 5.362 11.376 -5.480 1018 HB3 LEU 131 HB2 LEU 131 3.626 11.156 -5.413 1019 HG LEU 131 HG LEU 131 5.009 9.302 -7.231 1020 HD11 LEU 131 HD11 LEU 131 6.404 8.278 -5.823 1021 HD12 LEU 131 HD12 LEU 131 5.293 8.428 -4.463 1022 HD13 LEU 131 HD13 LEU 131 6.346 9.775 -4.894 1023 HD21 LEU 131 HD21 LEU 131 3.168 8.705 -4.935 1024 HD22 LEU 131 HD22 LEU 131 3.436 7.767 -6.405 1025 HD23 LEU 131 HD23 LEU 131 2.573 9.303 -6.484 1026 H ASN 132 H ASN 132 3.344 13.905 -6.230 1027 HA ASN 132 HA ASN 132 5.350 15.781 -7.085 1028 HB2 ASN 132 HB3 ASN 132 2.735 16.061 -6.455 1029 HB3 ASN 132 HB2 ASN 132 3.464 16.547 -4.928 1030 HD21 ASN 132 HD21 ASN 132 5.736 17.803 -5.761 1031 HD22 ASN 132 HD22 ASN 132 5.327 19.218 -6.663 1032 H TRP 133 H TRP 133 7.125 14.548 -6.096 1033 HA TRP 133 HA TRP 133 7.460 14.077 -3.397 1034 HB2 TRP 133 HB3 TRP 133 9.529 14.767 -5.486 1035 HB3 TRP 133 HB2 TRP 133 9.911 14.151 -3.880 1036 HD1 TRP 133 HD1 TRP 133 8.364 13.059 -7.211 1037 HE1 TRP 133 HE1 TRP 133 8.308 10.486 -7.288 1038 HE3 TRP 133 HE3 TRP 133 9.859 12.071 -2.423 1039 HZ2 TRP 133 HZ2 TRP 133 8.835 8.325 -5.550 1040 HZ3 TRP 133 HZ3 TRP 133 10.059 9.725 -1.710 1041 HH2 TRP 133 HH2 TRP 133 9.556 7.892 -3.242 1042 H ASP 134 H ASP 134 8.201 17.078 -5.192 1043 HA ASP 134 HA ASP 134 9.504 18.443 -3.158 1044 HB2 ASP 134 HB3 ASP 134 8.674 19.038 -5.715 1045 HB3 ASP 134 HB2 ASP 134 7.688 20.120 -4.735 1046 H ASP 135 H ASP 135 6.042 18.149 -3.815 1047 HA ASP 135 HA ASP 135 5.247 19.894 -1.707 1048 HB2 ASP 135 HB3 ASP 135 3.869 18.047 -3.592 1049 HB3 ASP 135 HB2 ASP 135 3.001 18.522 -2.135 1050 H PHE 136 H PHE 136 6.663 16.923 -1.516 1051 HA PHE 136 HA PHE 136 5.310 16.342 1.033 1052 HB2 PHE 136 HB3 PHE 136 6.330 14.436 -1.068 1053 HB3 PHE 136 HB2 PHE 136 6.024 13.927 0.590 1054 HD1 PHE 136 HD1 PHE 136 3.635 14.652 1.501 1055 HD2 PHE 136 HD2 PHE 136 4.653 14.148 -2.600 1056 HE1 PHE 136 HE1 PHE 136 1.261 14.306 0.959 1057 HE2 PHE 136 HE2 PHE 136 2.280 13.800 -3.150 1058 HZ PHE 136 HZ PHE 136 0.580 13.879 -1.370 1059 H THR 137 H THR 137 6.555 16.170 2.778 1060 HA THR 137 HA THR 137 9.477 16.253 2.395 1061 HB THR 137 HB THR 137 7.780 17.415 4.612 1062 HG1 THR 137 HG1 THR 137 7.765 18.726 2.828 1063 HG21 THR 137 HG21 THR 137 9.843 16.681 5.599 1064 HG22 THR 137 HG22 THR 137 9.858 18.437 5.438 1065 HG23 THR 137 HG23 THR 137 10.772 17.440 4.306 1066 H LYS 138 H LYS 138 10.797 14.984 3.673 1067 HA LYS 138 HA LYS 138 9.710 12.509 4.519 1068 HB2 LYS 138 HB3 LYS 138 12.042 12.931 3.612 1069 HB3 LYS 138 HB2 LYS 138 12.450 13.551 5.206 1070 HG2 LYS 138 HG3 LYS 138 12.728 11.508 6.012 1071 HG3 LYS 138 HG2 LYS 138 11.156 10.987 5.408 1072 HD2 LYS 138 HD3 LYS 138 12.540 9.589 4.230 1073 HD3 LYS 138 HD2 LYS 138 12.413 10.941 3.104 1074 HE2 LYS 138 HE3 LYS 138 14.511 11.838 4.329 1075 HE3 LYS 138 HE2 LYS 138 14.687 10.178 4.896 1076 HZ1 LYS 138 HZ1 LYS 138 14.235 10.516 2.044 1077 HZ2 LYS 138 HZ2 LYS 138 15.265 9.451 2.859 1078 HZ3 LYS 138 HZ3 LYS 138 15.729 11.060 2.624 1079 H VAL 139 H VAL 139 8.695 12.092 6.343 1080 HA VAL 139 HA VAL 139 8.917 13.897 8.603 1081 HB VAL 139 HB VAL 139 7.354 11.375 8.823 1082 HG11 VAL 139 HG11 VAL 139 6.167 12.517 10.365 1083 HG12 VAL 139 HG12 VAL 139 6.209 14.020 9.444 1084 HG13 VAL 139 HG13 VAL 139 7.608 13.533 10.401 1085 HG21 VAL 139 HG21 VAL 139 6.647 13.632 6.966 1086 HG22 VAL 139 HG22 VAL 139 5.438 12.541 7.643 1087 HG23 VAL 139 HG23 VAL 139 6.721 11.906 6.615 1088 H SER 140 H SER 140 9.947 10.694 7.656 1089 HA SER 140 HA SER 140 11.856 10.614 9.791 1090 HB2 SER 140 HB3 SER 140 9.300 9.512 10.332 1091 HB3 SER 140 HB2 SER 140 10.414 8.160 10.138 1092 HG SER 140 HG SER 140 10.166 9.831 12.205 1093 H SER 141 H SER 141 13.107 8.535 9.774 1094 HA SER 141 HA SER 141 12.915 6.867 7.446 1095 HB2 SER 141 HB3 SER 141 14.017 8.945 6.563 1096 HB3 SER 141 HB2 SER 141 15.350 8.647 7.677 1097 HG SER 141 HG SER 141 15.860 6.808 6.580 1098 H ARG 142 H ARG 142 13.543 4.907 8.052 1099 HA ARG 142 HA ARG 142 15.714 4.644 10.013 1100 HB2 ARG 142 HB3 ARG 142 13.379 4.401 11.034 1101 HB3 ARG 142 HB2 ARG 142 13.251 2.910 10.110 1102 HG2 ARG 142 HG3 ARG 142 14.471 1.787 11.586 1103 HG3 ARG 142 HG2 ARG 142 15.726 3.027 11.602 1104 HD2 ARG 142 HD3 ARG 142 13.151 3.067 13.174 1105 HD3 ARG 142 HD2 ARG 142 14.761 2.748 13.818 1106 HE ARG 142 HE ARG 142 14.528 5.282 12.480 1107 HH11 ARG 142 HH11 ARG 142 14.115 3.595 15.508 1108 HH12 ARG 142 HH12 ARG 142 14.274 5.026 16.470 1109 HH21 ARG 142 HH21 ARG 142 14.737 7.165 13.745 1110 HH22 ARG 142 HH22 ARG 142 14.627 7.053 15.469 1111 H THR 143 H THR 143 17.249 3.308 9.329 1112 HA THR 143 HA THR 143 16.704 1.609 7.019 1113 HB THR 143 HB THR 143 19.357 2.207 8.336 1114 HG1 THR 143 HG1 THR 143 18.791 4.131 7.576 1115 HG21 THR 143 HG21 THR 143 19.258 1.658 5.470 1116 HG22 THR 143 HG22 THR 143 18.835 0.284 6.491 1117 HG23 THR 143 HG23 THR 143 20.387 1.094 6.702 1118 H VAL 144 H VAL 144 15.877 -0.308 7.576 1119 HA VAL 144 HA VAL 144 17.012 -1.744 9.871 1120 HB VAL 144 HB VAL 144 14.552 -2.477 8.280 1121 HG11 VAL 144 HG11 VAL 144 15.980 -4.048 9.941 1122 HG12 VAL 144 HG12 VAL 144 14.237 -4.189 9.712 1123 HG13 VAL 144 HG13 VAL 144 14.876 -3.294 11.091 1124 HG21 VAL 144 HG21 VAL 144 14.535 -1.138 10.967 1125 HG22 VAL 144 HG22 VAL 144 13.203 -1.353 9.832 1126 HG23 VAL 144 HG23 VAL 144 14.497 -0.212 9.467 1127 H GLU 145 H GLU 145 18.292 -3.476 9.585 1128 HA GLU 145 HA GLU 145 18.377 -4.688 6.902 1129 HB2 GLU 145 HB3 GLU 145 20.817 -5.076 7.297 1130 HB3 GLU 145 HB2 GLU 145 20.368 -3.385 7.129 1131 HG2 GLU 145 HG3 GLU 145 21.343 -2.939 9.048 1132 HG3 GLU 145 HG2 GLU 145 20.215 -4.015 9.872 1133 H ASP 146 H ASP 146 18.668 -6.883 6.764 1134 HA ASP 146 HA ASP 146 18.263 -8.363 9.274 1135 HB2 ASP 146 HB3 ASP 146 17.300 -8.737 6.478 1136 HB3 ASP 146 HB2 ASP 146 17.600 -10.184 7.437 1137 H THR 147 H THR 147 19.002 -10.834 8.777 1138 HA THR 147 HA THR 147 21.801 -10.801 8.849 1139 HB THR 147 HB THR 147 21.349 -13.371 8.225 1140 HG1 THR 147 HG1 THR 147 18.888 -12.672 9.394 1141 HG21 THR 147 HG21 THR 147 22.202 -12.740 10.369 1142 HG22 THR 147 HG22 THR 147 20.826 -13.818 10.597 1143 HG23 THR 147 HG23 THR 147 20.637 -12.083 10.846 1144 H ASN 148 H ASN 148 19.556 -11.615 6.242 1145 HA ASN 148 HA ASN 148 21.631 -12.196 4.355 1146 HB2 ASN 148 HB3 ASN 148 18.652 -11.941 4.237 1147 HB3 ASN 148 HB2 ASN 148 19.570 -11.907 2.734 1148 HD21 ASN 148 HD21 ASN 148 17.690 -13.876 4.077 1149 HD22 ASN 148 HD22 ASN 148 18.529 -15.383 3.975 1150 HA PRO 149 HA PRO 149 22.710 -8.002 3.306 1151 HB2 PRO 149 HB3 PRO 149 23.338 -9.189 0.656 1152 HB3 PRO 149 HB2 PRO 149 24.359 -8.223 1.727 1153 HG2 PRO 149 HG3 PRO 149 24.739 -10.849 1.485 1154 HG3 PRO 149 HG2 PRO 149 24.914 -10.039 3.051 1155 HD2 PRO 149 HD3 PRO 149 22.670 -11.726 2.032 1156 HD3 PRO 149 HD2 PRO 149 23.365 -11.634 3.664 1157 H ALA 150 H ALA 150 20.851 -10.016 1.086 1158 HA ALA 150 HA ALA 150 19.794 -7.792 -0.389 1159 HB1 ALA 150 HB1 ALA 150 19.493 -10.733 -0.451 1160 HB2 ALA 150 HB2 ALA 150 19.792 -9.592 -1.762 1161 HB3 ALA 150 HB3 ALA 150 18.164 -9.778 -1.109 1162 H LEU 151 H LEU 151 19.004 -9.249 2.589 1163 HA LEU 151 HA LEU 151 16.195 -8.521 2.460 1164 HB2 LEU 151 HB3 LEU 151 17.894 -9.868 4.540 1165 HB3 LEU 151 HB2 LEU 151 16.260 -9.340 4.890 1166 HG LEU 151 HG LEU 151 17.139 -11.460 2.941 1167 HD11 LEU 151 HD11 LEU 151 16.829 -11.980 5.384 1168 HD12 LEU 151 HD12 LEU 151 15.842 -12.928 4.271 1169 HD13 LEU 151 HD13 LEU 151 15.123 -11.590 5.168 1170 HD21 LEU 151 HD21 LEU 151 15.480 -10.671 1.627 1171 HD22 LEU 151 HD22 LEU 151 14.698 -9.803 2.948 1172 HD23 LEU 151 HD23 LEU 151 14.458 -11.541 2.771 1173 H THR 152 H THR 152 18.624 -6.588 2.583 1174 HA THR 152 HA THR 152 18.001 -5.104 5.004 1175 HB THR 152 HB THR 152 19.896 -4.285 2.802 1176 HG1 THR 152 HG1 THR 152 21.196 -5.784 3.432 1177 HG21 THR 152 HG21 THR 152 20.187 -2.510 4.095 1178 HG22 THR 152 HG22 THR 152 20.964 -3.594 5.250 1179 HG23 THR 152 HG23 THR 152 19.248 -3.218 5.410 1180 H HIS 153 H HIS 153 16.453 -3.613 5.060 1181 HA HIS 153 HA HIS 153 15.789 -2.182 2.573 1182 HB2 HIS 153 HB3 HIS 153 13.525 -2.404 4.390 1183 HB3 HIS 153 HB2 HIS 153 13.620 -2.753 2.669 1184 HD1 HIS 153 HD1 HIS 153 12.743 -4.370 5.634 1185 HD2 HIS 153 HD2 HIS 153 15.141 -5.450 2.418 1186 HE1 HIS 153 HE1 HIS 153 12.862 -6.881 5.698 1187 HE2 HIS 153 HE2 HIS 153 14.240 -7.516 3.688 1188 H THR 154 H THR 154 14.546 -0.137 3.002 1189 HA THR 154 HA THR 154 15.350 1.108 5.540 1190 HB THR 154 HB THR 154 15.550 2.433 2.830 1191 HG1 THR 154 HG1 THR 154 17.501 1.233 4.482 1192 HG21 THR 154 HG21 THR 154 16.627 4.239 3.893 1193 HG22 THR 154 HG22 THR 154 16.708 3.380 5.431 1194 HG23 THR 154 HG23 THR 154 15.152 3.929 4.808 1195 H TYR 155 H TYR 155 13.682 1.978 6.565 1196 HA TYR 155 HA TYR 155 11.176 2.390 5.133 1197 HB2 TYR 155 HB3 TYR 155 11.964 2.000 7.971 1198 HB3 TYR 155 HB2 TYR 155 10.540 2.991 7.674 1199 HD1 TYR 155 HD2 TYR 155 11.968 -0.373 7.441 1200 HD2 TYR 155 HD1 TYR 155 8.519 2.018 6.742 1201 HE1 TYR 155 HE2 TYR 155 10.615 -2.410 7.188 1202 HE2 TYR 155 HE1 TYR 155 7.156 -0.013 6.488 1203 HH TYR 155 HH TYR 155 7.736 -2.762 7.543 1204 H GLU 156 H GLU 156 10.241 4.348 4.788 1205 HA GLU 156 HA GLU 156 11.463 6.711 6.016 1206 HB2 GLU 156 HB3 GLU 156 10.947 6.412 3.053 1207 HB3 GLU 156 HB2 GLU 156 11.493 7.880 3.853 1208 HG2 GLU 156 HG3 GLU 156 13.577 6.877 4.431 1209 HG3 GLU 156 HG2 GLU 156 13.025 5.294 3.887 1210 H VAL 157 H VAL 157 10.094 8.390 6.406 1211 HA VAL 157 HA VAL 157 7.255 7.933 5.766 1212 HB VAL 157 HB VAL 157 8.250 9.681 8.009 1213 HG11 VAL 157 HG11 VAL 157 5.634 8.726 7.026 1214 HG12 VAL 157 HG12 VAL 157 6.062 10.228 7.845 1215 HG13 VAL 157 HG13 VAL 157 5.849 8.747 8.777 1216 HG21 VAL 157 HG21 VAL 157 7.977 7.864 9.549 1217 HG22 VAL 157 HG22 VAL 157 9.085 7.345 8.279 1218 HG23 VAL 157 HG23 VAL 157 7.409 6.797 8.264 1219 H TRP 158 H TRP 158 6.003 9.652 5.092 1220 HA TRP 158 HA TRP 158 7.295 12.216 4.552 1221 HB2 TRP 158 HB3 TRP 158 5.978 10.612 2.356 1222 HB3 TRP 158 HB2 TRP 158 6.611 12.244 2.198 1223 HD1 TRP 158 HD1 TRP 158 7.974 8.714 3.086 1224 HE1 TRP 158 HE1 TRP 158 10.354 8.529 2.123 1225 HE3 TRP 158 HE3 TRP 158 8.458 13.442 1.202 1226 HZ2 TRP 158 HZ2 TRP 158 12.192 10.170 0.745 1227 HZ3 TRP 158 HZ3 TRP 158 10.558 14.054 0.075 1228 HH2 TRP 158 HH2 TRP 158 12.386 12.450 -0.147 1229 H GLN 159 H GLN 159 5.956 13.925 4.677 1230 HA GLN 159 HA GLN 159 3.062 13.487 4.572 1231 HB2 GLN 159 HB3 GLN 159 4.612 14.195 6.951 1232 HB3 GLN 159 HB2 GLN 159 3.315 15.331 6.615 1233 HG2 GLN 159 HG3 GLN 159 2.591 12.483 6.457 1234 HG3 GLN 159 HG2 GLN 159 3.016 13.086 8.059 1235 HE21 GLN 159 HE21 GLN 159 1.485 14.060 9.188 1236 HE22 GLN 159 HE22 GLN 159 -0.011 14.654 8.561 1237 H LYS 160 H LYS 160 2.011 15.063 3.491 1238 HA LYS 160 HA LYS 160 3.390 16.998 2.038 1239 HB2 LYS 160 HB3 LYS 160 0.894 15.994 1.929 1240 HB3 LYS 160 HB2 LYS 160 0.548 17.548 2.673 1241 HG2 LYS 160 HG3 LYS 160 1.795 18.628 0.791 1242 HG3 LYS 160 HG2 LYS 160 1.871 17.041 0.021 1243 HD2 LYS 160 HD3 LYS 160 -0.768 17.192 0.593 1244 HD3 LYS 160 HD2 LYS 160 -0.397 18.897 0.327 1245 HE2 LYS 160 HE3 LYS 160 0.048 18.598 -1.879 1246 HE3 LYS 160 HE2 LYS 160 0.685 16.971 -1.641 1247 HZ1 LYS 160 HZ1 LYS 160 -1.444 17.053 -2.873 1248 HZ2 LYS 160 HZ2 LYS 160 -2.197 17.662 -1.486 1249 HZ3 LYS 160 HZ3 LYS 160 -1.519 16.113 -1.468 1250 H LYS 161 H LYS 161 3.823 19.127 2.320 1251 HA LYS 161 HA LYS 161 4.180 20.142 4.893 1252 HB2 LYS 161 HB3 LYS 161 3.999 21.590 2.247 1253 HB3 LYS 161 HB2 LYS 161 4.531 22.340 3.745 1254 HG2 LYS 161 HG3 LYS 161 6.357 20.651 3.864 1255 HG3 LYS 161 HG2 LYS 161 5.868 20.089 2.264 1256 HD2 LYS 161 HD3 LYS 161 7.731 21.650 2.097 1257 HD3 LYS 161 HD2 LYS 161 6.280 22.330 1.358 1258 HE2 LYS 161 HE3 LYS 161 6.364 23.039 4.131 1259 HE3 LYS 161 HE2 LYS 161 7.899 23.457 3.371 1260 HZ1 LYS 161 HZ1 LYS 161 6.141 25.214 3.291 1261 HZ2 LYS 161 HZ2 LYS 161 5.272 24.223 2.231 1262 HZ3 LYS 161 HZ3 LYS 161 6.800 24.799 1.788 1263 H ALA 162 H ALA 162 2.972 21.350 6.248 1264 HA ALA 162 HA ALA 162 1.141 22.321 7.186 1265 HB1 ALA 162 HB1 ALA 162 0.097 23.177 4.536 1266 HB2 ALA 162 HB2 ALA 162 1.651 23.815 5.075 1267 HB3 ALA 162 HB3 ALA 162 0.205 24.072 6.052 1268 H51A NDP 170 H51A NDP 170 -5.092 -0.342 -9.639 1269 H52A NDP 170 H52A NDP 170 -5.532 -1.976 -9.130 1270 H4B NDP 170 H4B NDP 170 -6.880 -2.175 -11.288 1271 H3B NDP 170 H3B NDP 170 -6.117 0.734 -11.577 1272 HO3A NDP 170 HO3A NDP 170 -6.440 -1.529 -13.289 1273 H2B NDP 170 H2B NDP 170 -8.324 1.106 -12.460 1274 H1B NDP 170 H1B NDP 170 -9.639 -0.296 -10.498 1275 H8A NDP 170 H8A NDP 170 -6.443 1.411 -9.308 1276 H61A NDP 170 H61A NDP 170 -10.155 6.128 -7.730 1277 H62A NDP 170 H62A NDP 170 -8.525 5.496 -7.655 1278 H2A NDP 170 H2A NDP 170 -12.619 3.099 -9.943 1279 H51N NDP 170 H51N NDP 170 -1.305 -3.957 -7.599 1280 H52N NDP 170 H52N NDP 170 -0.472 -3.037 -8.864 1281 H4D NDP 170 H4D NDP 170 0.847 -5.098 -9.431 1282 H3D NDP 170 H3D NDP 170 -0.641 -6.303 -7.086 1283 HO3N NDP 170 HO3N NDP 170 -0.265 -6.796 -9.774 1284 H2D NDP 170 H2D NDP 170 1.379 -7.497 -6.571 1285 HO2N NDP 170 HO2N NDP 170 2.907 -7.919 -7.982 1286 H1D NDP 170 H1D NDP 170 3.066 -5.335 -6.909 1287 H2N NDP 170 H2N NDP 170 3.590 -5.095 -4.587 1288 H71N NDP 170 H71N NDP 170 5.400 -4.536 -1.978 1289 H72N NDP 170 H72N NDP 170 4.965 -5.169 -3.544 1290 H41N NDP 170 H41N NDP 170 0.546 -3.819 -2.352 1291 H42N NDP 170 H42N NDP 170 0.547 -5.593 -2.069 1292 H5N NDP 170 H5N NDP 170 -1.281 -4.919 -3.626 1293 H6N NDP 170 H6N NDP 170 -0.543 -5.311 -5.982 Start of MODEL 16 1 H1 THR 1 HT1 THR 1 -4.706 10.403 4.942 2 H2 THR 1 HT2 THR 1 -4.800 8.900 5.766 3 H3 THR 1 HT3 THR 1 -6.144 9.473 4.865 4 HA THR 1 HA THR 1 -5.110 7.805 3.624 5 HB THR 1 HB THR 1 -4.036 10.262 2.320 6 HG1 THR 1 HG1 THR 1 -5.751 11.261 3.115 7 HG21 THR 1 HG21 THR 1 -4.383 8.038 1.157 8 HG22 THR 1 HG22 THR 1 -5.072 9.464 0.382 9 HG23 THR 1 HG23 THR 1 -6.111 8.364 1.288 10 H ALA 2 H ALA 2 -3.420 6.512 3.936 11 HA ALA 2 HA ALA 2 -0.725 7.686 3.820 12 HB1 ALA 2 HB1 ALA 2 -1.076 7.253 6.134 13 HB2 ALA 2 HB2 ALA 2 -0.017 5.983 5.521 14 HB3 ALA 2 HB3 ALA 2 -1.726 5.649 5.798 15 H PHE 3 H PHE 3 0.804 6.517 2.729 16 HA PHE 3 HA PHE 3 -0.190 4.190 1.232 17 HB2 PHE 3 HB3 PHE 3 1.916 6.260 0.678 18 HB3 PHE 3 HB2 PHE 3 1.948 4.713 -0.155 19 HD1 PHE 3 HD1 PHE 3 -1.117 6.563 0.768 20 HD2 PHE 3 HD2 PHE 3 1.575 5.477 -2.344 21 HE1 PHE 3 HE1 PHE 3 -2.699 7.437 -0.900 22 HE2 PHE 3 HE2 PHE 3 -0.003 6.348 -4.017 23 HZ PHE 3 HZ PHE 3 -2.140 7.331 -3.297 24 H LEU 4 H LEU 4 0.602 2.217 1.698 25 HA LEU 4 HA LEU 4 3.258 2.044 2.937 26 HB2 LEU 4 HB3 LEU 4 1.689 1.869 4.751 27 HB3 LEU 4 HB2 LEU 4 0.746 0.675 3.880 28 HG LEU 4 HG LEU 4 2.649 -0.902 4.031 29 HD11 LEU 4 HD11 LEU 4 3.907 1.456 5.324 30 HD12 LEU 4 HD12 LEU 4 4.610 0.238 4.260 31 HD13 LEU 4 HD13 LEU 4 4.297 -0.144 5.954 32 HD21 LEU 4 HD21 LEU 4 2.204 -0.107 6.837 33 HD22 LEU 4 HD22 LEU 4 1.952 -1.661 6.040 34 HD23 LEU 4 HD23 LEU 4 0.759 -0.374 5.861 35 H TRP 5 H TRP 5 4.491 0.907 1.595 36 HA TRP 5 HA TRP 5 3.686 -1.723 0.785 37 HB2 TRP 5 HB3 TRP 5 3.502 -1.483 -1.513 38 HB3 TRP 5 HB2 TRP 5 2.700 -0.031 -0.929 39 HD1 TRP 5 HD1 TRP 5 5.820 -1.187 -2.795 40 HE1 TRP 5 HE1 TRP 5 6.938 0.859 -3.885 41 HE3 TRP 5 HE3 TRP 5 3.006 2.499 -0.660 42 HZ2 TRP 5 HZ2 TRP 5 6.662 3.669 -3.844 43 HZ3 TRP 5 HZ3 TRP 5 3.495 4.844 -1.241 44 HH2 TRP 5 HH2 TRP 5 5.284 5.413 -2.800 45 H ALA 6 H ALA 6 5.411 -2.939 -0.233 46 HA ALA 6 HA ALA 6 8.042 -1.910 0.567 47 HB1 ALA 6 HB1 ALA 6 8.540 -4.483 -0.001 48 HB2 ALA 6 HB2 ALA 6 6.827 -4.599 0.403 49 HB3 ALA 6 HB3 ALA 6 7.966 -3.936 1.575 50 H GLN 7 H GLN 7 9.805 -1.903 -0.855 51 HA GLN 7 HA GLN 7 9.375 -2.741 -3.606 52 HB2 GLN 7 HB3 GLN 7 10.094 -0.492 -4.464 53 HB3 GLN 7 HB2 GLN 7 8.493 -0.531 -3.736 54 HG2 GLN 7 HG3 GLN 7 10.360 0.089 -1.697 55 HG3 GLN 7 HG2 GLN 7 10.706 1.119 -3.085 56 HE21 GLN 7 HE21 GLN 7 8.196 0.109 -0.840 57 HE22 GLN 7 HE22 GLN 7 7.227 1.530 -0.995 58 H ASP 8 H ASP 8 11.331 -2.495 -4.948 59 HA ASP 8 HA ASP 8 13.729 -3.006 -3.339 60 HB2 ASP 8 HB3 ASP 8 14.626 -4.108 -5.325 61 HB3 ASP 8 HB2 ASP 8 13.037 -4.757 -4.944 62 H ARG 9 H ARG 9 15.695 -2.488 -5.268 63 HA ARG 9 HA ARG 9 15.957 0.337 -5.002 64 HB2 ARG 9 HB3 ARG 9 17.567 -1.792 -6.387 65 HB3 ARG 9 HB2 ARG 9 17.971 -0.091 -6.570 66 HG2 ARG 9 HG3 ARG 9 17.754 -1.478 -3.910 67 HG3 ARG 9 HG2 ARG 9 19.261 -1.298 -4.809 68 HD2 ARG 9 HD3 ARG 9 19.512 0.808 -4.129 69 HD3 ARG 9 HD2 ARG 9 17.857 1.221 -4.575 70 HE ARG 9 HE ARG 9 17.541 -0.152 -2.271 71 HH11 ARG 9 HH11 ARG 9 19.550 2.559 -3.165 72 HH12 ARG 9 HH12 ARG 9 19.545 3.246 -1.576 73 HH21 ARG 9 HH21 ARG 9 17.534 0.752 -0.181 74 HH22 ARG 9 HH22 ARG 9 18.402 2.221 0.118 75 H ASP 10 H ASP 10 14.817 -1.793 -7.495 76 HA ASP 10 HA ASP 10 14.841 0.226 -9.566 77 HB2 ASP 10 HB3 ASP 10 15.152 -2.308 -9.894 78 HB3 ASP 10 HB2 ASP 10 13.405 -2.416 -9.707 79 H GLY 11 H GLY 11 13.013 -0.077 -6.931 80 HA2 GLY 11 HA3 GLY 11 11.063 1.079 -6.390 81 HA3 GLY 11 HA2 GLY 11 10.817 1.402 -8.099 82 H LEU 12 H LEU 12 11.381 -1.806 -7.969 83 HA LEU 12 HA LEU 12 8.917 -2.690 -8.742 84 HB2 LEU 12 HB3 LEU 12 11.201 -3.909 -8.565 85 HB3 LEU 12 HB2 LEU 12 10.654 -4.381 -6.970 86 HG LEU 12 HG LEU 12 8.687 -5.504 -8.008 87 HD11 LEU 12 HD11 LEU 12 8.612 -4.120 -10.055 88 HD12 LEU 12 HD12 LEU 12 8.619 -5.850 -10.396 89 HD13 LEU 12 HD13 LEU 12 10.091 -4.903 -10.610 90 HD21 LEU 12 HD21 LEU 12 10.953 -6.710 -9.442 91 HD22 LEU 12 HD22 LEU 12 9.861 -7.405 -8.243 92 HD23 LEU 12 HD23 LEU 12 11.221 -6.407 -7.724 93 H ILE 13 H ILE 13 7.495 -4.272 -7.495 94 HA ILE 13 HA ILE 13 7.242 -3.810 -4.673 95 HB ILE 13 HB ILE 13 4.966 -2.998 -4.679 96 HG12 ILE 13 HG13 ILE 13 4.938 -2.276 -7.550 97 HG13 ILE 13 HG12 ILE 13 4.703 -3.980 -7.190 98 HG21 ILE 13 HG21 ILE 13 6.802 -1.374 -4.663 99 HG22 ILE 13 HG22 ILE 13 5.348 -0.724 -5.420 100 HG23 ILE 13 HG23 ILE 13 6.700 -1.254 -6.420 101 HD11 ILE 13 HD11 ILE 13 3.081 -1.745 -6.007 102 HD12 ILE 13 HD12 ILE 13 2.808 -3.474 -5.800 103 HD13 ILE 13 HD13 ILE 13 2.596 -2.731 -7.386 104 H GLY 14 H GLY 14 6.081 -5.245 -7.650 105 HA2 GLY 14 HA3 GLY 14 5.592 -7.728 -6.206 106 HA3 GLY 14 HA2 GLY 14 4.242 -7.047 -7.101 107 H LYS 15 H LYS 15 4.789 -9.420 -7.897 108 HA LYS 15 HA LYS 15 6.328 -9.102 -10.382 109 HB2 LYS 15 HB3 LYS 15 7.050 -11.425 -10.222 110 HB3 LYS 15 HB2 LYS 15 7.567 -10.530 -8.800 111 HG2 LYS 15 HG3 LYS 15 6.323 -11.769 -7.407 112 HG3 LYS 15 HG2 LYS 15 4.966 -11.855 -8.529 113 HD2 LYS 15 HD3 LYS 15 6.860 -13.366 -9.801 114 HD3 LYS 15 HD2 LYS 15 7.178 -13.726 -8.103 115 HE2 LYS 15 HE3 LYS 15 4.789 -14.275 -7.807 116 HE3 LYS 15 HE2 LYS 15 4.532 -13.989 -9.527 117 HZ1 LYS 15 HZ1 LYS 15 5.047 -16.379 -8.533 118 HZ2 LYS 15 HZ2 LYS 15 6.636 -15.873 -8.816 119 HZ3 LYS 15 HZ3 LYS 15 5.525 -15.921 -10.090 120 H ASP 16 H ASP 16 3.846 -8.447 -10.647 121 HA ASP 16 HA ASP 16 2.014 -8.865 -11.947 122 HB2 ASP 16 HB3 ASP 16 3.745 -10.635 -12.985 123 HB3 ASP 16 HB2 ASP 16 2.591 -11.764 -12.282 124 H GLY 17 H GLY 17 2.201 -9.249 -9.064 125 HA2 GLY 17 HA3 GLY 17 -0.388 -10.188 -8.539 126 HA3 GLY 17 HA2 GLY 17 0.747 -11.479 -8.170 127 H HIS 18 H HIS 18 2.845 -10.268 -7.047 128 HA HIS 18 HA HIS 18 2.295 -8.216 -5.197 129 HB2 HIS 18 HB3 HIS 18 2.143 -9.494 -3.124 130 HB3 HIS 18 HB2 HIS 18 0.822 -9.931 -4.203 131 HD1 HIS 18 HD1 HIS 18 1.438 -11.906 -2.060 132 HD2 HIS 18 HD2 HIS 18 3.372 -11.953 -5.737 133 HE1 HIS 18 HE1 HIS 18 2.299 -14.252 -2.336 134 HE2 HIS 18 HE2 HIS 18 3.387 -14.280 -4.608 135 H LEU 19 H LEU 19 3.971 -8.655 -3.167 136 HA LEU 19 HA LEU 19 6.518 -8.446 -4.362 137 HB2 LEU 19 HB3 LEU 19 7.361 -8.485 -2.010 138 HB3 LEU 19 HB2 LEU 19 6.135 -7.276 -2.337 139 HG LEU 19 HG LEU 19 4.594 -9.328 -1.432 140 HD11 LEU 19 HD11 LEU 19 6.097 -9.746 0.790 141 HD12 LEU 19 HD12 LEU 19 7.328 -9.774 -0.472 142 HD13 LEU 19 HD13 LEU 19 5.956 -10.879 -0.554 143 HD21 LEU 19 HD21 LEU 19 4.512 -8.084 0.686 144 HD22 LEU 19 HD22 LEU 19 4.447 -7.014 -0.716 145 HD23 LEU 19 HD23 LEU 19 5.947 -7.181 0.198 146 HA PRO 20 HA PRO 20 7.219 -12.890 -4.600 147 HB2 PRO 20 HB3 PRO 20 9.534 -12.773 -5.982 148 HB3 PRO 20 HB2 PRO 20 7.963 -12.506 -6.744 149 HG2 PRO 20 HG3 PRO 20 9.986 -10.504 -5.821 150 HG3 PRO 20 HG2 PRO 20 9.030 -10.521 -7.314 151 HD2 PRO 20 HD3 PRO 20 8.385 -9.000 -5.150 152 HD3 PRO 20 HD2 PRO 20 7.178 -9.633 -6.286 153 H TRP 21 H TRP 21 9.230 -10.488 -3.128 154 HA TRP 21 HA TRP 21 11.166 -12.391 -2.128 155 HB2 TRP 21 HB3 TRP 21 12.024 -10.386 -0.860 156 HB3 TRP 21 HB2 TRP 21 12.007 -10.207 -2.612 157 HD1 TRP 21 HD1 TRP 21 9.436 -9.430 0.203 158 HE1 TRP 21 HE1 TRP 21 8.454 -7.099 -0.255 159 HE3 TRP 21 HE3 TRP 21 12.012 -8.291 -4.062 160 HZ2 TRP 21 HZ2 TRP 21 8.735 -5.043 -2.171 161 HZ3 TRP 21 HZ3 TRP 21 11.597 -6.122 -5.146 162 HH2 TRP 21 HH2 TRP 21 9.991 -4.533 -4.220 163 H HIS 22 H HIS 22 11.520 -12.829 0.105 164 HA HIS 22 HA HIS 22 9.026 -12.863 1.641 165 HB2 HIS 22 HB3 HIS 22 10.483 -14.959 1.155 166 HB3 HIS 22 HB2 HIS 22 11.535 -14.327 2.418 167 HD1 HIS 22 HD1 HIS 22 8.404 -16.176 1.880 168 HD2 HIS 22 HD2 HIS 22 10.291 -14.207 5.015 169 HE1 HIS 22 HE1 HIS 22 7.226 -16.946 3.964 170 HE2 HIS 22 HE2 HIS 22 8.326 -15.673 5.839 171 H LEU 23 H LEU 23 8.829 -11.037 2.794 172 HA LEU 23 HA LEU 23 11.157 -10.137 4.358 173 HB2 LEU 23 HB3 LEU 23 9.168 -8.716 2.771 174 HB3 LEU 23 HB2 LEU 23 9.316 -8.068 4.394 175 HG LEU 23 HG LEU 23 11.838 -7.988 3.943 176 HD11 LEU 23 HD11 LEU 23 10.953 -9.146 1.503 177 HD12 LEU 23 HD12 LEU 23 12.595 -8.754 2.010 178 HD13 LEU 23 HD13 LEU 23 11.626 -7.554 1.156 179 HD21 LEU 23 HD21 LEU 23 11.512 -5.866 2.531 180 HD22 LEU 23 HD22 LEU 23 10.738 -5.941 4.114 181 HD23 LEU 23 HD23 LEU 23 9.789 -6.222 2.654 182 HA PRO 24 HA PRO 24 8.316 -12.019 7.497 183 HB2 PRO 24 HB3 PRO 24 10.864 -11.629 8.995 184 HB3 PRO 24 HB2 PRO 24 9.776 -13.022 8.968 185 HG2 PRO 24 HG3 PRO 24 12.083 -13.079 7.643 186 HG3 PRO 24 HG2 PRO 24 10.620 -13.810 6.957 187 HD2 PRO 24 HD3 PRO 24 11.968 -11.243 6.253 188 HD3 PRO 24 HD2 PRO 24 11.116 -12.397 5.208 189 H ASP 25 H ASP 25 10.669 -9.386 7.968 190 HA ASP 25 HA ASP 25 9.392 -8.229 10.189 191 HB2 ASP 25 HB3 ASP 25 10.762 -6.201 9.504 192 HB3 ASP 25 HB2 ASP 25 11.663 -7.673 9.826 193 H ASP 26 H ASP 26 9.175 -7.569 6.712 194 HA ASP 26 HA ASP 26 7.446 -5.333 6.972 195 HB2 ASP 26 HB3 ASP 26 8.915 -6.193 4.945 196 HB3 ASP 26 HB2 ASP 26 7.420 -7.013 4.504 197 H LEU 27 H LEU 27 6.821 -8.718 6.039 198 HA LEU 27 HA LEU 27 4.081 -8.563 5.703 199 HB2 LEU 27 HB3 LEU 27 5.512 -10.906 6.943 200 HB3 LEU 27 HB2 LEU 27 4.012 -10.937 6.037 201 HG LEU 27 HG LEU 27 6.357 -9.877 4.584 202 HD11 LEU 27 HD11 LEU 27 6.207 -12.826 4.686 203 HD12 LEU 27 HD12 LEU 27 6.941 -12.017 6.071 204 HD13 LEU 27 HD13 LEU 27 7.596 -11.764 4.452 205 HD21 LEU 27 HD21 LEU 27 4.003 -11.642 4.005 206 HD22 LEU 27 HD22 LEU 27 5.336 -11.467 2.864 207 HD23 LEU 27 HD23 LEU 27 4.389 -10.057 3.337 208 H HIS 28 H HIS 28 5.708 -9.740 8.657 209 HA HIS 28 HA HIS 28 3.450 -9.839 10.271 210 HB2 HIS 28 HB3 HIS 28 6.300 -10.033 10.631 211 HB3 HIS 28 HB2 HIS 28 5.597 -9.101 11.949 212 HD1 HIS 28 HD1 HIS 28 5.032 -10.538 13.866 213 HD2 HIS 28 HD2 HIS 28 4.560 -12.544 10.258 214 HE1 HIS 28 HE1 HIS 28 4.259 -12.850 14.479 215 HE2 HIS 28 HE2 HIS 28 3.895 -14.018 12.276 216 H TYR 29 H TYR 29 5.765 -7.175 9.848 217 HA TYR 29 HA TYR 29 4.562 -5.402 11.668 218 HB2 TYR 29 HB3 TYR 29 6.837 -5.083 10.794 219 HB3 TYR 29 HB2 TYR 29 6.182 -4.772 9.190 220 HD1 TYR 29 HD1 TYR 29 5.894 -3.507 12.695 221 HD2 TYR 29 HD2 TYR 29 5.859 -2.576 8.544 222 HE1 TYR 29 HE1 TYR 29 5.721 -1.115 13.239 223 HE2 TYR 29 HE2 TYR 29 5.687 -0.182 9.076 224 HH TYR 29 HH TYR 29 6.149 1.340 10.890 225 H PHE 30 H PHE 30 3.852 -6.190 8.343 226 HA PHE 30 HA PHE 30 2.278 -3.972 7.668 227 HB2 PHE 30 HB3 PHE 30 2.984 -6.444 6.486 228 HB3 PHE 30 HB2 PHE 30 1.227 -6.354 6.452 229 HD1 PHE 30 HD2 PHE 30 4.215 -4.252 5.706 230 HD2 PHE 30 HD1 PHE 30 0.217 -5.292 4.685 231 HE1 PHE 30 HE2 PHE 30 4.334 -2.771 3.745 232 HE2 PHE 30 HE1 PHE 30 0.329 -3.813 2.721 233 HZ PHE 30 HZ PHE 30 2.390 -2.550 2.249 234 H ARG 31 H ARG 31 1.272 -7.164 8.897 235 HA ARG 31 HA ARG 31 -1.446 -6.310 9.258 236 HB2 ARG 31 HB3 ARG 31 -0.135 -8.764 9.065 237 HB3 ARG 31 HB2 ARG 31 -0.728 -8.713 10.719 238 HG2 ARG 31 HG3 ARG 31 -2.747 -9.266 10.015 239 HG3 ARG 31 HG2 ARG 31 -2.813 -7.801 9.035 240 HD2 ARG 31 HD3 ARG 31 -1.765 -10.506 8.219 241 HD3 ARG 31 HD2 ARG 31 -3.200 -9.687 7.610 242 HE ARG 31 HE ARG 31 -1.817 -8.202 6.406 243 HH11 ARG 31 HH11 ARG 31 0.013 -10.675 8.071 244 HH12 ARG 31 HH12 ARG 31 1.427 -10.449 7.100 245 HH21 ARG 31 HH21 ARG 31 0.046 -7.912 5.138 246 HH22 ARG 31 HH22 ARG 31 1.448 -8.883 5.439 247 H ALA 32 H ALA 32 1.413 -6.528 11.239 248 HA ALA 32 HA ALA 32 0.177 -6.422 13.772 249 HB1 ALA 32 HB1 ALA 32 2.911 -5.916 12.728 250 HB2 ALA 32 HB2 ALA 32 2.362 -7.044 13.967 251 HB3 ALA 32 HB3 ALA 32 2.515 -5.327 14.342 252 H GLN 33 H GLN 33 1.112 -3.925 11.480 253 HA GLN 33 HA GLN 33 0.516 -1.791 13.343 254 HB2 GLN 33 HB3 GLN 33 1.933 -2.051 10.857 255 HB3 GLN 33 HB2 GLN 33 0.752 -0.755 10.725 256 HG2 GLN 33 HG3 GLN 33 2.262 -0.691 13.216 257 HG3 GLN 33 HG2 GLN 33 3.268 -0.537 11.776 258 HE21 GLN 33 HE21 GLN 33 2.568 1.101 10.189 259 HE22 GLN 33 HE22 GLN 33 1.886 2.573 10.783 260 H THR 34 H THR 34 -1.090 -3.525 10.796 261 HA THR 34 HA THR 34 -3.242 -1.561 10.654 262 HB THR 34 HB THR 34 -4.169 -3.185 8.938 263 HG1 THR 34 HG1 THR 34 -1.588 -4.326 9.071 264 HG21 THR 34 HG21 THR 34 -2.906 -2.363 7.204 265 HG22 THR 34 HG22 THR 34 -1.407 -2.415 8.131 266 HG23 THR 34 HG23 THR 34 -2.610 -1.172 8.470 267 H VAL 35 H VAL 35 -2.900 -2.897 13.151 268 HA VAL 35 HA VAL 35 -5.036 -4.874 13.274 269 HB VAL 35 HB VAL 35 -3.399 -3.796 15.569 270 HG11 VAL 35 HG11 VAL 35 -5.233 -4.889 16.482 271 HG12 VAL 35 HG12 VAL 35 -4.006 -6.154 16.435 272 HG13 VAL 35 HG13 VAL 35 -5.270 -6.105 15.206 273 HG21 VAL 35 HG21 VAL 35 -2.061 -4.832 13.669 274 HG22 VAL 35 HG22 VAL 35 -2.852 -6.352 14.085 275 HG23 VAL 35 HG23 VAL 35 -1.838 -5.532 15.272 276 H GLY 36 H GLY 36 -6.772 -3.451 12.717 277 HA2 GLY 36 HA3 GLY 36 -8.722 -2.644 13.937 278 HA3 GLY 36 HA2 GLY 36 -7.621 -1.774 14.995 279 H LYS 37 H LYS 37 -7.018 -1.817 11.583 280 HA LYS 37 HA LYS 37 -8.078 0.923 11.362 281 HB2 LYS 37 HB3 LYS 37 -5.445 -0.145 10.331 282 HB3 LYS 37 HB2 LYS 37 -6.123 1.406 9.857 283 HG2 LYS 37 HG3 LYS 37 -5.953 1.005 12.751 284 HG3 LYS 37 HG2 LYS 37 -4.397 1.015 11.919 285 HD2 LYS 37 HD3 LYS 37 -4.492 3.220 11.585 286 HD3 LYS 37 HD2 LYS 37 -6.143 3.126 10.967 287 HE2 LYS 37 HE3 LYS 37 -6.570 4.344 12.830 288 HE3 LYS 37 HE2 LYS 37 -6.645 2.742 13.561 289 HZ1 LYS 37 HZ1 LYS 37 -3.995 3.879 13.471 290 HZ2 LYS 37 HZ2 LYS 37 -4.804 3.120 14.747 291 HZ3 LYS 37 HZ3 LYS 37 -5.084 4.756 14.424 292 H ILE 38 H ILE 38 -7.713 1.468 8.768 293 HA ILE 38 HA ILE 38 -9.132 -0.704 7.368 294 HB ILE 38 HB ILE 38 -9.568 1.833 6.079 295 HG12 ILE 38 HG13 ILE 38 -10.804 1.771 8.819 296 HG13 ILE 38 HG12 ILE 38 -9.241 2.538 8.569 297 HG21 ILE 38 HG21 ILE 38 -11.344 -0.218 7.375 298 HG22 ILE 38 HG22 ILE 38 -10.973 -0.030 5.662 299 HG23 ILE 38 HG23 ILE 38 -11.957 1.178 6.489 300 HD11 ILE 38 HD11 ILE 38 -11.928 3.365 7.639 301 HD12 ILE 38 HD12 ILE 38 -10.533 3.765 6.637 302 HD13 ILE 38 HD13 ILE 38 -10.609 4.328 8.305 303 H MET 39 H MET 39 -8.163 -1.509 5.635 304 HA MET 39 HA MET 39 -5.959 0.029 4.429 305 HB2 MET 39 HB3 MET 39 -5.137 -1.981 5.458 306 HB3 MET 39 HB2 MET 39 -6.377 -2.951 4.678 307 HG2 MET 39 HG3 MET 39 -5.262 -2.092 2.481 308 HG3 MET 39 HG2 MET 39 -3.888 -1.775 3.538 309 HE1 MET 39 HE1 MET 39 -6.552 -4.342 2.569 310 HE2 MET 39 HE2 MET 39 -6.336 -4.933 4.217 311 HE3 MET 39 HE3 MET 39 -5.791 -5.907 2.852 312 H VAL 40 H VAL 40 -6.032 0.524 2.327 313 HA VAL 40 HA VAL 40 -8.382 -0.302 0.798 314 HB VAL 40 HB VAL 40 -6.280 1.715 0.006 315 HG11 VAL 40 HG11 VAL 40 -9.095 1.823 -0.924 316 HG12 VAL 40 HG12 VAL 40 -8.051 0.578 -1.610 317 HG13 VAL 40 HG13 VAL 40 -7.608 2.279 -1.755 318 HG21 VAL 40 HG21 VAL 40 -8.951 2.379 1.209 319 HG22 VAL 40 HG22 VAL 40 -7.563 3.437 0.954 320 HG23 VAL 40 HG23 VAL 40 -7.502 2.186 2.196 321 H VAL 41 H VAL 41 -8.305 -1.569 -0.978 322 HA VAL 41 HA VAL 41 -5.665 -2.334 -2.012 323 HB VAL 41 HB VAL 41 -7.069 -4.004 -0.404 324 HG11 VAL 41 HG11 VAL 41 -8.331 -5.586 -1.543 325 HG12 VAL 41 HG12 VAL 41 -7.707 -5.095 -3.119 326 HG13 VAL 41 HG13 VAL 41 -8.847 -4.060 -2.259 327 HG21 VAL 41 HG21 VAL 41 -5.746 -5.682 -2.249 328 HG22 VAL 41 HG22 VAL 41 -5.155 -5.073 -0.703 329 HG23 VAL 41 HG23 VAL 41 -4.850 -4.164 -2.182 330 H GLY 42 H GLY 42 -5.536 -2.699 -4.202 331 HA2 GLY 42 HA3 GLY 42 -7.623 -1.543 -5.802 332 HA3 GLY 42 HA2 GLY 42 -6.102 -2.199 -6.387 333 H ARG 43 H ARG 43 -8.293 -2.651 -7.883 334 HA ARG 43 HA ARG 43 -9.868 -4.859 -7.326 335 HB2 ARG 43 HB3 ARG 43 -10.206 -3.358 -9.258 336 HB3 ARG 43 HB2 ARG 43 -8.782 -4.047 -10.026 337 HG2 ARG 43 HG3 ARG 43 -10.184 -6.291 -9.558 338 HG3 ARG 43 HG2 ARG 43 -11.503 -5.136 -9.752 339 HD2 ARG 43 HD3 ARG 43 -9.248 -5.549 -11.711 340 HD3 ARG 43 HD2 ARG 43 -10.869 -6.224 -11.870 341 HE ARG 43 HE ARG 43 -10.748 -3.347 -11.594 342 HH11 ARG 43 HH11 ARG 43 -10.828 -6.055 -13.798 343 HH12 ARG 43 HH12 ARG 43 -11.432 -5.117 -15.122 344 HH21 ARG 43 HH21 ARG 43 -11.541 -2.116 -13.336 345 HH22 ARG 43 HH22 ARG 43 -11.835 -2.882 -14.861 346 H ARG 44 H ARG 44 -6.930 -4.870 -9.348 347 HA ARG 44 HA ARG 44 -6.709 -7.677 -9.448 348 HB2 ARG 44 HB3 ARG 44 -5.043 -5.364 -10.199 349 HB3 ARG 44 HB2 ARG 44 -4.146 -6.833 -9.840 350 HG2 ARG 44 HG3 ARG 44 -4.489 -7.185 -12.044 351 HG3 ARG 44 HG2 ARG 44 -5.995 -7.879 -11.442 352 HD2 ARG 44 HD3 ARG 44 -6.448 -6.409 -13.310 353 HD3 ARG 44 HD2 ARG 44 -7.119 -5.727 -11.829 354 HE ARG 44 HE ARG 44 -4.740 -4.516 -11.950 355 HH11 ARG 44 HH11 ARG 44 -7.209 -4.974 -14.377 356 HH12 ARG 44 HH12 ARG 44 -6.814 -3.520 -15.229 357 HH21 ARG 44 HH21 ARG 44 -4.224 -2.603 -13.070 358 HH22 ARG 44 HH22 ARG 44 -5.122 -2.173 -14.488 359 H THR 45 H THR 45 -6.006 -5.437 -6.975 360 HA THR 45 HA THR 45 -3.938 -6.928 -5.683 361 HB THR 45 HB THR 45 -5.569 -5.037 -4.098 362 HG1 THR 45 HG1 THR 45 -3.952 -4.115 -6.230 363 HG21 THR 45 HG21 THR 45 -2.618 -5.260 -4.633 364 HG22 THR 45 HG22 THR 45 -3.474 -5.837 -3.203 365 HG23 THR 45 HG23 THR 45 -3.376 -4.108 -3.534 366 H TYR 46 H TYR 46 -7.390 -6.365 -4.908 367 HA TYR 46 HA TYR 46 -7.532 -7.989 -2.670 368 HB2 TYR 46 HB3 TYR 46 -9.903 -7.994 -2.926 369 HB3 TYR 46 HB2 TYR 46 -9.336 -6.441 -3.522 370 HD1 TYR 46 HD2 TYR 46 -10.075 -9.868 -4.843 371 HD2 TYR 46 HD1 TYR 46 -10.273 -5.664 -5.493 372 HE1 TYR 46 HE2 TYR 46 -11.241 -10.258 -6.958 373 HE2 TYR 46 HE1 TYR 46 -11.458 -6.052 -7.610 374 HH TYR 46 HH TYR 46 -12.776 -7.735 -8.707 375 H GLU 47 H GLU 47 -7.851 -8.879 -6.077 376 HA GLU 47 HA GLU 47 -8.444 -11.629 -5.504 377 HB2 GLU 47 HB3 GLU 47 -8.477 -9.928 -7.785 378 HB3 GLU 47 HB2 GLU 47 -7.454 -11.307 -8.164 379 HG2 GLU 47 HG3 GLU 47 -10.059 -11.861 -6.876 380 HG3 GLU 47 HG2 GLU 47 -10.078 -11.313 -8.551 381 H SER 48 H SER 48 -5.597 -9.743 -5.882 382 HA SER 48 HA SER 48 -3.917 -12.097 -6.293 383 HB2 SER 48 HB3 SER 48 -2.098 -10.571 -6.672 384 HB3 SER 48 HB2 SER 48 -3.496 -9.976 -7.566 385 HG SER 48 HG SER 48 -2.538 -9.038 -5.066 386 H PHE 49 H PHE 49 -5.366 -10.911 -3.685 387 HA PHE 49 HA PHE 49 -3.027 -11.115 -1.927 388 HB2 PHE 49 HB3 PHE 49 -5.104 -9.305 -1.924 389 HB3 PHE 49 HB2 PHE 49 -5.574 -10.433 -0.657 390 HD1 PHE 49 HD1 PHE 49 -2.777 -8.280 -1.802 391 HD2 PHE 49 HD2 PHE 49 -4.609 -10.314 1.456 392 HE1 PHE 49 HE1 PHE 49 -1.226 -7.174 -0.244 393 HE2 PHE 49 HE2 PHE 49 -3.063 -9.210 3.020 394 HZ PHE 49 HZ PHE 49 -1.369 -7.638 2.171 395 HA PRO 50 HA PRO 50 -4.474 -15.313 -1.152 396 HB2 PRO 50 HB3 PRO 50 -2.274 -15.336 0.807 397 HB3 PRO 50 HB2 PRO 50 -2.548 -16.383 -0.588 398 HG2 PRO 50 HG3 PRO 50 -0.602 -14.537 -0.575 399 HG3 PRO 50 HG2 PRO 50 -1.505 -14.933 -2.050 400 HD2 PRO 50 HD3 PRO 50 -1.814 -12.591 -0.207 401 HD3 PRO 50 HD2 PRO 50 -1.867 -12.645 -1.982 402 H LYS 51 H LYS 51 -4.292 -12.672 1.019 403 HA LYS 51 HA LYS 51 -5.879 -14.184 2.987 404 HB2 LYS 51 HB3 LYS 51 -3.503 -12.507 3.355 405 HB3 LYS 51 HB2 LYS 51 -4.831 -12.090 4.430 406 HG2 LYS 51 HG3 LYS 51 -3.770 -14.886 4.118 407 HG3 LYS 51 HG2 LYS 51 -3.192 -13.748 5.338 408 HD2 LYS 51 HD3 LYS 51 -4.814 -14.596 6.632 409 HD3 LYS 51 HD2 LYS 51 -5.909 -13.614 5.658 410 HE2 LYS 51 HE3 LYS 51 -5.661 -15.825 4.103 411 HE3 LYS 51 HE2 LYS 51 -5.514 -16.527 5.714 412 HZ1 LYS 51 HZ1 LYS 51 -7.719 -14.697 4.956 413 HZ2 LYS 51 HZ2 LYS 51 -7.616 -15.687 6.324 414 HZ3 LYS 51 HZ3 LYS 51 -7.826 -16.379 4.795 415 H ARG 52 H ARG 52 -7.600 -13.373 1.458 416 HA ARG 52 HA ARG 52 -8.425 -10.662 2.255 417 HB2 ARG 52 HB3 ARG 52 -9.680 -10.584 0.086 418 HB3 ARG 52 HB2 ARG 52 -7.930 -10.599 -0.080 419 HG2 ARG 52 HG3 ARG 52 -7.937 -12.529 -1.200 420 HG3 ARG 52 HG2 ARG 52 -9.124 -13.261 -0.120 421 HD2 ARG 52 HD3 ARG 52 -10.839 -11.775 -1.299 422 HD3 ARG 52 HD2 ARG 52 -9.593 -11.515 -2.518 423 HE ARG 52 HE ARG 52 -11.206 -13.837 -2.193 424 HH11 ARG 52 HH11 ARG 52 -8.032 -12.768 -3.176 425 HH12 ARG 52 HH12 ARG 52 -7.761 -14.124 -4.217 426 HH21 ARG 52 HH21 ARG 52 -10.850 -15.622 -3.562 427 HH22 ARG 52 HH22 ARG 52 -9.361 -15.744 -4.437 428 HA PRO 53 HA PRO 53 -9.611 -9.663 3.218 429 HB2 PRO 53 HB3 PRO 53 -11.117 -9.141 5.348 430 HB3 PRO 53 HB2 PRO 53 -11.800 -9.080 3.719 431 HG2 PRO 53 HG3 PRO 53 -12.064 -11.193 5.808 432 HG3 PRO 53 HG2 PRO 53 -13.267 -10.601 4.651 433 HD2 PRO 53 HD3 PRO 53 -11.724 -12.918 4.371 434 HD3 PRO 53 HD2 PRO 53 -12.621 -12.104 3.075 435 H LEU 54 H LEU 54 -8.286 -8.865 4.912 436 HA LEU 54 HA LEU 54 -6.770 -10.837 6.270 437 HB2 LEU 54 HB3 LEU 54 -6.809 -7.833 6.502 438 HB3 LEU 54 HB2 LEU 54 -5.647 -8.856 7.325 439 HG LEU 54 HG LEU 54 -5.938 -8.966 4.340 440 HD11 LEU 54 HD11 LEU 54 -4.104 -7.100 5.832 441 HD12 LEU 54 HD12 LEU 54 -5.595 -6.603 5.033 442 HD13 LEU 54 HD13 LEU 54 -4.268 -7.271 4.084 443 HD21 LEU 54 HD21 LEU 54 -3.328 -9.241 5.642 444 HD22 LEU 54 HD22 LEU 54 -4.088 -10.231 4.396 445 HD23 LEU 54 HD23 LEU 54 -4.504 -10.476 6.092 446 HA PRO 55 HA PRO 55 -9.196 -11.231 9.958 447 HB2 PRO 55 HB3 PRO 55 -6.769 -12.104 11.347 448 HB3 PRO 55 HB2 PRO 55 -8.226 -13.018 10.956 449 HG2 PRO 55 HG3 PRO 55 -5.871 -13.472 9.725 450 HG3 PRO 55 HG2 PRO 55 -7.427 -13.670 8.899 451 HD2 PRO 55 HD3 PRO 55 -5.478 -11.399 8.752 452 HD3 PRO 55 HD2 PRO 55 -6.406 -12.177 7.451 453 H GLU 56 H GLU 56 -9.462 -10.425 12.050 454 HA GLU 56 HA GLU 56 -9.543 -8.706 13.538 455 HB2 GLU 56 HB3 GLU 56 -7.094 -10.069 13.731 456 HB3 GLU 56 HB2 GLU 56 -6.709 -8.365 13.922 457 HG2 GLU 56 HG3 GLU 56 -7.626 -8.267 15.949 458 HG3 GLU 56 HG2 GLU 56 -9.043 -9.191 15.453 459 H ARG 57 H ARG 57 -9.293 -7.840 10.711 460 HA ARG 57 HA ARG 57 -8.634 -5.087 11.310 461 HB2 ARG 57 HB3 ARG 57 -6.972 -4.747 9.701 462 HB3 ARG 57 HB2 ARG 57 -6.514 -6.253 10.478 463 HG2 ARG 57 HG3 ARG 57 -6.188 -6.767 8.273 464 HG3 ARG 57 HG2 ARG 57 -7.834 -7.348 8.520 465 HD2 ARG 57 HD3 ARG 57 -7.258 -5.898 6.431 466 HD3 ARG 57 HD2 ARG 57 -8.767 -5.634 7.300 467 HE ARG 57 HE ARG 57 -8.029 -3.549 7.868 468 HH11 ARG 57 HH11 ARG 57 -5.293 -5.449 6.828 469 HH12 ARG 57 HH12 ARG 57 -4.197 -4.109 6.854 470 HH21 ARG 57 HH21 ARG 57 -6.594 -1.789 7.903 471 HH22 ARG 57 HH22 ARG 57 -4.935 -2.029 7.465 472 H THR 58 H THR 58 -9.207 -3.615 9.476 473 HA THR 58 HA THR 58 -11.619 -4.641 8.150 474 HB THR 58 HB THR 58 -10.813 -1.755 8.534 475 HG1 THR 58 HG1 THR 58 -11.101 -2.755 10.553 476 HG21 THR 58 HG21 THR 58 -13.595 -2.801 8.207 477 HG22 THR 58 HG22 THR 58 -12.593 -2.396 6.813 478 HG23 THR 58 HG23 THR 58 -12.991 -1.157 8.004 479 H ASN 59 H ASN 59 -11.507 -5.067 6.047 480 HA ASN 59 HA ASN 59 -9.294 -3.942 4.499 481 HB2 ASN 59 HB3 ASN 59 -11.170 -6.235 3.898 482 HB3 ASN 59 HB2 ASN 59 -9.881 -5.690 2.829 483 HD21 ASN 59 HD21 ASN 59 -10.489 -6.851 6.106 484 HD22 ASN 59 HD22 ASN 59 -8.986 -7.681 6.283 485 H VAL 60 H VAL 60 -9.623 -3.151 2.371 486 HA VAL 60 HA VAL 60 -12.338 -2.269 1.713 487 HB VAL 60 HB VAL 60 -9.917 -0.475 1.916 488 HG11 VAL 60 HG11 VAL 60 -10.703 0.525 0.068 489 HG12 VAL 60 HG12 VAL 60 -11.938 1.175 1.148 490 HG13 VAL 60 HG13 VAL 60 -12.276 -0.265 0.187 491 HG21 VAL 60 HG21 VAL 60 -10.865 0.415 3.737 492 HG22 VAL 60 HG22 VAL 60 -11.827 -1.062 3.776 493 HG23 VAL 60 HG23 VAL 60 -12.478 0.395 3.026 494 H VAL 61 H VAL 61 -12.800 -2.538 -0.397 495 HA VAL 61 HA VAL 61 -10.565 -3.207 -2.190 496 HB VAL 61 HB VAL 61 -13.460 -4.054 -2.336 497 HG11 VAL 61 HG11 VAL 61 -11.426 -3.932 -4.384 498 HG12 VAL 61 HG12 VAL 61 -13.136 -4.340 -4.519 499 HG13 VAL 61 HG13 VAL 61 -11.962 -5.591 -4.112 500 HG21 VAL 61 HG21 VAL 61 -12.150 -5.198 -0.612 501 HG22 VAL 61 HG22 VAL 61 -10.954 -5.652 -1.827 502 HG23 VAL 61 HG23 VAL 61 -12.595 -6.292 -1.923 503 H LEU 62 H LEU 62 -10.231 -2.086 -3.999 504 HA LEU 62 HA LEU 62 -12.234 -0.065 -4.757 505 HB2 LEU 62 HB3 LEU 62 -10.098 0.821 -3.730 506 HB3 LEU 62 HB2 LEU 62 -9.254 0.196 -5.134 507 HG LEU 62 HG LEU 62 -10.652 1.663 -6.578 508 HD11 LEU 62 HD11 LEU 62 -11.765 3.587 -5.316 509 HD12 LEU 62 HD12 LEU 62 -11.722 2.520 -3.912 510 HD13 LEU 62 HD13 LEU 62 -12.609 2.039 -5.359 511 HD21 LEU 62 HD21 LEU 62 -8.700 2.581 -4.579 512 HD22 LEU 62 HD22 LEU 62 -9.650 3.850 -5.352 513 HD23 LEU 62 HD23 LEU 62 -8.692 2.743 -6.335 514 H THR 63 H THR 63 -13.225 -1.059 -6.426 515 HA THR 63 HA THR 63 -11.556 -1.757 -8.737 516 HB THR 63 HB THR 63 -12.248 -3.859 -7.772 517 HG1 THR 63 HG1 THR 63 -13.528 -4.648 -9.510 518 HG21 THR 63 HG21 THR 63 -14.065 -3.790 -6.469 519 HG22 THR 63 HG22 THR 63 -14.918 -4.159 -7.968 520 HG23 THR 63 HG23 THR 63 -14.816 -2.493 -7.399 521 H HIS 64 H HIS 64 -12.504 -1.338 -10.776 522 HA HIS 64 HA HIS 64 -14.292 0.882 -10.797 523 HB2 HIS 64 HB3 HIS 64 -12.875 -0.732 -12.867 524 HB3 HIS 64 HB2 HIS 64 -14.236 0.261 -13.377 525 HD1 HIS 64 HD1 HIS 64 -13.567 2.629 -11.337 526 HD2 HIS 64 HD2 HIS 64 -10.951 0.879 -14.048 527 HE1 HIS 64 HE1 HIS 64 -11.783 4.350 -11.756 528 HE2 HIS 64 HE2 HIS 64 -10.261 3.302 -13.468 529 H GLN 65 H GLN 65 -14.647 -2.557 -11.201 530 HA GLN 65 HA GLN 65 -17.025 -2.793 -12.552 531 HB2 GLN 65 HB3 GLN 65 -15.749 -4.390 -10.370 532 HB3 GLN 65 HB2 GLN 65 -17.383 -4.795 -10.877 533 HG2 GLN 65 HG3 GLN 65 -16.714 -5.602 -12.879 534 HG3 GLN 65 HG2 GLN 65 -15.375 -4.463 -13.016 535 HE21 GLN 65 HE21 GLN 65 -13.504 -4.864 -11.616 536 HE22 GLN 65 HE22 GLN 65 -13.067 -6.499 -11.271 537 H GLU 66 H GLU 66 -19.086 -2.292 -12.184 538 HA GLU 66 HA GLU 66 -19.774 -0.881 -9.757 539 HB2 GLU 66 HB3 GLU 66 -21.895 -0.418 -10.857 540 HB3 GLU 66 HB2 GLU 66 -20.560 -0.077 -11.949 541 HG2 GLU 66 HG3 GLU 66 -21.077 -2.622 -12.634 542 HG3 GLU 66 HG2 GLU 66 -22.684 -2.108 -12.122 543 H ASP 67 H ASP 67 -20.464 -3.962 -11.277 544 HA ASP 67 HA ASP 67 -22.318 -4.679 -9.140 545 HB2 ASP 67 HB3 ASP 67 -21.653 -5.831 -11.820 546 HB3 ASP 67 HB2 ASP 67 -22.397 -6.861 -10.600 547 H TYR 68 H TYR 68 -19.270 -4.453 -8.869 548 HA TYR 68 HA TYR 68 -18.347 -7.122 -8.434 549 HB2 TYR 68 HB3 TYR 68 -16.782 -5.289 -8.905 550 HB3 TYR 68 HB2 TYR 68 -17.248 -4.497 -7.403 551 HD1 TYR 68 HD1 TYR 68 -15.954 -7.801 -8.585 552 HD2 TYR 68 HD2 TYR 68 -15.898 -4.811 -5.559 553 HE1 TYR 68 HE1 TYR 68 -14.212 -9.055 -7.386 554 HE2 TYR 68 HE2 TYR 68 -14.154 -6.055 -4.355 555 HH TYR 68 HH TYR 68 -12.543 -7.720 -4.639 556 H GLN 69 H GLN 69 -18.014 -8.199 -6.460 557 HA GLN 69 HA GLN 69 -19.431 -7.068 -4.143 558 HB2 GLN 69 HB3 GLN 69 -19.667 -9.861 -5.258 559 HB3 GLN 69 HB2 GLN 69 -20.201 -9.424 -3.641 560 HG2 GLN 69 HG3 GLN 69 -21.250 -8.350 -6.246 561 HG3 GLN 69 HG2 GLN 69 -22.082 -9.424 -5.122 562 HE21 GLN 69 HE21 GLN 69 -21.799 -6.305 -6.126 563 HE22 GLN 69 HE22 GLN 69 -22.436 -5.496 -4.739 564 H ALA 70 H ALA 70 -17.847 -6.670 -2.735 565 HA ALA 70 HA ALA 70 -15.687 -8.625 -2.400 566 HB1 ALA 70 HB1 ALA 70 -15.233 -6.141 -2.748 567 HB2 ALA 70 HB2 ALA 70 -14.404 -6.928 -1.406 568 HB3 ALA 70 HB3 ALA 70 -15.818 -5.920 -1.100 569 H GLN 71 H GLN 71 -16.519 -10.209 -1.122 570 HA GLN 71 HA GLN 71 -18.187 -9.694 1.130 571 HB2 GLN 71 HB3 GLN 71 -16.654 -12.171 0.326 572 HB3 GLN 71 HB2 GLN 71 -17.830 -12.106 1.631 573 HG2 GLN 71 HG3 GLN 71 -19.063 -12.964 -0.112 574 HG3 GLN 71 HG2 GLN 71 -19.451 -11.245 -0.185 575 HE21 GLN 71 HE21 GLN 71 -16.755 -13.243 -1.350 576 HE22 GLN 71 HE22 GLN 71 -16.829 -12.690 -2.985 577 H GLY 72 H GLY 72 -17.529 -8.824 2.977 578 HA2 GLY 72 HA3 GLY 72 -16.312 -9.075 5.023 579 HA3 GLY 72 HA2 GLY 72 -14.970 -9.731 4.103 580 H ALA 73 H ALA 73 -15.416 -7.406 2.109 581 HA ALA 73 HA ALA 73 -14.191 -5.308 3.772 582 HB1 ALA 73 HB1 ALA 73 -12.496 -6.502 2.438 583 HB2 ALA 73 HB2 ALA 73 -12.643 -4.804 1.985 584 HB3 ALA 73 HB3 ALA 73 -13.365 -6.054 0.970 585 H VAL 74 H VAL 74 -14.169 -3.149 2.577 586 HA VAL 74 HA VAL 74 -16.874 -2.597 1.714 587 HB VAL 74 HB VAL 74 -14.645 -0.578 1.779 588 HG11 VAL 74 HG11 VAL 74 -17.369 0.059 2.697 589 HG12 VAL 74 HG12 VAL 74 -17.211 -0.335 0.985 590 HG13 VAL 74 HG13 VAL 74 -16.267 0.984 1.677 591 HG21 VAL 74 HG21 VAL 74 -14.509 -1.691 3.909 592 HG22 VAL 74 HG22 VAL 74 -16.257 -1.592 4.118 593 HG23 VAL 74 HG23 VAL 74 -15.282 -0.123 4.137 594 H VAL 75 H VAL 75 -17.531 -1.931 -0.288 595 HA VAL 75 HA VAL 75 -15.534 -2.182 -2.439 596 HB VAL 75 HB VAL 75 -18.516 -2.583 -2.670 597 HG11 VAL 75 HG11 VAL 75 -16.235 -2.713 -4.578 598 HG12 VAL 75 HG12 VAL 75 -17.872 -2.101 -4.814 599 HG13 VAL 75 HG13 VAL 75 -17.576 -3.839 -4.785 600 HG21 VAL 75 HG21 VAL 75 -18.294 -4.775 -2.207 601 HG22 VAL 75 HG22 VAL 75 -16.853 -4.249 -1.338 602 HG23 VAL 75 HG23 VAL 75 -16.711 -4.882 -2.977 603 H VAL 76 H VAL 76 -15.258 -0.613 -3.885 604 HA VAL 76 HA VAL 76 -17.203 1.463 -4.323 605 HB VAL 76 HB VAL 76 -15.790 3.344 -3.733 606 HG11 VAL 76 HG11 VAL 76 -15.982 3.251 -1.358 607 HG12 VAL 76 HG12 VAL 76 -15.924 1.489 -1.365 608 HG13 VAL 76 HG13 VAL 76 -17.322 2.327 -2.037 609 HG21 VAL 76 HG21 VAL 76 -13.722 1.424 -3.731 610 HG22 VAL 76 HG22 VAL 76 -13.812 2.088 -2.099 611 HG23 VAL 76 HG23 VAL 76 -13.596 3.165 -3.479 612 H HIS 77 H HIS 77 -16.423 2.998 -6.052 613 HA HIS 77 HA HIS 77 -14.374 1.719 -7.736 614 HB2 HIS 77 HB3 HIS 77 -16.656 3.039 -9.103 615 HB3 HIS 77 HB2 HIS 77 -15.713 1.632 -9.584 616 HD1 HIS 77 HD1 HIS 77 -16.202 -0.303 -7.341 617 HD2 HIS 77 HD2 HIS 77 -19.194 2.125 -8.895 618 HE1 HIS 77 HE1 HIS 77 -18.365 -1.448 -6.763 619 HE2 HIS 77 HE2 HIS 77 -20.158 -0.002 -7.783 620 H ASP 78 H ASP 78 -15.521 4.616 -6.342 621 HA ASP 78 HA ASP 78 -13.703 6.147 -8.083 622 HB2 ASP 78 HB3 ASP 78 -16.414 6.858 -7.012 623 HB3 ASP 78 HB2 ASP 78 -15.251 8.125 -7.390 624 H VAL 79 H VAL 79 -12.640 7.967 -7.105 625 HA VAL 79 HA VAL 79 -11.559 7.391 -4.571 626 HB VAL 79 HB VAL 79 -10.670 9.805 -4.805 627 HG11 VAL 79 HG11 VAL 79 -9.990 7.379 -6.328 628 HG12 VAL 79 HG12 VAL 79 -9.010 8.333 -5.214 629 HG13 VAL 79 HG13 VAL 79 -9.239 8.878 -6.876 630 HG21 VAL 79 HG21 VAL 79 -11.452 9.445 -7.673 631 HG22 VAL 79 HG22 VAL 79 -10.823 10.884 -6.871 632 HG23 VAL 79 HG23 VAL 79 -12.467 10.339 -6.542 633 H ALA 80 H ALA 80 -14.058 9.595 -5.675 634 HA ALA 80 HA ALA 80 -14.349 11.003 -3.226 635 HB1 ALA 80 HB1 ALA 80 -16.591 11.652 -4.216 636 HB2 ALA 80 HB2 ALA 80 -16.145 10.679 -5.618 637 HB3 ALA 80 HB3 ALA 80 -15.167 12.075 -5.166 638 H ALA 81 H ALA 81 -15.930 8.169 -4.625 639 HA ALA 81 HA ALA 81 -17.969 7.813 -2.768 640 HB1 ALA 81 HB1 ALA 81 -18.238 6.312 -4.441 641 HB2 ALA 81 HB2 ALA 81 -17.361 5.257 -3.333 642 HB3 ALA 81 HB3 ALA 81 -16.504 6.065 -4.645 643 H VAL 82 H VAL 82 -14.899 5.988 -2.776 644 HA VAL 82 HA VAL 82 -15.058 4.901 -0.266 645 HB VAL 82 HB VAL 82 -13.283 4.563 -2.111 646 HG11 VAL 82 HG11 VAL 82 -11.436 5.877 -2.228 647 HG12 VAL 82 HG12 VAL 82 -11.513 6.331 -0.526 648 HG13 VAL 82 HG13 VAL 82 -12.594 7.093 -1.692 649 HG21 VAL 82 HG21 VAL 82 -11.819 3.494 -0.599 650 HG22 VAL 82 HG22 VAL 82 -13.419 3.429 0.141 651 HG23 VAL 82 HG23 VAL 82 -12.233 4.607 0.705 652 H PHE 83 H PHE 83 -14.167 8.180 -1.149 653 HA PHE 83 HA PHE 83 -12.988 8.960 1.277 654 HB2 PHE 83 HB3 PHE 83 -14.126 10.320 -1.079 655 HB3 PHE 83 HB2 PHE 83 -14.168 11.265 0.403 656 HD1 PHE 83 HD2 PHE 83 -11.457 8.899 0.186 657 HD2 PHE 83 HD1 PHE 83 -12.686 12.841 -0.858 658 HE1 PHE 83 HE2 PHE 83 -9.107 9.538 -0.159 659 HE2 PHE 83 HE1 PHE 83 -10.337 13.483 -1.205 660 HZ PHE 83 HZ PHE 83 -8.545 11.832 -0.855 661 H ALA 84 H ALA 84 -16.367 8.906 0.233 662 HA ALA 84 HA ALA 84 -17.446 10.230 2.471 663 HB1 ALA 84 HB1 ALA 84 -18.738 9.829 0.427 664 HB2 ALA 84 HB2 ALA 84 -19.573 9.200 1.847 665 HB3 ALA 84 HB3 ALA 84 -18.728 8.097 0.759 666 H TYR 85 H TYR 85 -16.625 6.875 1.851 667 HA TYR 85 HA TYR 85 -17.730 5.782 4.204 668 HB2 TYR 85 HB3 TYR 85 -17.025 3.885 3.239 669 HB3 TYR 85 HB2 TYR 85 -16.189 4.831 2.018 670 HD1 TYR 85 HD1 TYR 85 -15.685 3.596 5.516 671 HD2 TYR 85 HD2 TYR 85 -13.934 4.508 1.754 672 HE1 TYR 85 HE1 TYR 85 -13.529 2.719 6.314 673 HE2 TYR 85 HE2 TYR 85 -11.773 3.637 2.535 674 HH TYR 85 HH TYR 85 -10.790 2.338 4.165 675 H ALA 86 H ALA 86 -14.317 6.595 3.507 676 HA ALA 86 HA ALA 86 -13.182 6.324 5.937 677 HB1 ALA 86 HB1 ALA 86 -12.070 8.713 5.108 678 HB2 ALA 86 HB2 ALA 86 -12.659 7.989 3.611 679 HB3 ALA 86 HB3 ALA 86 -11.538 7.098 4.640 680 H LYS 87 H LYS 87 -15.318 8.965 4.968 681 HA LYS 87 HA LYS 87 -14.907 10.587 7.258 682 HB2 LYS 87 HB3 LYS 87 -16.313 10.843 4.910 683 HB3 LYS 87 HB2 LYS 87 -17.606 10.650 6.085 684 HG2 LYS 87 HG3 LYS 87 -17.410 12.881 6.255 685 HG3 LYS 87 HG2 LYS 87 -16.093 12.473 7.357 686 HD2 LYS 87 HD3 LYS 87 -15.233 12.506 4.583 687 HD3 LYS 87 HD2 LYS 87 -15.917 14.053 5.086 688 HE2 LYS 87 HE3 LYS 87 -14.410 13.999 7.068 689 HE3 LYS 87 HE2 LYS 87 -13.661 12.548 6.402 690 HZ1 LYS 87 HZ1 LYS 87 -12.565 13.722 4.845 691 HZ2 LYS 87 HZ2 LYS 87 -12.770 15.002 5.931 692 HZ3 LYS 87 HZ3 LYS 87 -13.819 14.833 4.615 693 H GLN 88 H GLN 88 -17.283 8.134 6.427 694 HA GLN 88 HA GLN 88 -18.832 8.199 8.750 695 HB2 GLN 88 HB3 GLN 88 -19.003 6.818 6.459 696 HB3 GLN 88 HB2 GLN 88 -18.356 5.551 7.491 697 HG2 GLN 88 HG3 GLN 88 -20.345 5.190 8.380 698 HG3 GLN 88 HG2 GLN 88 -20.493 6.884 8.844 699 HE21 GLN 88 HE21 GLN 88 -20.309 5.389 5.645 700 HE22 GLN 88 HE22 GLN 88 -21.836 5.975 5.088 701 H HIS 89 H HIS 89 -15.634 7.090 8.286 702 HA HIS 89 HA HIS 89 -15.662 5.747 10.907 703 HB2 HIS 89 HB3 HIS 89 -14.290 5.142 8.346 704 HB3 HIS 89 HB2 HIS 89 -13.359 4.878 9.817 705 HD1 HIS 89 HD1 HIS 89 -15.434 3.678 11.666 706 HD2 HIS 89 HD2 HIS 89 -15.105 2.662 7.650 707 HE1 HIS 89 HE1 HIS 89 -16.491 1.405 11.459 708 HE2 HIS 89 HE2 HIS 89 -16.200 0.772 9.038 709 HA PRO 90 HA PRO 90 -13.218 9.615 11.445 710 HB2 PRO 90 HB3 PRO 90 -14.178 9.464 14.204 711 HB3 PRO 90 HB2 PRO 90 -14.391 10.749 13.014 712 HG2 PRO 90 HG3 PRO 90 -16.430 9.174 13.825 713 HG3 PRO 90 HG2 PRO 90 -16.335 9.843 12.186 714 HD2 PRO 90 HD3 PRO 90 -15.664 7.087 13.152 715 HD3 PRO 90 HD2 PRO 90 -16.513 7.588 11.675 716 H ASP 91 H ASP 91 -13.468 6.988 13.873 717 HA ASP 91 HA ASP 91 -10.852 7.557 14.903 718 HB2 ASP 91 HB3 ASP 91 -13.022 6.405 15.990 719 HB3 ASP 91 HB2 ASP 91 -12.140 4.958 15.511 720 H GLN 92 H GLN 92 -11.712 6.147 12.070 721 HA GLN 92 HA GLN 92 -9.510 4.198 12.172 722 HB2 GLN 92 HB3 GLN 92 -11.575 4.326 9.993 723 HB3 GLN 92 HB2 GLN 92 -10.542 2.979 10.445 724 HG2 GLN 92 HG3 GLN 92 -12.125 3.651 12.696 725 HG3 GLN 92 HG2 GLN 92 -13.185 3.554 11.291 726 HE21 GLN 92 HE21 GLN 92 -13.265 1.596 10.108 727 HE22 GLN 92 HE22 GLN 92 -12.827 0.096 10.845 728 H GLU 93 H GLU 93 -7.887 4.233 10.646 729 HA GLU 93 HA GLU 93 -7.680 6.734 9.114 730 HB2 GLU 93 HB3 GLU 93 -5.885 5.445 10.859 731 HB3 GLU 93 HB2 GLU 93 -5.214 5.244 9.247 732 HG2 GLU 93 HG3 GLU 93 -6.164 7.947 9.757 733 HG3 GLU 93 HG2 GLU 93 -4.899 7.430 10.871 734 H LEU 94 H LEU 94 -6.667 6.649 7.002 735 HA LEU 94 HA LEU 94 -7.410 4.201 5.569 736 HB2 LEU 94 HB3 LEU 94 -8.014 6.813 5.046 737 HB3 LEU 94 HB2 LEU 94 -6.624 6.565 4.006 738 HG LEU 94 HG LEU 94 -7.815 4.559 3.050 739 HD11 LEU 94 HD11 LEU 94 -9.806 5.460 5.022 740 HD12 LEU 94 HD12 LEU 94 -9.511 3.856 4.352 741 HD13 LEU 94 HD13 LEU 94 -10.438 5.039 3.430 742 HD21 LEU 94 HD21 LEU 94 -9.286 7.167 2.719 743 HD22 LEU 94 HD22 LEU 94 -9.138 5.859 1.545 744 HD23 LEU 94 HD23 LEU 94 -7.722 6.815 1.983 745 H VAL 95 H VAL 95 -5.881 2.863 4.882 746 HA VAL 95 HA VAL 95 -3.201 3.939 4.324 747 HB VAL 95 HB VAL 95 -3.686 1.289 5.683 748 HG11 VAL 95 HG11 VAL 95 -1.077 2.673 5.786 749 HG12 VAL 95 HG12 VAL 95 -1.553 2.000 4.226 750 HG13 VAL 95 HG13 VAL 95 -1.448 0.955 5.643 751 HG21 VAL 95 HG21 VAL 95 -3.390 4.010 6.782 752 HG22 VAL 95 HG22 VAL 95 -2.414 2.756 7.548 753 HG23 VAL 95 HG23 VAL 95 -4.168 2.584 7.470 754 H ILE 96 H ILE 96 -2.820 3.641 2.232 755 HA ILE 96 HA ILE 96 -4.156 1.582 0.722 756 HB ILE 96 HB ILE 96 -1.923 3.324 -0.297 757 HG12 ILE 96 HG13 ILE 96 -3.517 4.817 0.768 758 HG13 ILE 96 HG12 ILE 96 -3.672 4.947 -0.981 759 HG21 ILE 96 HG21 ILE 96 -4.336 2.231 -1.726 760 HG22 ILE 96 HG22 ILE 96 -2.782 1.400 -1.656 761 HG23 ILE 96 HG23 ILE 96 -2.904 2.978 -2.435 762 HD11 ILE 96 HD11 ILE 96 -5.631 3.467 -0.891 763 HD12 ILE 96 HD12 ILE 96 -5.847 4.942 0.052 764 HD13 ILE 96 HD13 ILE 96 -5.489 3.419 0.867 765 H ALA 97 H ALA 97 -3.371 -0.351 0.126 766 HA ALA 97 HA ALA 97 -0.560 -0.942 0.788 767 HB1 ALA 97 HB1 ALA 97 -2.968 -2.750 0.895 768 HB2 ALA 97 HB2 ALA 97 -2.014 -2.156 2.254 769 HB3 ALA 97 HB3 ALA 97 -1.303 -3.292 1.108 770 H GLY 98 H GLY 98 -2.842 -0.754 -1.731 771 HA2 GLY 98 HA3 GLY 98 -1.239 -1.055 -3.856 772 HA3 GLY 98 HA2 GLY 98 -1.539 -2.729 -3.415 773 H GLY 99 H GLY 99 -4.028 -2.000 -5.964 774 HA2 GLY 99 HA3 GLY 99 -1.251 -2.593 -5.507 775 HA3 GLY 99 HA2 GLY 99 -2.100 -2.656 -7.041 776 H ALA 100 H ALA 100 -0.228 -1.699 -7.998 777 HA ALA 100 HA ALA 100 0.810 0.808 -7.245 778 HB1 ALA 100 HB1 ALA 100 2.249 0.515 -8.946 779 HB2 ALA 100 HB2 ALA 100 0.970 0.133 -10.099 780 HB3 ALA 100 HB3 ALA 100 1.565 -1.110 -8.999 781 H GLN 101 H GLN 101 -1.756 -0.106 -9.497 782 HA GLN 101 HA GLN 101 -2.136 2.434 -10.650 783 HB2 GLN 101 HB3 GLN 101 -3.311 -0.121 -10.865 784 HB3 GLN 101 HB2 GLN 101 -4.618 0.988 -10.474 785 HG2 GLN 101 HG3 GLN 101 -2.662 1.464 -12.703 786 HG3 GLN 101 HG2 GLN 101 -4.195 0.620 -12.915 787 HE21 GLN 101 HE21 GLN 101 -5.907 1.796 -13.406 788 HE22 GLN 101 HE22 GLN 101 -6.043 3.509 -13.232 789 H ILE 102 H ILE 102 -3.266 1.001 -7.673 790 HA ILE 102 HA ILE 102 -5.285 2.927 -7.117 791 HB ILE 102 HB ILE 102 -3.806 1.370 -5.010 792 HG12 ILE 102 HG13 ILE 102 -4.364 -0.249 -6.721 793 HG13 ILE 102 HG12 ILE 102 -5.480 -0.441 -5.373 794 HG21 ILE 102 HG21 ILE 102 -6.643 2.359 -5.246 795 HG22 ILE 102 HG22 ILE 102 -5.379 3.025 -4.211 796 HG23 ILE 102 HG23 ILE 102 -6.007 1.405 -3.906 797 HD11 ILE 102 HD11 ILE 102 -7.173 0.819 -6.615 798 HD12 ILE 102 HD12 ILE 102 -6.643 -0.622 -7.483 799 HD13 ILE 102 HD13 ILE 102 -6.052 0.967 -7.968 800 H PHE 103 H PHE 103 -1.880 2.601 -6.217 801 HA PHE 103 HA PHE 103 -1.729 4.755 -4.435 802 HB2 PHE 103 HB3 PHE 103 0.388 3.623 -6.278 803 HB3 PHE 103 HB2 PHE 103 0.707 4.754 -4.968 804 HD1 PHE 103 HD1 PHE 103 -1.081 3.663 -2.870 805 HD2 PHE 103 HD2 PHE 103 1.508 1.698 -5.617 806 HE1 PHE 103 HE1 PHE 103 -0.853 1.780 -1.303 807 HE2 PHE 103 HE2 PHE 103 1.739 -0.189 -4.056 808 HZ PHE 103 HZ PHE 103 0.558 -0.150 -1.895 809 H THR 104 H THR 104 -1.503 4.603 -7.944 810 HA THR 104 HA THR 104 -0.593 7.197 -8.442 811 HB THR 104 HB THR 104 -2.478 5.532 -10.121 812 HG1 THR 104 HG1 THR 104 -0.784 4.454 -10.737 813 HG21 THR 104 HG21 THR 104 -0.564 7.215 -11.506 814 HG22 THR 104 HG22 THR 104 -1.742 8.134 -10.569 815 HG23 THR 104 HG23 THR 104 -2.290 6.983 -11.788 816 H ALA 105 H ALA 105 -3.939 5.967 -8.266 817 HA ALA 105 HA ALA 105 -5.233 8.388 -8.775 818 HB1 ALA 105 HB1 ALA 105 -6.145 5.940 -8.504 819 HB2 ALA 105 HB2 ALA 105 -7.182 7.331 -8.187 820 HB3 ALA 105 HB3 ALA 105 -6.435 6.464 -6.845 821 H PHE 106 H PHE 106 -4.663 6.905 -5.550 822 HA PHE 106 HA PHE 106 -5.453 9.237 -4.174 823 HB2 PHE 106 HB3 PHE 106 -3.979 6.739 -3.377 824 HB3 PHE 106 HB2 PHE 106 -4.236 8.054 -2.234 825 HD1 PHE 106 HD2 PHE 106 -6.081 5.820 -4.568 826 HD2 PHE 106 HD1 PHE 106 -6.183 8.122 -0.990 827 HE1 PHE 106 HE2 PHE 106 -8.319 4.927 -4.063 828 HE2 PHE 106 HE1 PHE 106 -8.419 7.232 -0.477 829 HZ PHE 106 HZ PHE 106 -9.489 5.633 -2.015 830 H LYS 107 H LYS 107 -2.589 8.493 -5.858 831 HA LYS 107 HA LYS 107 -0.536 9.566 -4.417 832 HB2 LYS 107 HB3 LYS 107 0.630 9.675 -6.377 833 HB3 LYS 107 HB2 LYS 107 -0.724 8.702 -6.930 834 HG2 LYS 107 HG3 LYS 107 -1.802 10.785 -7.761 835 HG3 LYS 107 HG2 LYS 107 -0.335 11.662 -7.324 836 HD2 LYS 107 HD3 LYS 107 0.920 10.033 -8.799 837 HD3 LYS 107 HD2 LYS 107 -0.654 9.488 -9.382 838 HE2 LYS 107 HE3 LYS 107 0.278 12.352 -9.476 839 HE3 LYS 107 HE2 LYS 107 0.461 11.216 -10.812 840 HZ1 LYS 107 HZ1 LYS 107 -2.010 12.368 -9.693 841 HZ2 LYS 107 HZ2 LYS 107 -2.060 10.905 -10.539 842 HZ3 LYS 107 HZ3 LYS 107 -1.499 12.305 -11.305 843 H ASP 108 H ASP 108 -3.099 11.298 -6.070 844 HA ASP 108 HA ASP 108 -1.963 13.886 -5.394 845 HB2 ASP 108 HB3 ASP 108 -4.190 12.914 -7.099 846 HB3 ASP 108 HB2 ASP 108 -4.384 14.512 -6.387 847 H ASP 109 H ASP 109 -4.688 11.834 -4.488 848 HA ASP 109 HA ASP 109 -5.648 13.772 -2.550 849 HB2 ASP 109 HB3 ASP 109 -6.687 11.378 -3.838 850 HB3 ASP 109 HB2 ASP 109 -7.033 11.404 -2.112 851 H VAL 110 H VAL 110 -3.043 11.929 -2.420 852 HA VAL 110 HA VAL 110 -3.466 10.632 0.133 853 HB VAL 110 HB VAL 110 -2.059 9.545 -1.551 854 HG11 VAL 110 HG11 VAL 110 -0.343 10.516 -2.620 855 HG12 VAL 110 HG12 VAL 110 0.243 11.317 -1.163 856 HG13 VAL 110 HG13 VAL 110 -1.081 12.026 -2.086 857 HG21 VAL 110 HG21 VAL 110 -1.683 9.153 0.871 858 HG22 VAL 110 HG22 VAL 110 -0.422 10.386 0.838 859 HG23 VAL 110 HG23 VAL 110 -0.238 8.911 -0.111 860 H ASP 111 H ASP 111 -2.097 11.020 1.985 861 HA ASP 111 HA ASP 111 -1.170 13.810 2.177 862 HB2 ASP 111 HB3 ASP 111 -2.929 12.223 3.991 863 HB3 ASP 111 HB2 ASP 111 -1.823 13.388 4.714 864 H THR 112 H THR 112 -0.773 10.487 3.325 865 HA THR 112 HA THR 112 1.926 11.213 4.250 866 HB THR 112 HB THR 112 0.263 8.872 5.186 867 HG1 THR 112 HG1 THR 112 -0.734 10.583 6.054 868 HG21 THR 112 HG21 THR 112 2.666 8.538 5.476 869 HG22 THR 112 HG22 THR 112 1.835 8.725 7.020 870 HG23 THR 112 HG23 THR 112 2.768 10.065 6.352 871 H LEU 113 H LEU 113 3.603 9.595 3.965 872 HA LEU 113 HA LEU 113 3.081 7.602 1.888 873 HB2 LEU 113 HB3 LEU 113 4.256 10.041 1.338 874 HB3 LEU 113 HB2 LEU 113 5.630 8.974 1.539 875 HG LEU 113 HG LEU 113 4.884 7.553 -0.244 876 HD11 LEU 113 HD11 LEU 113 2.676 8.995 -1.311 877 HD12 LEU 113 HD12 LEU 113 2.326 8.605 0.372 878 HD13 LEU 113 HD13 LEU 113 2.741 7.320 -0.762 879 HD21 LEU 113 HD21 LEU 113 5.135 10.457 -0.633 880 HD22 LEU 113 HD22 LEU 113 4.491 9.553 -2.005 881 HD23 LEU 113 HD23 LEU 113 6.066 9.131 -1.331 882 H LEU 114 H LEU 114 3.694 5.734 2.743 883 HA LEU 114 HA LEU 114 6.193 5.640 4.304 884 HB2 LEU 114 HB3 LEU 114 3.746 3.905 4.666 885 HB3 LEU 114 HB2 LEU 114 5.237 3.779 5.580 886 HG LEU 114 HG LEU 114 3.598 6.299 5.595 887 HD11 LEU 114 HD11 LEU 114 3.342 4.493 7.893 888 HD12 LEU 114 HD12 LEU 114 2.547 3.939 6.419 889 HD13 LEU 114 HD13 LEU 114 2.137 5.511 7.105 890 HD21 LEU 114 HD21 LEU 114 5.933 5.218 7.053 891 HD22 LEU 114 HD22 LEU 114 4.765 6.147 7.992 892 HD23 LEU 114 HD23 LEU 114 5.549 6.876 6.590 893 H VAL 115 H VAL 115 7.700 4.742 3.044 894 HA VAL 115 HA VAL 115 6.935 2.362 1.483 895 HB VAL 115 HB VAL 115 8.534 3.013 -0.246 896 HG11 VAL 115 HG11 VAL 115 6.661 5.308 0.275 897 HG12 VAL 115 HG12 VAL 115 6.116 3.725 -0.283 898 HG13 VAL 115 HG13 VAL 115 7.211 4.684 -1.280 899 HG21 VAL 115 HG21 VAL 115 10.144 4.286 0.936 900 HG22 VAL 115 HG22 VAL 115 8.928 5.436 1.493 901 HG23 VAL 115 HG23 VAL 115 9.382 5.389 -0.211 902 H THR 116 H THR 116 8.375 0.700 1.323 903 HA THR 116 HA THR 116 10.685 0.806 3.148 904 HB THR 116 HB THR 116 8.920 -1.501 2.306 905 HG1 THR 116 HG1 THR 116 8.594 -1.620 4.573 906 HG21 THR 116 HG21 THR 116 11.662 -1.633 3.058 907 HG22 THR 116 HG22 THR 116 10.539 -2.945 2.700 908 HG23 THR 116 HG23 THR 116 10.672 -2.322 4.345 909 H ARG 117 H ARG 117 12.322 1.407 1.801 910 HA ARG 117 HA ARG 117 12.564 0.253 -0.838 911 HB2 ARG 117 HB3 ARG 117 13.163 2.666 -0.091 912 HB3 ARG 117 HB2 ARG 117 14.664 1.947 0.476 913 HG2 ARG 117 HG3 ARG 117 15.046 1.074 -1.818 914 HG3 ARG 117 HG2 ARG 117 13.615 1.963 -2.345 915 HD2 ARG 117 HD3 ARG 117 15.992 3.240 -1.003 916 HD3 ARG 117 HD2 ARG 117 15.790 3.134 -2.751 917 HE ARG 117 HE ARG 117 14.440 4.925 -0.953 918 HH11 ARG 117 HH11 ARG 117 14.288 3.331 -4.053 919 HH12 ARG 117 HH12 ARG 117 13.218 4.504 -4.744 920 HH21 ARG 117 HH21 ARG 117 13.033 6.469 -1.860 921 HH22 ARG 117 HH22 ARG 117 12.506 6.286 -3.500 922 H LEU 118 H LEU 118 13.225 -1.792 -0.941 923 HA LEU 118 HA LEU 118 14.986 -2.997 0.944 924 HB2 LEU 118 HB3 LEU 118 13.578 -3.799 -1.524 925 HB3 LEU 118 HB2 LEU 118 15.060 -4.675 -1.192 926 HG LEU 118 HG LEU 118 14.093 -5.137 1.123 927 HD11 LEU 118 HD11 LEU 118 11.888 -3.662 -0.125 928 HD12 LEU 118 HD12 LEU 118 12.263 -3.922 1.579 929 HD13 LEU 118 HD13 LEU 118 11.418 -5.169 0.662 930 HD21 LEU 118 HD21 LEU 118 12.309 -6.450 -0.816 931 HD22 LEU 118 HD22 LEU 118 13.414 -7.148 0.367 932 HD23 LEU 118 HD23 LEU 118 14.034 -6.549 -1.172 933 H ALA 119 H ALA 119 17.099 -3.881 0.478 934 HA ALA 119 HA ALA 119 18.768 -2.000 -0.909 935 HB1 ALA 119 HB1 ALA 119 19.139 -4.204 0.964 936 HB2 ALA 119 HB2 ALA 119 20.066 -2.717 0.765 937 HB3 ALA 119 HB3 ALA 119 20.400 -4.110 -0.265 938 H GLY 120 H GLY 120 18.004 -5.450 -1.314 939 HA2 GLY 120 HA3 GLY 120 19.551 -5.874 -3.614 940 HA3 GLY 120 HA2 GLY 120 18.162 -6.835 -3.132 941 H SER 121 H SER 121 19.014 -6.030 -5.792 942 HA SER 121 HA SER 121 16.818 -4.256 -6.603 943 HB2 SER 121 HB3 SER 121 19.244 -5.168 -8.171 944 HB3 SER 121 HB2 SER 121 18.024 -4.026 -8.736 945 HG SER 121 HG SER 121 19.820 -3.698 -6.565 946 H PHE 122 H PHE 122 15.015 -5.277 -7.163 947 HA PHE 122 HA PHE 122 15.221 -7.916 -8.446 948 HB2 PHE 122 HB3 PHE 122 12.992 -6.628 -6.868 949 HB3 PHE 122 HB2 PHE 122 12.781 -8.115 -7.787 950 HD1 PHE 122 HD2 PHE 122 15.068 -6.661 -5.222 951 HD2 PHE 122 HD1 PHE 122 13.042 -10.107 -6.681 952 HE1 PHE 122 HE2 PHE 122 15.896 -7.957 -3.301 953 HE2 PHE 122 HE1 PHE 122 13.865 -11.409 -4.763 954 HZ PHE 122 HZ PHE 122 15.295 -10.334 -3.070 955 H GLU 123 H GLU 123 13.655 -8.413 -10.144 956 HA GLU 123 HA GLU 123 12.732 -6.039 -11.613 957 HB2 GLU 123 HB3 GLU 123 13.480 -7.012 -13.713 958 HB3 GLU 123 HB2 GLU 123 14.838 -6.838 -12.610 959 HG2 GLU 123 HG3 GLU 123 13.856 -9.393 -12.125 960 HG3 GLU 123 HG2 GLU 123 13.781 -9.201 -13.876 961 H GLY 124 H GLY 124 10.737 -6.189 -12.491 962 HA2 GLY 124 HA3 GLY 124 9.499 -8.781 -12.920 963 HA3 GLY 124 HA2 GLY 124 8.782 -7.813 -11.641 964 H ASP 125 H ASP 125 6.937 -6.987 -12.366 965 HA ASP 125 HA ASP 125 6.984 -5.404 -14.814 966 HB2 ASP 125 HB3 ASP 125 4.918 -7.562 -14.333 967 HB3 ASP 125 HB2 ASP 125 4.945 -6.437 -15.688 968 H THR 126 H THR 126 6.806 -4.857 -11.933 969 HA THR 126 HA THR 126 4.451 -3.151 -12.039 970 HB THR 126 HB THR 126 4.903 -4.834 -9.586 971 HG1 THR 126 HG1 THR 126 4.453 -6.285 -11.231 972 HG21 THR 126 HG21 THR 126 2.225 -3.924 -10.405 973 HG22 THR 126 HG22 THR 126 3.345 -2.683 -9.844 974 HG23 THR 126 HG23 THR 126 2.948 -4.050 -8.802 975 H LYS 127 H LYS 127 5.463 -1.244 -11.862 976 HA LYS 127 HA LYS 127 7.341 -0.893 -9.618 977 HB2 LYS 127 HB3 LYS 127 8.422 0.887 -10.964 978 HB3 LYS 127 HB2 LYS 127 8.543 -0.703 -11.704 979 HG2 LYS 127 HG3 LYS 127 6.224 0.340 -12.782 980 HG3 LYS 127 HG2 LYS 127 7.314 1.725 -12.701 981 HD2 LYS 127 HD3 LYS 127 7.676 0.711 -14.813 982 HD3 LYS 127 HD2 LYS 127 9.054 0.265 -13.805 983 HE2 LYS 127 HE3 LYS 127 8.490 -1.924 -13.770 984 HE3 LYS 127 HE2 LYS 127 6.759 -1.585 -13.744 985 HZ1 LYS 127 HZ1 LYS 127 8.003 -2.587 -15.852 986 HZ2 LYS 127 HZ2 LYS 127 8.170 -0.942 -16.207 987 HZ3 LYS 127 HZ3 LYS 127 6.631 -1.605 -15.982 988 H MET 128 H MET 128 7.477 1.396 -8.843 989 HA MET 128 HA MET 128 4.879 2.314 -8.140 990 HB2 MET 128 HB3 MET 128 6.935 2.488 -6.705 991 HB3 MET 128 HB2 MET 128 7.504 3.764 -7.771 992 HG2 MET 128 HG3 MET 128 6.466 4.624 -5.724 993 HG3 MET 128 HG2 MET 128 5.636 5.158 -7.183 994 HE1 MET 128 HE1 MET 128 2.582 5.283 -6.160 995 HE2 MET 128 HE2 MET 128 4.102 6.012 -5.643 996 HE3 MET 128 HE3 MET 128 3.103 5.139 -4.481 997 H ILE 129 H ILE 129 4.193 4.612 -8.397 998 HA ILE 129 HA ILE 129 4.669 5.470 -11.167 999 HB ILE 129 HB ILE 129 2.539 6.643 -11.040 1000 HG12 ILE 129 HG13 ILE 129 1.170 5.849 -8.859 1001 HG13 ILE 129 HG12 ILE 129 2.785 5.947 -8.166 1002 HG21 ILE 129 HG21 ILE 129 1.480 4.177 -10.019 1003 HG22 ILE 129 HG22 ILE 129 2.899 3.864 -11.019 1004 HG23 ILE 129 HG23 ILE 129 1.537 4.769 -11.680 1005 HD11 ILE 129 HD11 ILE 129 1.356 8.004 -7.964 1006 HD12 ILE 129 HD12 ILE 129 1.541 8.199 -9.707 1007 HD13 ILE 129 HD13 ILE 129 2.959 8.242 -8.659 1008 HA PRO 130 HA PRO 130 6.667 9.203 -9.933 1009 HB2 PRO 130 HB3 PRO 130 5.665 10.984 -11.749 1010 HB3 PRO 130 HB2 PRO 130 6.905 9.786 -12.134 1011 HG2 PRO 130 HG3 PRO 130 3.955 9.685 -12.630 1012 HG3 PRO 130 HG2 PRO 130 5.287 9.204 -13.697 1013 HD2 PRO 130 HD3 PRO 130 3.858 7.398 -12.303 1014 HD3 PRO 130 HD2 PRO 130 5.593 7.183 -12.613 1015 H LEU 131 H LEU 131 6.273 10.494 -8.255 1016 HA LEU 131 HA LEU 131 3.581 11.664 -7.971 1017 HB2 LEU 131 HB3 LEU 131 5.173 11.221 -5.520 1018 HB3 LEU 131 HB2 LEU 131 3.445 11.083 -5.776 1019 HG LEU 131 HG LEU 131 5.066 8.985 -7.074 1020 HD11 LEU 131 HD11 LEU 131 4.954 7.862 -4.654 1021 HD12 LEU 131 HD12 LEU 131 5.232 9.537 -4.177 1022 HD13 LEU 131 HD13 LEU 131 6.373 8.724 -5.248 1023 HD21 LEU 131 HD21 LEU 131 2.763 8.622 -5.200 1024 HD22 LEU 131 HD22 LEU 131 3.239 7.646 -6.590 1025 HD23 LEU 131 HD23 LEU 131 2.501 9.229 -6.835 1026 H ASN 132 H ASN 132 3.566 13.597 -6.489 1027 HA ASN 132 HA ASN 132 5.702 15.401 -7.278 1028 HB2 ASN 132 HB3 ASN 132 2.962 15.707 -6.826 1029 HB3 ASN 132 HB2 ASN 132 3.720 16.530 -5.467 1030 HD21 ASN 132 HD21 ASN 132 3.940 18.604 -5.819 1031 HD22 ASN 132 HD22 ASN 132 4.323 19.353 -7.328 1032 H TRP 133 H TRP 133 7.380 14.444 -6.044 1033 HA TRP 133 HA TRP 133 7.277 14.023 -3.280 1034 HB2 TRP 133 HB3 TRP 133 9.663 14.529 -5.059 1035 HB3 TRP 133 HB2 TRP 133 9.742 13.903 -3.413 1036 HD1 TRP 133 HD1 TRP 133 8.449 12.903 -6.907 1037 HE1 TRP 133 HE1 TRP 133 8.298 10.336 -7.010 1038 HE3 TRP 133 HE3 TRP 133 9.622 11.825 -2.049 1039 HZ2 TRP 133 HZ2 TRP 133 8.640 8.144 -5.266 1040 HZ3 TRP 133 HZ3 TRP 133 9.688 9.467 -1.348 1041 HH2 TRP 133 HH2 TRP 133 9.206 7.666 -2.925 1042 H ASP 134 H ASP 134 8.071 16.970 -5.104 1043 HA ASP 134 HA ASP 134 9.355 18.379 -3.087 1044 HB2 ASP 134 HB3 ASP 134 8.659 18.926 -5.644 1045 HB3 ASP 134 HB2 ASP 134 7.483 19.916 -4.785 1046 H ASP 135 H ASP 135 5.891 18.063 -3.763 1047 HA ASP 135 HA ASP 135 5.086 19.841 -1.688 1048 HB2 ASP 135 HB3 ASP 135 3.826 18.820 -3.843 1049 HB3 ASP 135 HB2 ASP 135 3.183 17.759 -2.593 1050 H PHE 136 H PHE 136 6.506 16.888 -1.434 1051 HA PHE 136 HA PHE 136 5.151 16.349 1.124 1052 HB2 PHE 136 HB3 PHE 136 6.234 14.378 -0.895 1053 HB3 PHE 136 HB2 PHE 136 5.811 13.933 0.756 1054 HD1 PHE 136 HD1 PHE 136 3.374 14.804 1.465 1055 HD2 PHE 136 HD2 PHE 136 4.662 13.983 -2.507 1056 HE1 PHE 136 HE1 PHE 136 1.035 14.475 0.778 1057 HE2 PHE 136 HE2 PHE 136 2.325 13.652 -3.201 1058 HZ PHE 136 HZ PHE 136 0.507 13.898 -1.557 1059 H THR 137 H THR 137 6.397 16.212 2.872 1060 HA THR 137 HA THR 137 9.317 16.325 2.484 1061 HB THR 137 HB THR 137 7.594 17.489 4.678 1062 HG1 THR 137 HG1 THR 137 9.287 18.739 2.779 1063 HG21 THR 137 HG21 THR 137 10.578 17.332 4.454 1064 HG22 THR 137 HG22 THR 137 9.546 16.902 5.819 1065 HG23 THR 137 HG23 THR 137 9.765 18.596 5.378 1066 H LYS 138 H LYS 138 10.655 15.056 3.701 1067 HA LYS 138 HA LYS 138 9.641 12.578 4.594 1068 HB2 LYS 138 HB3 LYS 138 11.981 13.134 3.687 1069 HB3 LYS 138 HB2 LYS 138 12.351 13.664 5.322 1070 HG2 LYS 138 HG3 LYS 138 12.685 11.581 5.998 1071 HG3 LYS 138 HG2 LYS 138 11.126 11.060 5.356 1072 HD2 LYS 138 HD3 LYS 138 12.387 9.815 3.967 1073 HD3 LYS 138 HD2 LYS 138 12.556 11.325 3.070 1074 HE2 LYS 138 HE3 LYS 138 14.512 11.442 5.053 1075 HE3 LYS 138 HE2 LYS 138 14.554 9.777 4.472 1076 HZ1 LYS 138 HZ1 LYS 138 15.910 11.681 3.301 1077 HZ2 LYS 138 HZ2 LYS 138 14.451 11.914 2.478 1078 HZ3 LYS 138 HZ3 LYS 138 15.227 10.413 2.413 1079 H VAL 139 H VAL 139 8.736 12.071 6.458 1080 HA VAL 139 HA VAL 139 8.960 13.913 8.712 1081 HB VAL 139 HB VAL 139 7.258 11.455 8.792 1082 HG11 VAL 139 HG11 VAL 139 7.421 14.065 10.154 1083 HG12 VAL 139 HG12 VAL 139 6.954 12.483 10.777 1084 HG13 VAL 139 HG13 VAL 139 5.798 13.444 9.854 1085 HG21 VAL 139 HG21 VAL 139 5.421 12.673 7.711 1086 HG22 VAL 139 HG22 VAL 139 6.774 12.405 6.613 1087 HG23 VAL 139 HG23 VAL 139 6.529 13.994 7.337 1088 H SER 140 H SER 140 9.764 10.631 7.762 1089 HA SER 140 HA SER 140 11.583 10.446 10.015 1090 HB2 SER 140 HB3 SER 140 9.019 9.316 10.241 1091 HB3 SER 140 HB2 SER 140 10.108 7.964 9.930 1092 HG SER 140 HG SER 140 9.822 9.467 12.167 1093 H SER 141 H SER 141 13.059 8.656 9.863 1094 HA SER 141 HA SER 141 13.089 7.085 7.436 1095 HB2 SER 141 HB3 SER 141 15.424 8.925 7.982 1096 HB3 SER 141 HB2 SER 141 15.164 7.904 6.568 1097 HG SER 141 HG SER 141 13.655 10.182 7.333 1098 H ARG 142 H ARG 142 13.784 5.120 7.956 1099 HA ARG 142 HA ARG 142 15.892 4.814 9.960 1100 HB2 ARG 142 HB3 ARG 142 13.670 4.611 11.102 1101 HB3 ARG 142 HB2 ARG 142 13.323 3.227 10.074 1102 HG2 ARG 142 HG3 ARG 142 15.160 1.998 11.029 1103 HG3 ARG 142 HG2 ARG 142 15.652 3.405 11.974 1104 HD2 ARG 142 HD3 ARG 142 13.006 1.980 12.237 1105 HD3 ARG 142 HD2 ARG 142 14.393 1.737 13.296 1106 HE ARG 142 HE ARG 142 13.983 3.786 14.287 1107 HH11 ARG 142 HH11 ARG 142 11.869 3.341 11.540 1108 HH12 ARG 142 HH12 ARG 142 10.843 4.669 11.962 1109 HH21 ARG 142 HH21 ARG 142 12.632 5.531 14.836 1110 HH22 ARG 142 HH22 ARG 142 11.275 5.913 13.829 1111 H THR 143 H THR 143 17.416 3.534 9.171 1112 HA THR 143 HA THR 143 16.753 1.729 6.965 1113 HB THR 143 HB THR 143 19.570 2.084 7.817 1114 HG1 THR 143 HG1 THR 143 17.966 4.177 6.818 1115 HG21 THR 143 HG21 THR 143 20.086 1.831 5.620 1116 HG22 THR 143 HG22 THR 143 18.591 2.584 5.065 1117 HG23 THR 143 HG23 THR 143 18.572 0.929 5.677 1118 H VAL 144 H VAL 144 16.421 -0.339 7.384 1119 HA VAL 144 HA VAL 144 17.691 -1.524 9.764 1120 HB VAL 144 HB VAL 144 15.253 -2.586 8.339 1121 HG11 VAL 144 HG11 VAL 144 16.460 -3.162 11.042 1122 HG12 VAL 144 HG12 VAL 144 16.430 -4.240 9.647 1123 HG13 VAL 144 HG13 VAL 144 14.926 -3.809 10.460 1124 HG21 VAL 144 HG21 VAL 144 15.516 -0.392 10.269 1125 HG22 VAL 144 HG22 VAL 144 14.319 -1.613 10.702 1126 HG23 VAL 144 HG23 VAL 144 14.204 -0.774 9.154 1127 H GLU 145 H GLU 145 18.984 -3.266 9.542 1128 HA GLU 145 HA GLU 145 19.175 -4.486 6.868 1129 HB2 GLU 145 HB3 GLU 145 21.639 -4.888 7.564 1130 HB3 GLU 145 HB2 GLU 145 21.166 -3.294 6.992 1131 HG2 GLU 145 HG3 GLU 145 21.341 -2.342 9.068 1132 HG3 GLU 145 HG2 GLU 145 21.091 -3.872 9.909 1133 H ASP 146 H ASP 146 19.527 -6.679 6.748 1134 HA ASP 146 HA ASP 146 19.221 -8.155 9.280 1135 HB2 ASP 146 HB3 ASP 146 18.112 -8.745 6.533 1136 HB3 ASP 146 HB2 ASP 146 18.108 -9.921 7.843 1137 H THR 147 H THR 147 19.710 -10.689 8.501 1138 HA THR 147 HA THR 147 22.510 -10.819 8.391 1139 HB THR 147 HB THR 147 21.864 -13.305 7.626 1140 HG1 THR 147 HG1 THR 147 19.524 -12.558 8.998 1141 HG21 THR 147 HG21 THR 147 22.883 -12.904 9.743 1142 HG22 THR 147 HG22 THR 147 21.438 -13.882 10.001 1143 HG23 THR 147 HG23 THR 147 21.413 -12.157 10.367 1144 H ASN 148 H ASN 148 20.049 -11.193 5.886 1145 HA ASN 148 HA ASN 148 22.017 -11.735 3.842 1146 HB2 ASN 148 HB3 ASN 148 19.083 -11.768 4.052 1147 HB3 ASN 148 HB2 ASN 148 19.691 -11.229 2.489 1148 HD21 ASN 148 HD21 ASN 148 18.226 -13.565 2.842 1149 HD22 ASN 148 HD22 ASN 148 19.244 -14.915 2.489 1150 HA PRO 149 HA PRO 149 22.875 -7.500 2.820 1151 HB2 PRO 149 HB3 PRO 149 23.268 -8.459 0.051 1152 HB3 PRO 149 HB2 PRO 149 24.405 -7.649 1.132 1153 HG2 PRO 149 HG3 PRO 149 24.646 -10.251 0.557 1154 HG3 PRO 149 HG2 PRO 149 25.028 -9.617 2.167 1155 HD2 PRO 149 HD3 PRO 149 22.596 -11.089 1.240 1156 HD3 PRO 149 HD2 PRO 149 23.492 -11.235 2.767 1157 H ALA 150 H ALA 150 20.710 -9.447 0.869 1158 HA ALA 150 HA ALA 150 19.524 -7.150 -0.432 1159 HB1 ALA 150 HB1 ALA 150 18.691 -10.047 -0.483 1160 HB2 ALA 150 HB2 ALA 150 19.759 -9.259 -1.643 1161 HB3 ALA 150 HB3 ALA 150 18.069 -8.769 -1.526 1162 H LEU 151 H LEU 151 19.078 -8.800 2.515 1163 HA LEU 151 HA LEU 151 16.257 -8.213 2.734 1164 HB2 LEU 151 HB3 LEU 151 18.280 -9.432 4.588 1165 HB3 LEU 151 HB2 LEU 151 16.676 -9.001 5.147 1166 HG LEU 151 HG LEU 151 17.447 -11.103 3.141 1167 HD11 LEU 151 HD11 LEU 151 17.334 -12.270 5.050 1168 HD12 LEU 151 HD12 LEU 151 15.589 -12.154 4.818 1169 HD13 LEU 151 HD13 LEU 151 16.415 -11.016 5.882 1170 HD21 LEU 151 HD21 LEU 151 14.740 -9.860 3.582 1171 HD22 LEU 151 HD22 LEU 151 14.979 -11.434 2.824 1172 HD23 LEU 151 HD23 LEU 151 15.642 -9.983 2.071 1173 H THR 152 H THR 152 18.748 -6.201 2.741 1174 HA THR 152 HA THR 152 18.228 -4.724 5.162 1175 HB THR 152 HB THR 152 19.714 -3.633 2.786 1176 HG1 THR 152 HG1 THR 152 20.710 -5.485 4.687 1177 HG21 THR 152 HG21 THR 152 21.190 -3.117 5.015 1178 HG22 THR 152 HG22 THR 152 19.541 -3.002 5.628 1179 HG23 THR 152 HG23 THR 152 20.047 -2.003 4.266 1180 H HIS 153 H HIS 153 16.578 -3.367 5.422 1181 HA HIS 153 HA HIS 153 15.405 -2.125 3.018 1182 HB2 HIS 153 HB3 HIS 153 13.762 -2.570 5.475 1183 HB3 HIS 153 HB2 HIS 153 13.255 -2.472 3.794 1184 HD1 HIS 153 HD1 HIS 153 12.676 -4.796 5.995 1185 HD2 HIS 153 HD2 HIS 153 15.239 -4.952 2.729 1186 HE1 HIS 153 HE1 HIS 153 12.931 -7.239 5.458 1187 HE2 HIS 153 HE2 HIS 153 14.414 -7.303 3.423 1188 H THR 154 H THR 154 14.149 -0.125 3.500 1189 HA THR 154 HA THR 154 15.178 1.392 5.782 1190 HB THR 154 HB THR 154 15.207 2.451 2.949 1191 HG1 THR 154 HG1 THR 154 17.417 2.219 3.054 1192 HG21 THR 154 HG21 THR 154 16.595 3.662 5.304 1193 HG22 THR 154 HG22 THR 154 14.931 4.081 4.898 1194 HG23 THR 154 HG23 THR 154 16.225 4.382 3.737 1195 H TYR 155 H TYR 155 13.484 2.174 6.835 1196 HA TYR 155 HA TYR 155 10.947 2.529 5.445 1197 HB2 TYR 155 HB3 TYR 155 11.787 2.283 8.299 1198 HB3 TYR 155 HB2 TYR 155 10.284 3.128 7.943 1199 HD1 TYR 155 HD1 TYR 155 8.530 1.883 6.548 1200 HD2 TYR 155 HD2 TYR 155 11.841 -0.052 8.391 1201 HE1 TYR 155 HE1 TYR 155 7.355 -0.271 6.386 1202 HE2 TYR 155 HE2 TYR 155 10.675 -2.211 8.232 1203 HH TYR 155 HH TYR 155 8.776 -3.164 6.626 1204 H GLU 156 H GLU 156 10.207 4.446 4.802 1205 HA GLU 156 HA GLU 156 11.329 6.867 6.052 1206 HB2 GLU 156 HB3 GLU 156 10.735 6.483 3.112 1207 HB3 GLU 156 HB2 GLU 156 11.316 7.965 3.859 1208 HG2 GLU 156 HG3 GLU 156 13.307 6.532 4.640 1209 HG3 GLU 156 HG2 GLU 156 12.766 5.390 3.410 1210 H VAL 157 H VAL 157 9.928 8.495 6.499 1211 HA VAL 157 HA VAL 157 7.098 8.010 5.850 1212 HB VAL 157 HB VAL 157 8.072 9.729 8.125 1213 HG11 VAL 157 HG11 VAL 157 5.889 10.289 7.956 1214 HG12 VAL 157 HG12 VAL 157 5.659 8.789 8.854 1215 HG13 VAL 157 HG13 VAL 157 5.462 8.807 7.101 1216 HG21 VAL 157 HG21 VAL 157 7.708 7.863 9.627 1217 HG22 VAL 157 HG22 VAL 157 8.917 7.430 8.418 1218 HG23 VAL 157 HG23 VAL 157 7.267 6.825 8.271 1219 H TRP 158 H TRP 158 5.827 9.724 5.214 1220 HA TRP 158 HA TRP 158 7.105 12.298 4.683 1221 HB2 TRP 158 HB3 TRP 158 5.756 10.703 2.501 1222 HB3 TRP 158 HB2 TRP 158 6.381 12.338 2.341 1223 HD1 TRP 158 HD1 TRP 158 7.728 8.783 3.117 1224 HE1 TRP 158 HE1 TRP 158 10.115 8.619 2.168 1225 HE3 TRP 158 HE3 TRP 158 8.269 13.584 1.447 1226 HZ2 TRP 158 HZ2 TRP 158 11.980 10.303 0.880 1227 HZ3 TRP 158 HZ3 TRP 158 10.385 14.227 0.368 1228 HH2 TRP 158 HH2 TRP 158 12.201 12.619 0.092 1229 H GLN 159 H GLN 159 5.770 13.992 4.880 1230 HA GLN 159 HA GLN 159 2.874 13.536 4.852 1231 HB2 GLN 159 HB3 GLN 159 4.525 14.501 7.134 1232 HB3 GLN 159 HB2 GLN 159 2.968 15.276 6.875 1233 HG2 GLN 159 HG3 GLN 159 1.826 13.176 7.088 1234 HG3 GLN 159 HG2 GLN 159 3.359 12.308 7.174 1235 HE21 GLN 159 HE21 GLN 159 3.964 11.754 9.130 1236 HE22 GLN 159 HE22 GLN 159 3.545 12.560 10.599 1237 H LYS 160 H LYS 160 1.809 15.072 3.732 1238 HA LYS 160 HA LYS 160 3.141 17.026 2.273 1239 HB2 LYS 160 HB3 LYS 160 0.776 16.005 1.967 1240 HB3 LYS 160 HB2 LYS 160 0.247 17.305 3.024 1241 HG2 LYS 160 HG3 LYS 160 0.426 18.847 1.417 1242 HG3 LYS 160 HG2 LYS 160 1.953 18.193 0.824 1243 HD2 LYS 160 HD3 LYS 160 0.754 17.554 -0.962 1244 HD3 LYS 160 HD2 LYS 160 0.187 16.249 0.081 1245 HE2 LYS 160 HE3 LYS 160 -1.891 17.019 -0.053 1246 HE3 LYS 160 HE2 LYS 160 -1.377 18.574 0.600 1247 HZ1 LYS 160 HZ1 LYS 160 -2.421 18.279 -1.821 1248 HZ2 LYS 160 HZ2 LYS 160 -0.783 18.108 -2.206 1249 HZ3 LYS 160 HZ3 LYS 160 -1.327 19.510 -1.432 1250 H LYS 161 H LYS 161 3.581 19.142 2.554 1251 HA LYS 161 HA LYS 161 3.627 20.158 5.232 1252 HB2 LYS 161 HB3 LYS 161 4.575 21.092 2.566 1253 HB3 LYS 161 HB2 LYS 161 4.367 22.297 3.830 1254 HG2 LYS 161 HG3 LYS 161 5.957 21.241 5.228 1255 HG3 LYS 161 HG2 LYS 161 5.997 19.802 4.207 1256 HD2 LYS 161 HD3 LYS 161 7.495 20.708 2.810 1257 HD3 LYS 161 HD2 LYS 161 6.634 22.247 2.754 1258 HE2 LYS 161 HE3 LYS 161 8.975 22.303 3.717 1259 HE3 LYS 161 HE2 LYS 161 7.706 23.034 4.700 1260 HZ1 LYS 161 HZ1 LYS 161 8.283 20.216 5.175 1261 HZ2 LYS 161 HZ2 LYS 161 7.879 21.438 6.273 1262 HZ3 LYS 161 HZ3 LYS 161 9.458 21.325 5.678 1263 H ALA 162 H ALA 162 2.481 21.862 6.108 1264 HA ALA 162 HA ALA 162 0.679 23.197 6.495 1265 HB1 ALA 162 HB1 ALA 162 0.216 24.793 4.921 1266 HB2 ALA 162 HB2 ALA 162 0.256 23.644 3.583 1267 HB3 ALA 162 HB3 ALA 162 1.762 24.200 4.314 1268 H51A NDP 170 H51A NDP 170 -4.774 -1.723 -11.695 1269 H52A NDP 170 H52A NDP 170 -5.210 -0.564 -10.426 1270 H4B NDP 170 H4B NDP 170 -7.154 -2.258 -12.053 1271 H3B NDP 170 H3B NDP 170 -6.509 0.698 -12.129 1272 HO3A NDP 170 HO3A NDP 170 -7.073 -1.351 -14.044 1273 H2B NDP 170 H2B NDP 170 -8.819 1.079 -12.640 1274 H1B NDP 170 H1B NDP 170 -9.822 -0.647 -10.730 1275 H8A NDP 170 H8A NDP 170 -6.643 1.390 -9.956 1276 H61A NDP 170 H61A NDP 170 -10.542 5.222 -7.024 1277 H62A NDP 170 H62A NDP 170 -8.874 4.936 -7.467 1278 H2A NDP 170 H2A NDP 170 -12.974 2.016 -9.009 1279 H51N NDP 170 H51N NDP 170 -1.271 -4.184 -7.420 1280 H52N NDP 170 H52N NDP 170 -0.459 -3.247 -8.686 1281 H4D NDP 170 H4D NDP 170 0.913 -5.275 -9.247 1282 H3D NDP 170 H3D NDP 170 -0.565 -6.520 -6.917 1283 HO3N NDP 170 HO3N NDP 170 -1.162 -7.675 -8.606 1284 H2D NDP 170 H2D NDP 170 1.471 -7.674 -6.394 1285 HO2N NDP 170 HO2N NDP 170 2.976 -8.108 -7.809 1286 H1D NDP 170 H1D NDP 170 3.123 -5.477 -6.733 1287 H2N NDP 170 H2N NDP 170 3.664 -5.337 -4.404 1288 H71N NDP 170 H71N NDP 170 5.498 -4.826 -1.800 1289 H72N NDP 170 H72N NDP 170 5.039 -5.424 -3.373 1290 H41N NDP 170 H41N NDP 170 0.675 -3.949 -2.164 1291 H42N NDP 170 H42N NDP 170 0.612 -5.722 -1.877 1292 H5N NDP 170 H5N NDP 170 -1.194 -4.987 -3.430 1293 H6N NDP 170 H6N NDP 170 -0.478 -5.405 -5.789 Start of MODEL 17 1 H1 THR 1 HT1 THR 1 -5.734 9.011 5.422 2 H2 THR 1 HT2 THR 1 -4.098 9.374 5.795 3 H3 THR 1 HT3 THR 1 -4.672 7.761 5.920 4 HA THR 1 HA THR 1 -4.871 7.522 3.655 5 HB THR 1 HB THR 1 -4.306 9.615 2.221 6 HG1 THR 1 HG1 THR 1 -4.739 11.559 3.217 7 HG21 THR 1 HG21 THR 1 -6.456 9.473 1.753 8 HG22 THR 1 HG22 THR 1 -6.812 10.448 3.179 9 HG23 THR 1 HG23 THR 1 -6.773 8.689 3.300 10 H ALA 2 H ALA 2 -3.038 6.276 4.156 11 HA ALA 2 HA ALA 2 -0.496 7.568 3.438 12 HB1 ALA 2 HB1 ALA 2 -0.750 7.186 5.930 13 HB2 ALA 2 HB2 ALA 2 0.689 6.502 5.174 14 HB3 ALA 2 HB3 ALA 2 -0.677 5.461 5.574 15 H PHE 3 H PHE 3 1.012 6.256 2.372 16 HA PHE 3 HA PHE 3 -0.154 3.846 1.160 17 HB2 PHE 3 HB3 PHE 3 2.104 5.633 0.236 18 HB3 PHE 3 HB2 PHE 3 1.606 4.163 -0.587 19 HD1 PHE 3 HD1 PHE 3 -1.392 5.315 0.512 20 HD2 PHE 3 HD2 PHE 3 1.686 6.407 -2.219 21 HE1 PHE 3 HE1 PHE 3 -3.020 6.608 -0.802 22 HE2 PHE 3 HE2 PHE 3 0.062 7.702 -3.536 23 HZ PHE 3 HZ PHE 3 -2.292 7.804 -2.829 24 H LEU 4 H LEU 4 0.537 1.951 1.916 25 HA LEU 4 HA LEU 4 3.295 1.783 2.938 26 HB2 LEU 4 HB3 LEU 4 1.721 1.595 4.767 27 HB3 LEU 4 HB2 LEU 4 0.829 0.350 3.914 28 HG LEU 4 HG LEU 4 2.661 -1.206 4.150 29 HD11 LEU 4 HD11 LEU 4 4.121 1.195 5.177 30 HD12 LEU 4 HD12 LEU 4 4.620 0.020 3.960 31 HD13 LEU 4 HD13 LEU 4 4.601 -0.430 5.666 32 HD21 LEU 4 HD21 LEU 4 2.268 0.129 6.816 33 HD22 LEU 4 HD22 LEU 4 2.553 -1.579 6.486 34 HD23 LEU 4 HD23 LEU 4 1.021 -0.836 6.028 35 H TRP 5 H TRP 5 4.526 0.640 1.594 36 HA TRP 5 HA TRP 5 3.715 -1.988 0.763 37 HB2 TRP 5 HB3 TRP 5 3.576 -1.703 -1.549 38 HB3 TRP 5 HB2 TRP 5 2.716 -0.300 -0.927 39 HD1 TRP 5 HD1 TRP 5 5.800 -1.287 -2.901 40 HE1 TRP 5 HE1 TRP 5 6.898 0.830 -3.867 41 HE3 TRP 5 HE3 TRP 5 3.070 2.251 -0.418 42 HZ2 TRP 5 HZ2 TRP 5 6.640 3.629 -3.613 43 HZ3 TRP 5 HZ3 TRP 5 3.556 4.626 -0.840 44 HH2 TRP 5 HH2 TRP 5 5.304 5.299 -2.404 45 H ALA 6 H ALA 6 5.442 -3.107 -0.477 46 HA ALA 6 HA ALA 6 8.075 -2.149 0.422 47 HB1 ALA 6 HB1 ALA 6 8.723 -4.586 -0.078 48 HB2 ALA 6 HB2 ALA 6 6.986 -4.887 -0.141 49 HB3 ALA 6 HB3 ALA 6 7.721 -4.266 1.338 50 H GLN 7 H GLN 7 9.827 -2.041 -0.997 51 HA GLN 7 HA GLN 7 9.377 -2.701 -3.800 52 HB2 GLN 7 HB3 GLN 7 10.268 -0.402 -4.446 53 HB3 GLN 7 HB2 GLN 7 8.610 -0.476 -3.866 54 HG2 GLN 7 HG3 GLN 7 10.362 -0.052 -1.653 55 HG3 GLN 7 HG2 GLN 7 10.720 1.122 -2.917 56 HE21 GLN 7 HE21 GLN 7 8.211 -0.159 -0.835 57 HE22 GLN 7 HE22 GLN 7 7.179 1.225 -0.906 58 H ASP 8 H ASP 8 11.355 -2.510 -5.118 59 HA ASP 8 HA ASP 8 13.669 -3.297 -3.524 60 HB2 ASP 8 HB3 ASP 8 14.597 -4.181 -5.585 61 HB3 ASP 8 HB2 ASP 8 12.943 -4.750 -5.395 62 H ARG 9 H ARG 9 15.784 -2.674 -5.080 63 HA ARG 9 HA ARG 9 16.315 -0.021 -4.394 64 HB2 ARG 9 HB3 ARG 9 17.723 -2.206 -5.612 65 HB3 ARG 9 HB2 ARG 9 18.093 -0.716 -6.468 66 HG2 ARG 9 HG3 ARG 9 18.445 0.230 -4.055 67 HG3 ARG 9 HG2 ARG 9 18.659 -1.473 -3.646 68 HD2 ARG 9 HD3 ARG 9 20.798 -0.419 -4.139 69 HD3 ARG 9 HD2 ARG 9 20.418 -1.658 -5.331 70 HE ARG 9 HE ARG 9 20.417 1.238 -5.761 71 HH11 ARG 9 HH11 ARG 9 20.006 -1.981 -7.064 72 HH12 ARG 9 HH12 ARG 9 20.138 -1.461 -8.709 73 HH21 ARG 9 HH21 ARG 9 20.584 1.913 -7.924 74 HH22 ARG 9 HH22 ARG 9 20.464 0.745 -9.198 75 H ASP 10 H ASP 10 14.833 -1.297 -7.262 76 HA ASP 10 HA ASP 10 15.292 1.171 -8.744 77 HB2 ASP 10 HB3 ASP 10 15.125 -1.376 -9.606 78 HB3 ASP 10 HB2 ASP 10 13.444 -0.891 -9.809 79 H GLY 11 H GLY 11 12.742 -0.545 -7.100 80 HA2 GLY 11 HA3 GLY 11 11.124 1.115 -6.036 81 HA3 GLY 11 HA2 GLY 11 10.884 1.674 -7.684 82 H LEU 12 H LEU 12 11.378 -1.611 -7.797 83 HA LEU 12 HA LEU 12 8.922 -2.329 -8.772 84 HB2 LEU 12 HB3 LEU 12 11.216 -3.635 -8.429 85 HB3 LEU 12 HB2 LEU 12 10.354 -4.301 -7.058 86 HG LEU 12 HG LEU 12 8.638 -5.221 -8.520 87 HD11 LEU 12 HD11 LEU 12 8.482 -3.588 -10.239 88 HD12 LEU 12 HD12 LEU 12 9.007 -5.086 -11.005 89 HD13 LEU 12 HD13 LEU 12 10.173 -3.801 -10.689 90 HD21 LEU 12 HD21 LEU 12 9.873 -7.014 -9.066 91 HD22 LEU 12 HD22 LEU 12 11.177 -6.140 -8.261 92 HD23 LEU 12 HD23 LEU 12 11.018 -6.068 -10.017 93 H ILE 13 H ILE 13 7.485 -4.078 -7.638 94 HA ILE 13 HA ILE 13 7.083 -3.677 -4.827 95 HB ILE 13 HB ILE 13 4.807 -2.909 -4.895 96 HG12 ILE 13 HG13 ILE 13 4.829 -2.218 -7.781 97 HG13 ILE 13 HG12 ILE 13 4.595 -3.916 -7.393 98 HG21 ILE 13 HG21 ILE 13 6.665 -1.258 -4.908 99 HG22 ILE 13 HG22 ILE 13 5.144 -0.636 -5.550 100 HG23 ILE 13 HG23 ILE 13 6.444 -1.092 -6.650 101 HD11 ILE 13 HD11 ILE 13 2.931 -1.654 -6.323 102 HD12 ILE 13 HD12 ILE 13 2.676 -3.374 -6.027 103 HD13 ILE 13 HD13 ILE 13 2.482 -2.720 -7.653 104 H GLY 14 H GLY 14 6.069 -5.073 -7.875 105 HA2 GLY 14 HA3 GLY 14 5.618 -7.613 -6.521 106 HA3 GLY 14 HA2 GLY 14 4.261 -6.938 -7.410 107 H LYS 15 H LYS 15 4.877 -9.261 -8.278 108 HA LYS 15 HA LYS 15 6.349 -8.799 -10.773 109 HB2 LYS 15 HB3 LYS 15 7.145 -11.181 -10.635 110 HB3 LYS 15 HB2 LYS 15 7.862 -10.099 -9.449 111 HG2 LYS 15 HG3 LYS 15 7.003 -11.225 -7.723 112 HG3 LYS 15 HG2 LYS 15 5.440 -11.437 -8.513 113 HD2 LYS 15 HD3 LYS 15 7.033 -13.069 -10.004 114 HD3 LYS 15 HD2 LYS 15 7.760 -13.230 -8.405 115 HE2 LYS 15 HE3 LYS 15 4.960 -13.342 -8.058 116 HE3 LYS 15 HE2 LYS 15 5.352 -14.393 -9.418 117 HZ1 LYS 15 HZ1 LYS 15 7.029 -14.602 -7.037 118 HZ2 LYS 15 HZ2 LYS 15 6.519 -15.806 -8.109 119 HZ3 LYS 15 HZ3 LYS 15 5.458 -15.222 -6.930 120 H ASP 16 H ASP 16 3.824 -8.375 -10.951 121 HA ASP 16 HA ASP 16 2.007 -8.950 -12.215 122 HB2 ASP 16 HB3 ASP 16 3.859 -10.678 -13.200 123 HB3 ASP 16 HB2 ASP 16 2.689 -11.810 -12.527 124 H GLY 17 H GLY 17 2.214 -9.179 -9.352 125 HA2 GLY 17 HA3 GLY 17 -0.264 -10.328 -8.753 126 HA3 GLY 17 HA2 GLY 17 0.977 -11.509 -8.359 127 H HIS 18 H HIS 18 2.940 -10.291 -7.178 128 HA HIS 18 HA HIS 18 2.340 -8.141 -5.457 129 HB2 HIS 18 HB3 HIS 18 2.075 -9.315 -3.335 130 HB3 HIS 18 HB2 HIS 18 0.797 -9.785 -4.451 131 HD1 HIS 18 HD1 HIS 18 0.928 -12.208 -5.443 132 HD2 HIS 18 HD2 HIS 18 3.743 -11.365 -2.506 133 HE1 HIS 18 HE1 HIS 18 1.858 -14.438 -4.744 134 HE2 HIS 18 HE2 HIS 18 3.499 -13.909 -2.907 135 H LEU 19 H LEU 19 3.904 -8.542 -3.315 136 HA LEU 19 HA LEU 19 6.512 -8.401 -4.389 137 HB2 LEU 19 HB3 LEU 19 7.239 -8.350 -2.008 138 HB3 LEU 19 HB2 LEU 19 6.025 -7.156 -2.422 139 HG LEU 19 HG LEU 19 4.425 -9.128 -1.513 140 HD11 LEU 19 HD11 LEU 19 6.416 -9.345 0.608 141 HD12 LEU 19 HD12 LEU 19 6.892 -10.143 -0.891 142 HD13 LEU 19 HD13 LEU 19 5.374 -10.577 -0.104 143 HD21 LEU 19 HD21 LEU 19 4.580 -7.901 0.719 144 HD22 LEU 19 HD22 LEU 19 4.180 -6.941 -0.705 145 HD23 LEU 19 HD23 LEU 19 5.818 -6.906 -0.050 146 HA PRO 20 HA PRO 20 7.170 -12.854 -4.293 147 HB2 PRO 20 HB3 PRO 20 9.344 -12.919 -5.849 148 HB3 PRO 20 HB2 PRO 20 7.742 -12.583 -6.518 149 HG2 PRO 20 HG3 PRO 20 9.957 -10.686 -5.857 150 HG3 PRO 20 HG2 PRO 20 8.870 -10.695 -7.256 151 HD2 PRO 20 HD3 PRO 20 8.552 -9.090 -5.031 152 HD3 PRO 20 HD2 PRO 20 7.246 -9.543 -6.142 153 H TRP 21 H TRP 21 9.310 -10.360 -3.187 154 HA TRP 21 HA TRP 21 11.365 -12.107 -2.227 155 HB2 TRP 21 HB3 TRP 21 12.068 -10.021 -0.929 156 HB3 TRP 21 HB2 TRP 21 12.073 -9.905 -2.686 157 HD1 TRP 21 HD1 TRP 21 9.462 -9.153 0.102 158 HE1 TRP 21 HE1 TRP 21 8.332 -6.912 -0.469 159 HE3 TRP 21 HE3 TRP 21 11.901 -8.106 -4.265 160 HZ2 TRP 21 HZ2 TRP 21 8.456 -4.961 -2.506 161 HZ3 TRP 21 HZ3 TRP 21 11.336 -6.034 -5.465 162 HH2 TRP 21 HH2 TRP 21 9.648 -4.495 -4.602 163 H HIS 22 H HIS 22 11.784 -12.770 -0.133 164 HA HIS 22 HA HIS 22 9.437 -13.084 1.531 165 HB2 HIS 22 HB3 HIS 22 11.417 -14.786 0.995 166 HB3 HIS 22 HB2 HIS 22 12.117 -14.032 2.424 167 HD1 HIS 22 HD1 HIS 22 9.372 -16.301 1.330 168 HD2 HIS 22 HD2 HIS 22 10.791 -14.595 4.842 169 HE1 HIS 22 HE1 HIS 22 8.212 -17.531 3.191 170 HE2 HIS 22 HE2 HIS 22 9.151 -16.539 5.308 171 H LEU 23 H LEU 23 9.019 -11.058 2.385 172 HA LEU 23 HA LEU 23 11.110 -9.832 4.031 173 HB2 LEU 23 HB3 LEU 23 9.119 -8.800 2.289 174 HB3 LEU 23 HB2 LEU 23 8.732 -8.254 3.909 175 HG LEU 23 HG LEU 23 11.101 -7.426 4.086 176 HD11 LEU 23 HD11 LEU 23 11.120 -7.737 1.097 177 HD12 LEU 23 HD12 LEU 23 11.923 -8.859 2.195 178 HD13 LEU 23 HD13 LEU 23 12.425 -7.169 2.137 179 HD21 LEU 23 HD21 LEU 23 10.478 -5.627 2.128 180 HD22 LEU 23 HD22 LEU 23 9.864 -5.585 3.780 181 HD23 LEU 23 HD23 LEU 23 8.904 -6.330 2.502 182 HA PRO 24 HA PRO 24 8.514 -11.958 7.208 183 HB2 PRO 24 HB3 PRO 24 10.558 -12.099 9.025 184 HB3 PRO 24 HB2 PRO 24 10.248 -13.329 7.795 185 HG2 PRO 24 HG3 PRO 24 12.226 -11.084 7.774 186 HG3 PRO 24 HG2 PRO 24 12.436 -12.767 7.253 187 HD2 PRO 24 HD3 PRO 24 12.034 -10.778 5.489 188 HD3 PRO 24 HD2 PRO 24 11.370 -12.405 5.230 189 H ASP 25 H ASP 25 10.940 -9.413 7.793 190 HA ASP 25 HA ASP 25 9.778 -8.396 10.131 191 HB2 ASP 25 HB3 ASP 25 11.129 -6.331 9.520 192 HB3 ASP 25 HB2 ASP 25 12.031 -7.827 9.696 193 H ASP 26 H ASP 26 9.002 -7.955 6.780 194 HA ASP 26 HA ASP 26 7.519 -5.523 7.145 195 HB2 ASP 26 HB3 ASP 26 8.628 -6.585 4.977 196 HB3 ASP 26 HB2 ASP 26 7.030 -7.305 4.803 197 H LEU 27 H LEU 27 6.672 -8.943 6.681 198 HA LEU 27 HA LEU 27 3.895 -8.655 6.689 199 HB2 LEU 27 HB3 LEU 27 5.365 -11.004 7.865 200 HB3 LEU 27 HB2 LEU 27 3.775 -10.993 7.127 201 HG LEU 27 HG LEU 27 5.984 -10.142 5.365 202 HD11 LEU 27 HD11 LEU 27 7.183 -12.035 5.295 203 HD12 LEU 27 HD12 LEU 27 5.774 -13.059 5.569 204 HD13 LEU 27 HD13 LEU 27 6.573 -12.276 6.932 205 HD21 LEU 27 HD21 LEU 27 3.945 -10.311 4.293 206 HD22 LEU 27 HD22 LEU 27 3.476 -11.756 5.188 207 HD23 LEU 27 HD23 LEU 27 4.697 -11.862 3.919 208 H HIS 28 H HIS 28 5.980 -9.646 9.411 209 HA HIS 28 HA HIS 28 4.075 -9.682 11.403 210 HB2 HIS 28 HB3 HIS 28 6.511 -10.385 11.553 211 HB3 HIS 28 HB2 HIS 28 6.893 -8.688 11.827 212 HD1 HIS 28 HD1 HIS 28 3.826 -10.170 13.362 213 HD2 HIS 28 HD2 HIS 28 7.716 -9.202 14.457 214 HE1 HIS 28 HE1 HIS 28 3.878 -10.333 15.870 215 HE2 HIS 28 HE2 HIS 28 6.265 -9.829 16.503 216 H TYR 29 H TYR 29 5.979 -6.918 10.258 217 HA TYR 29 HA TYR 29 4.868 -5.089 12.148 218 HB2 TYR 29 HB3 TYR 29 7.097 -4.892 10.880 219 HB3 TYR 29 HB2 TYR 29 6.132 -4.308 9.529 220 HD1 TYR 29 HD1 TYR 29 6.180 -3.661 13.217 221 HD2 TYR 29 HD2 TYR 29 6.246 -2.023 9.291 222 HE1 TYR 29 HE1 TYR 29 6.231 -1.395 14.170 223 HE2 TYR 29 HE2 TYR 29 6.298 0.248 10.233 224 HH TYR 29 HH TYR 29 7.169 1.213 12.663 225 H PHE 30 H PHE 30 4.068 -6.076 8.882 226 HA PHE 30 HA PHE 30 2.330 -4.015 8.169 227 HB2 PHE 30 HB3 PHE 30 2.985 -6.659 7.210 228 HB3 PHE 30 HB2 PHE 30 1.253 -6.376 7.082 229 HD1 PHE 30 HD2 PHE 30 4.307 -4.289 6.558 230 HD2 PHE 30 HD1 PHE 30 0.631 -5.739 4.979 231 HE1 PHE 30 HE2 PHE 30 4.677 -2.982 4.507 232 HE2 PHE 30 HE1 PHE 30 0.994 -4.436 2.924 233 HZ PHE 30 HZ PHE 30 3.019 -3.054 2.686 234 H ARG 31 H ARG 31 1.391 -7.232 9.398 235 HA ARG 31 HA ARG 31 -1.297 -6.626 9.831 236 HB2 ARG 31 HB3 ARG 31 0.556 -8.688 10.986 237 HB3 ARG 31 HB2 ARG 31 -1.105 -8.560 11.549 238 HG2 ARG 31 HG3 ARG 31 -1.973 -9.370 9.616 239 HG3 ARG 31 HG2 ARG 31 -0.674 -8.705 8.624 240 HD2 ARG 31 HD3 ARG 31 -0.250 -10.975 8.527 241 HD3 ARG 31 HD2 ARG 31 0.806 -10.453 9.839 242 HE ARG 31 HE ARG 31 -1.718 -11.254 10.844 243 HH11 ARG 31 HH11 ARG 31 1.257 -12.542 9.552 244 HH12 ARG 31 HH12 ARG 31 1.119 -14.047 10.397 245 HH21 ARG 31 HH21 ARG 31 -1.901 -13.233 11.957 246 HH22 ARG 31 HH22 ARG 31 -0.674 -14.440 11.762 247 H ALA 32 H ALA 32 1.501 -6.255 11.942 248 HA ALA 32 HA ALA 32 0.082 -5.629 14.301 249 HB1 ALA 32 HB1 ALA 32 2.314 -6.275 14.586 250 HB2 ALA 32 HB2 ALA 32 2.299 -4.553 14.967 251 HB3 ALA 32 HB3 ALA 32 2.897 -5.105 13.402 252 H GLN 33 H GLN 33 1.114 -3.684 11.572 253 HA GLN 33 HA GLN 33 0.488 -1.193 12.906 254 HB2 GLN 33 HB3 GLN 33 1.950 -1.989 10.570 255 HB3 GLN 33 HB2 GLN 33 0.763 -0.773 10.120 256 HG2 GLN 33 HG3 GLN 33 2.516 -0.340 12.496 257 HG3 GLN 33 HG2 GLN 33 3.136 -0.055 10.870 258 HE21 GLN 33 HE21 GLN 33 1.182 1.090 9.532 259 HE22 GLN 33 HE22 GLN 33 0.666 2.563 10.273 260 H THR 34 H THR 34 -1.058 -3.413 10.704 261 HA THR 34 HA THR 34 -3.179 -1.546 10.056 262 HB THR 34 HB THR 34 -4.136 -3.537 8.832 263 HG1 THR 34 HG1 THR 34 -1.632 -4.732 9.366 264 HG21 THR 34 HG21 THR 34 -2.011 -3.722 7.277 265 HG22 THR 34 HG22 THR 34 -1.508 -2.321 8.223 266 HG23 THR 34 HG23 THR 34 -3.020 -2.277 7.317 267 H VAL 35 H VAL 35 -2.737 -2.514 12.877 268 HA VAL 35 HA VAL 35 -5.184 -4.020 13.375 269 HB VAL 35 HB VAL 35 -3.167 -3.044 15.399 270 HG11 VAL 35 HG11 VAL 35 -4.203 -5.134 16.585 271 HG12 VAL 35 HG12 VAL 35 -5.556 -4.828 15.496 272 HG13 VAL 35 HG13 VAL 35 -5.036 -3.580 16.629 273 HG21 VAL 35 HG21 VAL 35 -1.915 -4.462 14.024 274 HG22 VAL 35 HG22 VAL 35 -3.270 -5.560 13.768 275 HG23 VAL 35 HG23 VAL 35 -2.462 -5.508 15.334 276 H GLY 36 H GLY 36 -6.888 -2.659 13.101 277 HA2 GLY 36 HA3 GLY 36 -8.438 -1.265 14.261 278 HA3 GLY 36 HA2 GLY 36 -7.083 -0.452 15.028 279 H LYS 37 H LYS 37 -6.795 -1.050 11.656 280 HA LYS 37 HA LYS 37 -7.647 1.702 11.054 281 HB2 LYS 37 HB3 LYS 37 -5.137 0.352 10.043 282 HB3 LYS 37 HB2 LYS 37 -5.711 1.939 9.548 283 HG2 LYS 37 HG3 LYS 37 -5.399 2.789 11.791 284 HG3 LYS 37 HG2 LYS 37 -4.918 1.187 12.354 285 HD2 LYS 37 HD3 LYS 37 -2.939 1.232 11.016 286 HD3 LYS 37 HD2 LYS 37 -3.465 2.700 10.190 287 HE2 LYS 37 HE3 LYS 37 -1.984 3.569 11.714 288 HE3 LYS 37 HE2 LYS 37 -3.494 3.688 12.615 289 HZ1 LYS 37 HZ1 LYS 37 -2.930 1.563 13.688 290 HZ2 LYS 37 HZ2 LYS 37 -1.792 2.772 14.013 291 HZ3 LYS 37 HZ3 LYS 37 -1.439 1.561 12.886 292 H ILE 38 H ILE 38 -7.411 1.895 8.448 293 HA ILE 38 HA ILE 38 -8.828 -0.442 7.348 294 HB ILE 38 HB ILE 38 -9.396 2.024 5.910 295 HG12 ILE 38 HG13 ILE 38 -10.921 1.997 8.444 296 HG13 ILE 38 HG12 ILE 38 -9.257 2.548 8.579 297 HG21 ILE 38 HG21 ILE 38 -11.758 0.931 6.875 298 HG22 ILE 38 HG22 ILE 38 -10.674 -0.448 6.688 299 HG23 ILE 38 HG23 ILE 38 -10.999 0.610 5.316 300 HD11 ILE 38 HD11 ILE 38 -11.571 3.816 7.286 301 HD12 ILE 38 HD12 ILE 38 -10.029 3.970 6.443 302 HD13 ILE 38 HD13 ILE 38 -10.186 4.536 8.106 303 H MET 39 H MET 39 -8.016 -1.314 5.547 304 HA MET 39 HA MET 39 -5.891 0.178 4.151 305 HB2 MET 39 HB3 MET 39 -5.060 -1.804 5.332 306 HB3 MET 39 HB2 MET 39 -6.209 -2.812 4.464 307 HG2 MET 39 HG3 MET 39 -5.027 -1.833 2.353 308 HG3 MET 39 HG2 MET 39 -3.720 -1.501 3.488 309 HE1 MET 39 HE1 MET 39 -5.479 -5.683 2.764 310 HE2 MET 39 HE2 MET 39 -5.593 -4.480 1.480 311 HE3 MET 39 HE3 MET 39 -6.378 -4.190 3.032 312 H VAL 40 H VAL 40 -6.434 0.842 2.194 313 HA VAL 40 HA VAL 40 -8.683 -0.334 0.790 314 HB VAL 40 HB VAL 40 -6.863 1.892 -0.140 315 HG11 VAL 40 HG11 VAL 40 -9.678 1.798 -0.976 316 HG12 VAL 40 HG12 VAL 40 -8.670 0.488 -1.592 317 HG13 VAL 40 HG13 VAL 40 -8.226 2.165 -1.907 318 HG21 VAL 40 HG21 VAL 40 -8.390 2.009 2.106 319 HG22 VAL 40 HG22 VAL 40 -9.527 2.580 0.884 320 HG23 VAL 40 HG23 VAL 40 -7.980 3.399 1.100 321 H VAL 41 H VAL 41 -8.539 -1.798 -0.798 322 HA VAL 41 HA VAL 41 -5.889 -2.287 -1.987 323 HB VAL 41 HB VAL 41 -7.027 -4.053 -0.374 324 HG11 VAL 41 HG11 VAL 41 -9.026 -4.037 -2.106 325 HG12 VAL 41 HG12 VAL 41 -8.550 -5.501 -1.249 326 HG13 VAL 41 HG13 VAL 41 -8.016 -5.238 -2.909 327 HG21 VAL 41 HG21 VAL 41 -5.162 -5.070 -0.998 328 HG22 VAL 41 HG22 VAL 41 -5.130 -4.160 -2.509 329 HG23 VAL 41 HG23 VAL 41 -6.004 -5.689 -2.419 330 H GLY 42 H GLY 42 -5.777 -2.772 -4.183 331 HA2 GLY 42 HA3 GLY 42 -7.898 -1.644 -5.771 332 HA3 GLY 42 HA2 GLY 42 -6.373 -2.281 -6.367 333 H ARG 43 H ARG 43 -8.524 -2.805 -7.856 334 HA ARG 43 HA ARG 43 -10.042 -5.043 -7.218 335 HB2 ARG 43 HB3 ARG 43 -10.002 -5.305 -9.848 336 HB3 ARG 43 HB2 ARG 43 -10.899 -4.020 -9.064 337 HG2 ARG 43 HG3 ARG 43 -9.532 -2.400 -9.850 338 HG3 ARG 43 HG2 ARG 43 -8.098 -3.425 -9.796 339 HD2 ARG 43 HD3 ARG 43 -8.575 -3.024 -12.089 340 HD3 ARG 43 HD2 ARG 43 -9.052 -4.686 -11.748 341 HE ARG 43 HE ARG 43 -11.176 -2.753 -11.498 342 HH11 ARG 43 HH11 ARG 43 -9.487 -4.919 -13.653 343 HH12 ARG 43 HH12 ARG 43 -10.819 -5.070 -14.748 344 HH21 ARG 43 HH21 ARG 43 -12.932 -2.956 -12.938 345 HH22 ARG 43 HH22 ARG 43 -12.773 -3.954 -14.344 346 H ARG 44 H ARG 44 -7.188 -4.960 -9.358 347 HA ARG 44 HA ARG 44 -6.907 -7.738 -9.566 348 HB2 ARG 44 HB3 ARG 44 -5.195 -5.376 -10.127 349 HB3 ARG 44 HB2 ARG 44 -4.387 -6.933 -9.998 350 HG2 ARG 44 HG3 ARG 44 -4.868 -6.611 -12.283 351 HG3 ARG 44 HG2 ARG 44 -6.027 -7.804 -11.694 352 HD2 ARG 44 HD3 ARG 44 -7.133 -5.202 -11.332 353 HD3 ARG 44 HD2 ARG 44 -6.538 -5.334 -12.986 354 HE ARG 44 HE ARG 44 -8.780 -6.712 -11.833 355 HH11 ARG 44 HH11 ARG 44 -6.362 -6.793 -14.349 356 HH12 ARG 44 HH12 ARG 44 -7.299 -7.810 -15.390 357 HH21 ARG 44 HH21 ARG 44 -10.014 -8.051 -13.201 358 HH22 ARG 44 HH22 ARG 44 -9.373 -8.524 -14.739 359 H THR 45 H THR 45 -6.170 -5.618 -6.977 360 HA THR 45 HA THR 45 -4.107 -7.251 -5.824 361 HB THR 45 HB THR 45 -5.652 -5.179 -4.303 362 HG1 THR 45 HG1 THR 45 -5.114 -3.790 -5.766 363 HG21 THR 45 HG21 THR 45 -2.792 -6.092 -4.295 364 HG22 THR 45 HG22 THR 45 -3.979 -6.225 -2.998 365 HG23 THR 45 HG23 THR 45 -3.356 -4.642 -3.464 366 H TYR 46 H TYR 46 -7.513 -6.546 -4.915 367 HA TYR 46 HA TYR 46 -7.663 -8.193 -2.706 368 HB2 TYR 46 HB3 TYR 46 -10.035 -8.193 -2.942 369 HB3 TYR 46 HB2 TYR 46 -9.473 -6.640 -3.543 370 HD1 TYR 46 HD2 TYR 46 -10.209 -10.067 -4.877 371 HD2 TYR 46 HD1 TYR 46 -10.452 -5.860 -5.480 372 HE1 TYR 46 HE2 TYR 46 -11.401 -10.446 -6.980 373 HE2 TYR 46 HE1 TYR 46 -11.662 -6.235 -7.586 374 HH TYR 46 HH TYR 46 -12.812 -9.373 -8.524 375 H GLU 47 H GLU 47 -7.989 -9.063 -6.114 376 HA GLU 47 HA GLU 47 -8.553 -11.826 -5.544 377 HB2 GLU 47 HB3 GLU 47 -8.630 -10.112 -7.824 378 HB3 GLU 47 HB2 GLU 47 -7.615 -11.494 -8.216 379 HG2 GLU 47 HG3 GLU 47 -10.186 -12.067 -6.882 380 HG3 GLU 47 HG2 GLU 47 -10.258 -11.481 -8.543 381 H SER 48 H SER 48 -5.752 -9.879 -5.978 382 HA SER 48 HA SER 48 -4.051 -12.274 -6.161 383 HB2 SER 48 HB3 SER 48 -3.902 -10.321 -7.876 384 HB3 SER 48 HB2 SER 48 -3.042 -9.476 -6.589 385 HG SER 48 HG SER 48 -2.075 -11.253 -8.280 386 H PHE 49 H PHE 49 -5.331 -11.179 -3.713 387 HA PHE 49 HA PHE 49 -2.998 -10.278 -2.189 388 HB2 PHE 49 HB3 PHE 49 -5.566 -9.386 -2.138 389 HB3 PHE 49 HB2 PHE 49 -5.596 -10.542 -0.811 390 HD1 PHE 49 HD1 PHE 49 -3.186 -7.973 -2.070 391 HD2 PHE 49 HD2 PHE 49 -5.325 -9.581 1.240 392 HE1 PHE 49 HE1 PHE 49 -2.150 -6.302 -0.593 393 HE2 PHE 49 HE2 PHE 49 -4.293 -7.912 2.723 394 HZ PHE 49 HZ PHE 49 -2.703 -6.269 1.807 395 HA PRO 50 HA PRO 50 -2.522 -14.295 -0.389 396 HB2 PRO 50 HB3 PRO 50 -0.956 -13.696 1.704 397 HB3 PRO 50 HB2 PRO 50 -0.373 -13.562 0.041 398 HG2 PRO 50 HG3 PRO 50 -1.346 -11.417 1.887 399 HG3 PRO 50 HG2 PRO 50 0.044 -11.401 0.786 400 HD2 PRO 50 HD3 PRO 50 -2.380 -10.253 0.210 401 HD3 PRO 50 HD2 PRO 50 -1.243 -10.835 -1.021 402 H LYS 51 H LYS 51 -3.751 -11.647 1.568 403 HA LYS 51 HA LYS 51 -5.300 -13.595 3.123 404 HB2 LYS 51 HB3 LYS 51 -3.170 -12.528 4.280 405 HB3 LYS 51 HB2 LYS 51 -4.265 -11.175 4.527 406 HG2 LYS 51 HG3 LYS 51 -4.396 -12.477 6.477 407 HG3 LYS 51 HG2 LYS 51 -5.868 -12.826 5.569 408 HD2 LYS 51 HD3 LYS 51 -4.655 -14.835 4.626 409 HD3 LYS 51 HD2 LYS 51 -3.399 -14.531 5.828 410 HE2 LYS 51 HE3 LYS 51 -4.676 -15.265 7.540 411 HE3 LYS 51 HE2 LYS 51 -6.159 -14.603 6.855 412 HZ1 LYS 51 HZ1 LYS 51 -6.639 -16.523 5.838 413 HZ2 LYS 51 HZ2 LYS 51 -5.562 -17.214 6.943 414 HZ3 LYS 51 HZ3 LYS 51 -5.037 -16.823 5.384 415 H ARG 52 H ARG 52 -7.068 -13.025 1.783 416 HA ARG 52 HA ARG 52 -8.178 -10.359 2.359 417 HB2 ARG 52 HB3 ARG 52 -9.413 -10.629 0.169 418 HB3 ARG 52 HB2 ARG 52 -7.677 -10.387 0.042 419 HG2 ARG 52 HG3 ARG 52 -7.307 -12.457 -0.788 420 HG3 ARG 52 HG2 ARG 52 -8.615 -13.186 0.144 421 HD2 ARG 52 HD3 ARG 52 -9.610 -11.295 -1.812 422 HD3 ARG 52 HD2 ARG 52 -8.640 -12.559 -2.562 423 HE ARG 52 HE ARG 52 -10.197 -14.154 -1.868 424 HH11 ARG 52 HH11 ARG 52 -11.100 -10.954 -0.783 425 HH12 ARG 52 HH12 ARG 52 -12.728 -11.409 -0.414 426 HH21 ARG 52 HH21 ARG 52 -12.337 -14.743 -1.379 427 HH22 ARG 52 HH22 ARG 52 -13.430 -13.555 -0.750 428 HA PRO 53 HA PRO 53 -9.406 -9.462 3.345 429 HB2 PRO 53 HB3 PRO 53 -11.042 -9.312 5.625 430 HB3 PRO 53 HB2 PRO 53 -11.433 -8.719 4.012 431 HG2 PRO 53 HG3 PRO 53 -12.693 -10.835 5.372 432 HG3 PRO 53 HG2 PRO 53 -12.889 -10.411 3.665 433 HD2 PRO 53 HD3 PRO 53 -11.208 -12.525 4.914 434 HD3 PRO 53 HD2 PRO 53 -12.020 -12.509 3.334 435 H LEU 54 H LEU 54 -8.572 -8.399 5.393 436 HA LEU 54 HA LEU 54 -6.805 -10.268 6.732 437 HB2 LEU 54 HB3 LEU 54 -6.986 -7.280 6.585 438 HB3 LEU 54 HB2 LEU 54 -5.993 -8.048 7.810 439 HG LEU 54 HG LEU 54 -5.607 -8.836 4.957 440 HD11 LEU 54 HD11 LEU 54 -4.280 -6.416 6.148 441 HD12 LEU 54 HD12 LEU 54 -5.688 -6.319 5.091 442 HD13 LEU 54 HD13 LEU 54 -4.181 -7.010 4.491 443 HD21 LEU 54 HD21 LEU 54 -4.192 -10.093 6.205 444 HD22 LEU 54 HD22 LEU 54 -4.110 -8.909 7.509 445 HD23 LEU 54 HD23 LEU 54 -3.173 -8.664 6.035 446 HA PRO 55 HA PRO 55 -9.360 -10.539 10.344 447 HB2 PRO 55 HB3 PRO 55 -7.598 -11.672 12.038 448 HB3 PRO 55 HB2 PRO 55 -8.309 -12.558 10.684 449 HG2 PRO 55 HG3 PRO 55 -5.621 -11.255 10.893 450 HG3 PRO 55 HG2 PRO 55 -6.047 -12.839 10.218 451 HD2 PRO 55 HD3 PRO 55 -5.618 -10.632 8.682 452 HD3 PRO 55 HD2 PRO 55 -6.719 -11.942 8.212 453 H GLU 56 H GLU 56 -9.763 -9.515 12.254 454 HA GLU 56 HA GLU 56 -9.737 -7.837 13.779 455 HB2 GLU 56 HB3 GLU 56 -7.492 -9.332 14.182 456 HB3 GLU 56 HB2 GLU 56 -6.806 -7.723 14.005 457 HG2 GLU 56 HG3 GLU 56 -8.586 -7.012 15.722 458 HG3 GLU 56 HG2 GLU 56 -8.722 -8.736 16.065 459 H ARG 57 H ARG 57 -9.456 -7.097 10.927 460 HA ARG 57 HA ARG 57 -8.711 -4.339 11.403 461 HB2 ARG 57 HB3 ARG 57 -7.048 -4.127 9.776 462 HB3 ARG 57 HB2 ARG 57 -6.641 -5.623 10.597 463 HG2 ARG 57 HG3 ARG 57 -6.358 -6.218 8.405 464 HG3 ARG 57 HG2 ARG 57 -8.020 -6.734 8.687 465 HD2 ARG 57 HD3 ARG 57 -7.415 -5.371 6.546 466 HD3 ARG 57 HD2 ARG 57 -8.906 -5.032 7.417 467 HE ARG 57 HE ARG 57 -8.072 -2.969 7.989 468 HH11 ARG 57 HH11 ARG 57 -5.494 -4.935 6.700 469 HH12 ARG 57 HH12 ARG 57 -4.367 -3.623 6.617 470 HH21 ARG 57 HH21 ARG 57 -6.592 -1.244 7.885 471 HH22 ARG 57 HH22 ARG 57 -4.989 -1.528 7.294 472 H THR 58 H THR 58 -9.298 -2.919 9.558 473 HA THR 58 HA THR 58 -11.755 -3.917 8.312 474 HB THR 58 HB THR 58 -10.756 -1.071 8.552 475 HG1 THR 58 HG1 THR 58 -11.350 -1.321 10.543 476 HG21 THR 58 HG21 THR 58 -12.887 -0.337 7.927 477 HG22 THR 58 HG22 THR 58 -13.578 -1.954 8.068 478 HG23 THR 58 HG23 THR 58 -12.464 -1.583 6.752 479 H ASN 59 H ASN 59 -11.678 -4.537 6.259 480 HA ASN 59 HA ASN 59 -9.485 -3.549 4.580 481 HB2 ASN 59 HB3 ASN 59 -10.692 -5.565 3.130 482 HB3 ASN 59 HB2 ASN 59 -9.255 -5.735 4.131 483 HD21 ASN 59 HD21 ASN 59 -9.430 -6.677 6.165 484 HD22 ASN 59 HD22 ASN 59 -10.806 -7.614 6.625 485 H VAL 60 H VAL 60 -9.813 -2.740 2.537 486 HA VAL 60 HA VAL 60 -12.583 -2.131 1.764 487 HB VAL 60 HB VAL 60 -10.276 -0.202 1.976 488 HG11 VAL 60 HG11 VAL 60 -12.538 -0.172 0.080 489 HG12 VAL 60 HG12 VAL 60 -10.943 0.571 -0.038 490 HG13 VAL 60 HG13 VAL 60 -12.206 1.341 0.923 491 HG21 VAL 60 HG21 VAL 60 -13.096 0.288 2.836 492 HG22 VAL 60 HG22 VAL 60 -11.600 0.992 3.448 493 HG23 VAL 60 HG23 VAL 60 -12.014 -0.677 3.841 494 H VAL 61 H VAL 61 -13.009 -2.486 -0.349 495 HA VAL 61 HA VAL 61 -10.721 -3.140 -2.080 496 HB VAL 61 HB VAL 61 -13.564 -4.145 -2.156 497 HG11 VAL 61 HG11 VAL 61 -11.570 -3.984 -4.283 498 HG12 VAL 61 HG12 VAL 61 -13.301 -4.308 -4.373 499 HG13 VAL 61 HG13 VAL 61 -12.177 -5.617 -4.011 500 HG21 VAL 61 HG21 VAL 61 -12.804 -5.931 -1.069 501 HG22 VAL 61 HG22 VAL 61 -11.302 -5.047 -0.801 502 HG23 VAL 61 HG23 VAL 61 -11.458 -6.118 -2.193 503 H LEU 62 H LEU 62 -10.368 -2.030 -3.876 504 HA LEU 62 HA LEU 62 -12.425 -0.114 -4.752 505 HB2 LEU 62 HB3 LEU 62 -10.266 0.802 -3.742 506 HB3 LEU 62 HB2 LEU 62 -9.460 0.199 -5.178 507 HG LEU 62 HG LEU 62 -11.018 1.639 -6.543 508 HD11 LEU 62 HD11 LEU 62 -11.962 2.277 -3.825 509 HD12 LEU 62 HD12 LEU 62 -12.821 2.307 -5.366 510 HD13 LEU 62 HD13 LEU 62 -11.762 3.645 -4.920 511 HD21 LEU 62 HD21 LEU 62 -9.851 3.813 -5.674 512 HD22 LEU 62 HD22 LEU 62 -8.902 2.525 -6.417 513 HD23 LEU 62 HD23 LEU 62 -8.954 2.682 -4.661 514 H THR 63 H THR 63 -13.388 -1.234 -6.370 515 HA THR 63 HA THR 63 -11.688 -1.985 -8.647 516 HB THR 63 HB THR 63 -12.428 -4.009 -7.445 517 HG1 THR 63 HG1 THR 63 -13.919 -3.904 -9.826 518 HG21 THR 63 HG21 THR 63 -15.002 -4.469 -7.980 519 HG22 THR 63 HG22 THR 63 -15.073 -2.734 -7.676 520 HG23 THR 63 HG23 THR 63 -14.432 -3.819 -6.443 521 H HIS 64 H HIS 64 -12.487 -1.498 -10.670 522 HA HIS 64 HA HIS 64 -14.345 0.619 -10.853 523 HB2 HIS 64 HB3 HIS 64 -12.758 -1.006 -12.748 524 HB3 HIS 64 HB2 HIS 64 -14.203 -0.251 -13.412 525 HD1 HIS 64 HD1 HIS 64 -13.560 1.840 -14.547 526 HD2 HIS 64 HD2 HIS 64 -11.364 1.243 -11.071 527 HE1 HIS 64 HE1 HIS 64 -12.076 3.858 -14.335 528 HE2 HIS 64 HE2 HIS 64 -10.819 3.515 -12.178 529 H GLN 65 H GLN 65 -14.644 -2.847 -11.230 530 HA GLN 65 HA GLN 65 -17.019 -3.104 -12.584 531 HB2 GLN 65 HB3 GLN 65 -15.687 -4.706 -10.447 532 HB3 GLN 65 HB2 GLN 65 -17.335 -5.121 -10.896 533 HG2 GLN 65 HG3 GLN 65 -16.720 -5.990 -12.869 534 HG3 GLN 65 HG2 GLN 65 -15.495 -4.753 -13.150 535 HE21 GLN 65 HE21 GLN 65 -13.575 -4.939 -11.608 536 HE22 GLN 65 HE22 GLN 65 -12.943 -6.531 -11.379 537 H GLU 66 H GLU 66 -19.085 -2.633 -12.207 538 HA GLU 66 HA GLU 66 -19.789 -1.272 -9.756 539 HB2 GLU 66 HB3 GLU 66 -21.938 -0.848 -10.852 540 HB3 GLU 66 HB2 GLU 66 -20.594 -0.401 -11.894 541 HG2 GLU 66 HG3 GLU 66 -20.911 -2.269 -13.283 542 HG3 GLU 66 HG2 GLU 66 -21.974 -3.055 -12.116 543 H ASP 67 H ASP 67 -20.435 -4.334 -11.331 544 HA ASP 67 HA ASP 67 -22.294 -5.109 -9.221 545 HB2 ASP 67 HB3 ASP 67 -21.701 -6.050 -11.960 546 HB3 ASP 67 HB2 ASP 67 -22.157 -7.297 -10.803 547 H TYR 68 H TYR 68 -19.239 -4.855 -8.940 548 HA TYR 68 HA TYR 68 -18.350 -7.546 -8.487 549 HB2 TYR 68 HB3 TYR 68 -16.712 -5.847 -9.059 550 HB3 TYR 68 HB2 TYR 68 -17.164 -4.890 -7.651 551 HD1 TYR 68 HD1 TYR 68 -15.934 -8.321 -8.490 552 HD2 TYR 68 HD2 TYR 68 -15.855 -5.064 -5.755 553 HE1 TYR 68 HE1 TYR 68 -14.237 -9.494 -7.151 554 HE2 TYR 68 HE2 TYR 68 -14.156 -6.226 -4.412 555 HH TYR 68 HH TYR 68 -13.350 -9.521 -4.916 556 H GLN 69 H GLN 69 -17.968 -8.558 -6.489 557 HA GLN 69 HA GLN 69 -19.286 -7.321 -4.169 558 HB2 GLN 69 HB3 GLN 69 -19.696 -10.069 -5.307 559 HB3 GLN 69 HB2 GLN 69 -19.970 -9.757 -3.598 560 HG2 GLN 69 HG3 GLN 69 -21.376 -8.481 -5.930 561 HG3 GLN 69 HG2 GLN 69 -22.054 -9.606 -4.754 562 HE21 GLN 69 HE21 GLN 69 -21.359 -6.355 -5.490 563 HE22 GLN 69 HE22 GLN 69 -21.934 -5.654 -4.020 564 H ALA 70 H ALA 70 -17.679 -6.929 -2.794 565 HA ALA 70 HA ALA 70 -15.509 -8.876 -2.507 566 HB1 ALA 70 HB1 ALA 70 -15.246 -6.274 -2.789 567 HB2 ALA 70 HB2 ALA 70 -14.171 -7.185 -1.730 568 HB3 ALA 70 HB3 ALA 70 -15.521 -6.279 -1.048 569 H GLN 71 H GLN 71 -16.343 -10.475 -1.242 570 HA GLN 71 HA GLN 71 -17.991 -10.037 1.015 571 HB2 GLN 71 HB3 GLN 71 -16.271 -12.470 0.585 572 HB3 GLN 71 HB2 GLN 71 -17.816 -12.364 1.418 573 HG2 GLN 71 HG3 GLN 71 -18.933 -12.769 -0.449 574 HG3 GLN 71 HG2 GLN 71 -18.076 -11.493 -1.312 575 HE21 GLN 71 HE21 GLN 71 -16.384 -12.008 -2.628 576 HE22 GLN 71 HE22 GLN 71 -15.932 -13.631 -3.010 577 H GLY 72 H GLY 72 -17.408 -9.127 2.867 578 HA2 GLY 72 HA3 GLY 72 -16.203 -9.303 4.925 579 HA3 GLY 72 HA2 GLY 72 -14.813 -9.879 4.023 580 H ALA 73 H ALA 73 -15.412 -7.541 2.035 581 HA ALA 73 HA ALA 73 -14.313 -5.405 3.732 582 HB1 ALA 73 HB1 ALA 73 -12.888 -4.768 1.769 583 HB2 ALA 73 HB2 ALA 73 -13.350 -6.297 1.022 584 HB3 ALA 73 HB3 ALA 73 -12.453 -6.293 2.541 585 H VAL 74 H VAL 74 -14.380 -3.237 2.518 586 HA VAL 74 HA VAL 74 -17.107 -2.829 1.643 587 HB VAL 74 HB VAL 74 -14.973 -0.707 1.713 588 HG11 VAL 74 HG11 VAL 74 -17.535 -0.585 0.875 589 HG12 VAL 74 HG12 VAL 74 -16.658 0.781 1.565 590 HG13 VAL 74 HG13 VAL 74 -17.736 -0.179 2.579 591 HG21 VAL 74 HG21 VAL 74 -16.220 -2.146 3.969 592 HG22 VAL 74 HG22 VAL 74 -16.176 -0.387 4.097 593 HG23 VAL 74 HG23 VAL 74 -14.679 -1.292 3.878 594 H VAL 75 H VAL 75 -17.776 -2.149 -0.366 595 HA VAL 75 HA VAL 75 -15.766 -2.385 -2.507 596 HB VAL 75 HB VAL 75 -18.737 -2.783 -2.813 597 HG11 VAL 75 HG11 VAL 75 -16.351 -3.253 -4.571 598 HG12 VAL 75 HG12 VAL 75 -17.811 -2.324 -4.912 599 HG13 VAL 75 HG13 VAL 75 -17.882 -4.085 -4.842 600 HG21 VAL 75 HG21 VAL 75 -17.607 -4.404 -1.218 601 HG22 VAL 75 HG22 VAL 75 -16.694 -4.978 -2.612 602 HG23 VAL 75 HG23 VAL 75 -18.452 -5.113 -2.595 603 H VAL 76 H VAL 76 -15.503 -0.827 -3.966 604 HA VAL 76 HA VAL 76 -17.479 1.209 -4.449 605 HB VAL 76 HB VAL 76 -16.107 3.125 -3.880 606 HG11 VAL 76 HG11 VAL 76 -16.232 1.308 -1.482 607 HG12 VAL 76 HG12 VAL 76 -17.638 2.109 -2.184 608 HG13 VAL 76 HG13 VAL 76 -16.323 3.069 -1.506 609 HG21 VAL 76 HG21 VAL 76 -13.920 3.026 -3.511 610 HG22 VAL 76 HG22 VAL 76 -13.990 1.305 -3.890 611 HG23 VAL 76 HG23 VAL 76 -14.130 1.845 -2.217 612 H HIS 77 H HIS 77 -16.670 2.760 -6.183 613 HA HIS 77 HA HIS 77 -14.606 1.463 -7.834 614 HB2 HIS 77 HB3 HIS 77 -16.875 2.725 -9.264 615 HB3 HIS 77 HB2 HIS 77 -15.932 1.298 -9.679 616 HD1 HIS 77 HD1 HIS 77 -16.464 -0.693 -7.619 617 HD2 HIS 77 HD2 HIS 77 -19.420 1.971 -8.817 618 HE1 HIS 77 HE1 HIS 77 -18.642 -1.771 -6.973 619 HE2 HIS 77 HE2 HIS 77 -20.420 -0.178 -7.781 620 H ASP 78 H ASP 78 -15.773 4.376 -6.502 621 HA ASP 78 HA ASP 78 -14.017 5.895 -8.318 622 HB2 ASP 78 HB3 ASP 78 -16.563 6.805 -6.963 623 HB3 ASP 78 HB2 ASP 78 -15.474 7.865 -7.854 624 H VAL 79 H VAL 79 -13.072 7.866 -7.364 625 HA VAL 79 HA VAL 79 -11.830 7.276 -4.882 626 HB VAL 79 HB VAL 79 -10.938 9.666 -5.176 627 HG11 VAL 79 HG11 VAL 79 -9.370 8.921 -6.965 628 HG12 VAL 79 HG12 VAL 79 -10.383 7.493 -7.176 629 HG13 VAL 79 HG13 VAL 79 -9.563 7.772 -5.640 630 HG21 VAL 79 HG21 VAL 79 -12.803 10.275 -6.780 631 HG22 VAL 79 HG22 VAL 79 -11.935 9.324 -7.984 632 HG23 VAL 79 HG23 VAL 79 -11.170 10.737 -7.257 633 H ALA 80 H ALA 80 -14.341 9.507 -5.929 634 HA ALA 80 HA ALA 80 -14.559 10.897 -3.465 635 HB1 ALA 80 HB1 ALA 80 -15.406 11.601 -5.789 636 HB2 ALA 80 HB2 ALA 80 -16.407 11.982 -4.389 637 HB3 ALA 80 HB3 ALA 80 -16.817 10.611 -5.419 638 H ALA 81 H ALA 81 -16.224 8.103 -4.850 639 HA ALA 81 HA ALA 81 -18.242 7.750 -2.988 640 HB1 ALA 81 HB1 ALA 81 -16.774 5.992 -4.849 641 HB2 ALA 81 HB2 ALA 81 -18.509 6.228 -4.638 642 HB3 ALA 81 HB3 ALA 81 -17.619 5.186 -3.527 643 H VAL 82 H VAL 82 -15.115 6.015 -2.955 644 HA VAL 82 HA VAL 82 -15.318 4.914 -0.439 645 HB VAL 82 HB VAL 82 -13.544 4.423 -2.139 646 HG11 VAL 82 HG11 VAL 82 -12.263 6.917 -1.034 647 HG12 VAL 82 HG12 VAL 82 -12.899 6.707 -2.666 648 HG13 VAL 82 HG13 VAL 82 -11.508 5.765 -2.135 649 HG21 VAL 82 HG21 VAL 82 -12.001 3.656 -0.576 650 HG22 VAL 82 HG22 VAL 82 -13.496 3.791 0.350 651 HG23 VAL 82 HG23 VAL 82 -12.254 5.035 0.494 652 H PHE 83 H PHE 83 -14.119 8.132 -1.352 653 HA PHE 83 HA PHE 83 -13.108 8.995 1.067 654 HB2 PHE 83 HB3 PHE 83 -14.253 10.295 -1.315 655 HB3 PHE 83 HB2 PHE 83 -14.346 11.261 0.154 656 HD1 PHE 83 HD2 PHE 83 -11.945 10.797 1.574 657 HD2 PHE 83 HD1 PHE 83 -12.523 10.999 -2.637 658 HE1 PHE 83 HE2 PHE 83 -9.593 11.461 1.287 659 HE2 PHE 83 HE1 PHE 83 -10.172 11.662 -2.932 660 HZ PHE 83 HZ PHE 83 -8.704 11.895 -0.968 661 H ALA 84 H ALA 84 -16.473 8.808 0.028 662 HA ALA 84 HA ALA 84 -17.593 10.148 2.249 663 HB1 ALA 84 HB1 ALA 84 -19.597 9.648 1.322 664 HB2 ALA 84 HB2 ALA 84 -19.173 7.955 1.068 665 HB3 ALA 84 HB3 ALA 84 -18.613 9.183 -0.066 666 H TYR 85 H TYR 85 -16.645 6.845 1.619 667 HA TYR 85 HA TYR 85 -17.741 5.638 3.909 668 HB2 TYR 85 HB3 TYR 85 -16.878 3.832 2.896 669 HB3 TYR 85 HB2 TYR 85 -15.998 4.868 1.783 670 HD1 TYR 85 HD1 TYR 85 -15.761 3.167 5.079 671 HD2 TYR 85 HD2 TYR 85 -13.654 5.016 1.885 672 HE1 TYR 85 HE1 TYR 85 -13.631 2.367 6.019 673 HE2 TYR 85 HE2 TYR 85 -11.527 4.224 2.810 674 HH TYR 85 HH TYR 85 -10.671 2.552 4.274 675 H ALA 86 H ALA 86 -14.358 6.673 3.387 676 HA ALA 86 HA ALA 86 -13.327 6.406 5.864 677 HB1 ALA 86 HB1 ALA 86 -11.957 7.188 4.074 678 HB2 ALA 86 HB2 ALA 86 -11.880 8.380 5.372 679 HB3 ALA 86 HB3 ALA 86 -12.878 8.687 3.951 680 H LYS 87 H LYS 87 -15.561 8.936 4.850 681 HA LYS 87 HA LYS 87 -15.309 10.576 7.143 682 HB2 LYS 87 HB3 LYS 87 -16.688 10.776 4.805 683 HB3 LYS 87 HB2 LYS 87 -17.992 10.373 5.913 684 HG2 LYS 87 HG3 LYS 87 -17.893 12.729 5.800 685 HG3 LYS 87 HG2 LYS 87 -17.212 12.270 7.362 686 HD2 LYS 87 HD3 LYS 87 -15.005 12.274 5.739 687 HD3 LYS 87 HD2 LYS 87 -15.958 13.605 5.079 688 HE2 LYS 87 HE3 LYS 87 -16.207 14.315 7.564 689 HE3 LYS 87 HE2 LYS 87 -14.807 13.275 7.821 690 HZ1 LYS 87 HZ1 LYS 87 -13.813 14.629 5.879 691 HZ2 LYS 87 HZ2 LYS 87 -13.851 15.315 7.425 692 HZ3 LYS 87 HZ3 LYS 87 -15.001 15.769 6.271 693 H GLN 88 H GLN 88 -17.528 7.975 6.309 694 HA GLN 88 HA GLN 88 -19.037 7.921 8.662 695 HB2 GLN 88 HB3 GLN 88 -19.039 6.489 6.327 696 HB3 GLN 88 HB2 GLN 88 -18.506 5.278 7.483 697 HG2 GLN 88 HG3 GLN 88 -20.756 4.975 7.597 698 HG3 GLN 88 HG2 GLN 88 -20.546 6.175 8.872 699 HE21 GLN 88 HE21 GLN 88 -20.873 6.205 5.333 700 HE22 GLN 88 HE22 GLN 88 -22.090 7.429 5.287 701 H HIS 89 H HIS 89 -15.817 6.889 8.039 702 HA HIS 89 HA HIS 89 -15.672 5.586 10.676 703 HB2 HIS 89 HB3 HIS 89 -14.366 5.052 8.063 704 HB3 HIS 89 HB2 HIS 89 -13.373 4.825 9.501 705 HD1 HIS 89 HD1 HIS 89 -15.416 3.568 11.398 706 HD2 HIS 89 HD2 HIS 89 -15.011 2.502 7.403 707 HE1 HIS 89 HE1 HIS 89 -16.365 1.246 11.223 708 HE2 HIS 89 HE2 HIS 89 -16.032 0.589 8.813 709 HA PRO 90 HA PRO 90 -13.353 9.555 11.062 710 HB2 PRO 90 HB3 PRO 90 -14.168 10.144 13.563 711 HB3 PRO 90 HB2 PRO 90 -15.153 10.497 12.138 712 HG2 PRO 90 HG3 PRO 90 -15.353 8.208 14.058 713 HG3 PRO 90 HG2 PRO 90 -16.648 9.199 13.361 714 HD2 PRO 90 HD3 PRO 90 -15.992 6.731 12.418 715 HD3 PRO 90 HD2 PRO 90 -16.663 8.014 11.392 716 H ASP 91 H ASP 91 -13.694 7.099 13.654 717 HA ASP 91 HA ASP 91 -11.162 7.773 14.801 718 HB2 ASP 91 HB3 ASP 91 -12.949 5.378 15.264 719 HB3 ASP 91 HB2 ASP 91 -11.560 5.819 16.253 720 H GLN 92 H GLN 92 -11.909 6.111 12.020 721 HA GLN 92 HA GLN 92 -9.625 4.286 12.284 722 HB2 GLN 92 HB3 GLN 92 -12.180 4.148 10.917 723 HB3 GLN 92 HB2 GLN 92 -10.849 3.804 9.823 724 HG2 GLN 92 HG3 GLN 92 -11.489 1.730 10.683 725 HG3 GLN 92 HG2 GLN 92 -10.027 2.162 11.569 726 HE21 GLN 92 HE21 GLN 92 -13.516 2.780 11.840 727 HE22 GLN 92 HE22 GLN 92 -13.623 2.407 13.523 728 H GLU 93 H GLU 93 -7.891 4.354 10.900 729 HA GLU 93 HA GLU 93 -7.534 6.870 9.469 730 HB2 GLU 93 HB3 GLU 93 -5.861 5.434 11.091 731 HB3 GLU 93 HB2 GLU 93 -5.301 4.957 9.494 732 HG2 GLU 93 HG3 GLU 93 -4.429 6.978 9.049 733 HG3 GLU 93 HG2 GLU 93 -5.731 7.840 9.868 734 H LEU 94 H LEU 94 -6.470 6.857 7.340 735 HA LEU 94 HA LEU 94 -7.529 4.675 5.682 736 HB2 LEU 94 HB3 LEU 94 -7.130 7.588 5.273 737 HB3 LEU 94 HB2 LEU 94 -6.914 6.551 3.877 738 HG LEU 94 HG LEU 94 -9.391 6.152 5.458 739 HD11 LEU 94 HD11 LEU 94 -9.886 8.337 5.438 740 HD12 LEU 94 HD12 LEU 94 -10.201 8.080 3.722 741 HD13 LEU 94 HD13 LEU 94 -8.640 8.712 4.247 742 HD21 LEU 94 HD21 LEU 94 -8.641 6.146 2.543 743 HD22 LEU 94 HD22 LEU 94 -10.297 5.960 3.121 744 HD23 LEU 94 HD23 LEU 94 -9.072 4.768 3.556 745 H VAL 95 H VAL 95 -6.162 3.295 4.771 746 HA VAL 95 HA VAL 95 -3.435 4.176 4.139 747 HB VAL 95 HB VAL 95 -3.998 1.515 5.449 748 HG11 VAL 95 HG11 VAL 95 -2.030 1.610 3.981 749 HG12 VAL 95 HG12 VAL 95 -1.582 1.385 5.671 750 HG13 VAL 95 HG13 VAL 95 -1.408 2.969 4.916 751 HG21 VAL 95 HG21 VAL 95 -3.470 4.171 6.621 752 HG22 VAL 95 HG22 VAL 95 -2.530 2.833 7.280 753 HG23 VAL 95 HG23 VAL 95 -4.292 2.769 7.306 754 H ILE 96 H ILE 96 -2.478 3.135 2.384 755 HA ILE 96 HA ILE 96 -4.263 1.358 0.848 756 HB ILE 96 HB ILE 96 -2.239 3.108 -0.501 757 HG12 ILE 96 HG13 ILE 96 -3.610 4.612 0.894 758 HG13 ILE 96 HG12 ILE 96 -3.936 4.841 -0.821 759 HG21 ILE 96 HG21 ILE 96 -4.921 2.314 -1.553 760 HG22 ILE 96 HG22 ILE 96 -3.589 1.158 -1.551 761 HG23 ILE 96 HG23 ILE 96 -3.436 2.679 -2.431 762 HD11 ILE 96 HD11 ILE 96 -5.990 3.625 -0.650 763 HD12 ILE 96 HD12 ILE 96 -5.956 4.869 0.600 764 HD13 ILE 96 HD13 ILE 96 -5.639 3.186 1.022 765 H ALA 97 H ALA 97 -3.440 -0.533 0.168 766 HA ALA 97 HA ALA 97 -0.578 -1.012 0.651 767 HB1 ALA 97 HB1 ALA 97 -1.369 -3.473 0.586 768 HB2 ALA 97 HB2 ALA 97 -2.977 -2.789 0.821 769 HB3 ALA 97 HB3 ALA 97 -1.713 -2.501 2.016 770 H GLY 98 H GLY 98 -3.179 -1.425 -1.675 771 HA2 GLY 98 HA3 GLY 98 -1.442 -1.279 -3.898 772 HA3 GLY 98 HA2 GLY 98 -1.846 -2.961 -3.590 773 H GLY 99 H GLY 99 -4.291 -1.784 -6.056 774 HA2 GLY 99 HA3 GLY 99 -1.533 -2.610 -5.663 775 HA3 GLY 99 HA2 GLY 99 -2.411 -2.571 -7.182 776 H ALA 100 H ALA 100 -0.295 -1.684 -7.902 777 HA ALA 100 HA ALA 100 0.656 0.826 -7.092 778 HB1 ALA 100 HB1 ALA 100 1.029 0.095 -9.926 779 HB2 ALA 100 HB2 ALA 100 1.591 -1.078 -8.735 780 HB3 ALA 100 HB3 ALA 100 2.212 0.572 -8.709 781 H GLN 101 H GLN 101 -1.934 -0.063 -9.251 782 HA GLN 101 HA GLN 101 -2.139 2.470 -10.551 783 HB2 GLN 101 HB3 GLN 101 -3.450 -0.088 -10.687 784 HB3 GLN 101 HB2 GLN 101 -4.654 1.192 -10.631 785 HG2 GLN 101 HG3 GLN 101 -2.368 1.043 -12.583 786 HG3 GLN 101 HG2 GLN 101 -4.033 0.570 -12.919 787 HE21 GLN 101 HE21 GLN 101 -5.575 2.461 -12.017 788 HE22 GLN 101 HE22 GLN 101 -5.196 4.008 -12.687 789 H ILE 102 H ILE 102 -3.666 0.982 -7.746 790 HA ILE 102 HA ILE 102 -5.619 2.957 -7.283 791 HB ILE 102 HB ILE 102 -4.250 1.269 -5.187 792 HG12 ILE 102 HG13 ILE 102 -5.106 -0.112 -7.055 793 HG13 ILE 102 HG12 ILE 102 -5.994 -0.386 -5.560 794 HG21 ILE 102 HG21 ILE 102 -5.727 3.216 -4.497 795 HG22 ILE 102 HG22 ILE 102 -6.139 1.634 -3.835 796 HG23 ILE 102 HG23 ILE 102 -7.071 2.299 -5.177 797 HD11 ILE 102 HD11 ILE 102 -7.059 0.181 -8.047 798 HD12 ILE 102 HD12 ILE 102 -7.215 1.691 -7.148 799 HD13 ILE 102 HD13 ILE 102 -7.909 0.204 -6.502 800 H PHE 103 H PHE 103 -2.222 2.777 -6.546 801 HA PHE 103 HA PHE 103 -2.225 4.926 -4.652 802 HB2 PHE 103 HB3 PHE 103 -0.037 3.473 -6.135 803 HB3 PHE 103 HB2 PHE 103 0.295 4.823 -5.054 804 HD1 PHE 103 HD1 PHE 103 -2.137 2.024 -4.709 805 HD2 PHE 103 HD2 PHE 103 1.375 3.911 -3.223 806 HE1 PHE 103 HE1 PHE 103 -2.131 0.490 -2.796 807 HE2 PHE 103 HE2 PHE 103 1.385 2.372 -1.304 808 HZ PHE 103 HZ PHE 103 -0.367 0.659 -1.088 809 H THR 104 H THR 104 -1.814 4.603 -8.109 810 HA THR 104 HA THR 104 -0.647 7.078 -8.680 811 HB THR 104 HB THR 104 -2.620 5.492 -10.336 812 HG1 THR 104 HG1 THR 104 -0.988 4.284 -10.850 813 HG21 THR 104 HG21 THR 104 -2.359 6.889 -12.036 814 HG22 THR 104 HG22 THR 104 -0.617 7.002 -11.778 815 HG23 THR 104 HG23 THR 104 -1.714 8.036 -10.862 816 H ALA 105 H ALA 105 -4.085 6.162 -8.521 817 HA ALA 105 HA ALA 105 -5.127 8.703 -9.117 818 HB1 ALA 105 HB1 ALA 105 -6.162 6.186 -8.015 819 HB2 ALA 105 HB2 ALA 105 -6.844 7.254 -9.242 820 HB3 ALA 105 HB3 ALA 105 -7.051 7.631 -7.531 821 H PHE 106 H PHE 106 -4.786 7.147 -5.903 822 HA PHE 106 HA PHE 106 -5.460 9.476 -4.491 823 HB2 PHE 106 HB3 PHE 106 -4.075 6.915 -3.738 824 HB3 PHE 106 HB2 PHE 106 -4.292 8.216 -2.571 825 HD1 PHE 106 HD2 PHE 106 -6.377 6.445 -5.122 826 HD2 PHE 106 HD1 PHE 106 -6.075 7.976 -1.162 827 HE1 PHE 106 HE2 PHE 106 -8.647 5.629 -4.639 828 HE2 PHE 106 HE1 PHE 106 -8.345 7.162 -0.672 829 HZ PHE 106 HZ PHE 106 -9.634 5.988 -2.413 830 H LYS 107 H LYS 107 -2.611 8.673 -6.186 831 HA LYS 107 HA LYS 107 -0.528 9.660 -4.723 832 HB2 LYS 107 HB3 LYS 107 0.638 9.886 -6.698 833 HB3 LYS 107 HB2 LYS 107 -0.670 8.835 -7.218 834 HG2 LYS 107 HG3 LYS 107 -1.874 10.903 -8.000 835 HG3 LYS 107 HG2 LYS 107 -0.381 11.791 -7.690 836 HD2 LYS 107 HD3 LYS 107 0.802 10.569 -9.329 837 HD3 LYS 107 HD2 LYS 107 -0.470 9.352 -9.448 838 HE2 LYS 107 HE3 LYS 107 -1.139 10.517 -11.242 839 HE3 LYS 107 HE2 LYS 107 -1.829 11.632 -10.064 840 HZ1 LYS 107 HZ1 LYS 107 0.922 11.891 -11.143 841 HZ2 LYS 107 HZ2 LYS 107 0.070 13.023 -10.220 842 HZ3 LYS 107 HZ3 LYS 107 -0.418 12.686 -11.804 843 H ASP 108 H ASP 108 -3.086 11.461 -6.270 844 HA ASP 108 HA ASP 108 -1.909 14.026 -5.562 845 HB2 ASP 108 HB3 ASP 108 -4.481 13.289 -6.973 846 HB3 ASP 108 HB2 ASP 108 -3.997 14.946 -6.624 847 H ASP 109 H ASP 109 -4.572 11.920 -4.647 848 HA ASP 109 HA ASP 109 -5.545 13.792 -2.649 849 HB2 ASP 109 HB3 ASP 109 -6.481 11.231 -3.814 850 HB3 ASP 109 HB2 ASP 109 -6.985 11.578 -2.162 851 H VAL 110 H VAL 110 -2.889 12.019 -2.594 852 HA VAL 110 HA VAL 110 -3.252 10.636 -0.077 853 HB VAL 110 HB VAL 110 -1.823 9.669 -1.832 854 HG11 VAL 110 HG11 VAL 110 0.429 11.479 -1.299 855 HG12 VAL 110 HG12 VAL 110 -0.891 12.180 -2.236 856 HG13 VAL 110 HG13 VAL 110 -0.087 10.716 -2.803 857 HG21 VAL 110 HG21 VAL 110 -0.203 8.822 -0.393 858 HG22 VAL 110 HG22 VAL 110 -1.477 9.355 0.704 859 HG23 VAL 110 HG23 VAL 110 -0.037 10.347 0.477 860 H ASP 111 H ASP 111 -1.859 11.000 1.774 861 HA ASP 111 HA ASP 111 -0.927 13.778 2.033 862 HB2 ASP 111 HB3 ASP 111 -2.900 12.301 3.689 863 HB3 ASP 111 HB2 ASP 111 -1.745 13.315 4.550 864 H THR 112 H THR 112 -0.774 10.480 3.341 865 HA THR 112 HA THR 112 1.940 11.087 4.310 866 HB THR 112 HB THR 112 0.088 8.929 5.334 867 HG1 THR 112 HG1 THR 112 0.787 11.388 6.556 868 HG21 THR 112 HG21 THR 112 1.690 9.064 7.315 869 HG22 THR 112 HG22 THR 112 2.801 9.862 6.203 870 HG23 THR 112 HG23 THR 112 2.244 8.222 5.869 871 H LEU 113 H LEU 113 3.503 9.316 4.196 872 HA LEU 113 HA LEU 113 2.886 7.233 2.250 873 HB2 LEU 113 HB3 LEU 113 4.352 9.590 1.640 874 HB3 LEU 113 HB2 LEU 113 5.471 8.242 1.617 875 HG LEU 113 HG LEU 113 4.184 7.117 -0.073 876 HD11 LEU 113 HD11 LEU 113 2.173 8.286 -1.048 877 HD12 LEU 113 HD12 LEU 113 2.183 9.317 0.383 878 HD13 LEU 113 HD13 LEU 113 1.945 7.578 0.551 879 HD21 LEU 113 HD21 LEU 113 5.573 8.469 -1.244 880 HD22 LEU 113 HD22 LEU 113 4.990 9.934 -0.452 881 HD23 LEU 113 HD23 LEU 113 4.044 9.193 -1.745 882 H LEU 114 H LEU 114 3.888 5.356 2.631 883 HA LEU 114 HA LEU 114 6.198 5.281 4.437 884 HB2 LEU 114 HB3 LEU 114 3.605 3.787 4.750 885 HB3 LEU 114 HB2 LEU 114 5.099 3.166 5.426 886 HG LEU 114 HG LEU 114 4.407 5.964 6.113 887 HD11 LEU 114 HD11 LEU 114 2.613 5.559 7.431 888 HD12 LEU 114 HD12 LEU 114 3.099 3.899 7.775 889 HD13 LEU 114 HD13 LEU 114 2.329 4.292 6.237 890 HD21 LEU 114 HD21 LEU 114 6.434 4.786 6.926 891 HD22 LEU 114 HD22 LEU 114 5.387 3.647 7.773 892 HD23 LEU 114 HD23 LEU 114 5.381 5.353 8.222 893 H VAL 115 H VAL 115 7.768 4.364 3.254 894 HA VAL 115 HA VAL 115 7.044 2.035 1.603 895 HB VAL 115 HB VAL 115 8.609 2.732 -0.112 896 HG11 VAL 115 HG11 VAL 115 6.203 3.550 -0.038 897 HG12 VAL 115 HG12 VAL 115 7.314 4.435 -1.083 898 HG13 VAL 115 HG13 VAL 115 6.862 5.100 0.486 899 HG21 VAL 115 HG21 VAL 115 9.624 4.988 -0.036 900 HG22 VAL 115 HG22 VAL 115 10.241 3.911 1.217 901 HG23 VAL 115 HG23 VAL 115 9.059 5.155 1.626 902 H THR 116 H THR 116 8.615 0.471 1.261 903 HA THR 116 HA THR 116 10.896 0.530 3.127 904 HB THR 116 HB THR 116 9.092 -1.763 2.333 905 HG1 THR 116 HG1 THR 116 8.639 -1.832 4.481 906 HG21 THR 116 HG21 THR 116 11.282 -2.704 2.290 907 HG22 THR 116 HG22 THR 116 10.501 -3.184 3.797 908 HG23 THR 116 HG23 THR 116 11.711 -1.901 3.801 909 H ARG 117 H ARG 117 12.495 1.138 1.735 910 HA ARG 117 HA ARG 117 12.661 0.016 -0.918 911 HB2 ARG 117 HB3 ARG 117 13.460 2.386 0.157 912 HB3 ARG 117 HB2 ARG 117 14.981 1.506 0.119 913 HG2 ARG 117 HG3 ARG 117 15.127 1.592 -2.119 914 HG3 ARG 117 HG2 ARG 117 13.394 1.349 -2.347 915 HD2 ARG 117 HD3 ARG 117 14.301 3.593 -3.068 916 HD3 ARG 117 HD2 ARG 117 12.927 3.634 -1.964 917 HE ARG 117 HE ARG 117 14.266 4.606 -0.378 918 HH11 ARG 117 HH11 ARG 117 16.272 3.313 -2.924 919 HH12 ARG 117 HH12 ARG 117 17.720 4.054 -2.330 920 HH21 ARG 117 HH21 ARG 117 16.169 5.582 0.404 921 HH22 ARG 117 HH22 ARG 117 17.662 5.342 -0.441 922 H LEU 118 H LEU 118 13.278 -2.037 -1.079 923 HA LEU 118 HA LEU 118 15.020 -3.346 0.734 924 HB2 LEU 118 HB3 LEU 118 13.515 -4.009 -1.670 925 HB3 LEU 118 HB2 LEU 118 15.067 -4.823 -1.619 926 HG LEU 118 HG LEU 118 14.429 -5.615 0.708 927 HD11 LEU 118 HD11 LEU 118 11.586 -5.314 0.032 928 HD12 LEU 118 HD12 LEU 118 12.408 -3.832 0.518 929 HD13 LEU 118 HD13 LEU 118 12.400 -5.229 1.594 930 HD21 LEU 118 HD21 LEU 118 12.449 -6.730 -1.186 931 HD22 LEU 118 HD22 LEU 118 13.638 -7.547 -0.171 932 HD23 LEU 118 HD23 LEU 118 14.144 -6.774 -1.674 933 H ALA 119 H ALA 119 17.120 -4.257 0.243 934 HA ALA 119 HA ALA 119 18.830 -2.336 -1.063 935 HB1 ALA 119 HB1 ALA 119 20.096 -3.053 0.634 936 HB2 ALA 119 HB2 ALA 119 20.440 -4.457 -0.377 937 HB3 ALA 119 HB3 ALA 119 19.152 -4.531 0.826 938 H GLY 120 H GLY 120 18.077 -5.786 -1.491 939 HA2 GLY 120 HA3 GLY 120 19.678 -6.205 -3.756 940 HA3 GLY 120 HA2 GLY 120 18.275 -7.165 -3.313 941 H SER 121 H SER 121 19.198 -6.323 -5.952 942 HA SER 121 HA SER 121 17.086 -4.480 -6.795 943 HB2 SER 121 HB3 SER 121 19.760 -4.895 -7.634 944 HB3 SER 121 HB2 SER 121 18.724 -5.371 -8.980 945 HG SER 121 HG SER 121 18.342 -2.943 -7.586 946 H PHE 122 H PHE 122 15.288 -5.174 -7.746 947 HA PHE 122 HA PHE 122 15.258 -7.895 -8.875 948 HB2 PHE 122 HB3 PHE 122 13.003 -6.556 -7.367 949 HB3 PHE 122 HB2 PHE 122 12.972 -8.173 -8.061 950 HD1 PHE 122 HD2 PHE 122 15.048 -6.151 -5.707 951 HD2 PHE 122 HD1 PHE 122 13.345 -9.936 -6.647 952 HE1 PHE 122 HE2 PHE 122 15.926 -7.066 -3.599 953 HE2 PHE 122 HE1 PHE 122 14.218 -10.857 -4.539 954 HZ PHE 122 HZ PHE 122 15.512 -9.422 -3.012 955 H GLU 123 H GLU 123 13.556 -8.253 -10.493 956 HA GLU 123 HA GLU 123 12.742 -5.795 -11.883 957 HB2 GLU 123 HB3 GLU 123 13.313 -6.787 -14.032 958 HB3 GLU 123 HB2 GLU 123 14.734 -6.712 -12.999 959 HG2 GLU 123 HG3 GLU 123 13.629 -9.206 -12.483 960 HG3 GLU 123 HG2 GLU 123 13.457 -8.991 -14.224 961 H GLY 124 H GLY 124 10.700 -5.793 -12.665 962 HA2 GLY 124 HA3 GLY 124 9.267 -8.294 -13.045 963 HA3 GLY 124 HA2 GLY 124 8.676 -7.276 -11.741 964 H ASP 125 H ASP 125 6.825 -6.413 -12.430 965 HA ASP 125 HA ASP 125 6.895 -4.753 -14.822 966 HB2 ASP 125 HB3 ASP 125 5.932 -7.249 -15.135 967 HB3 ASP 125 HB2 ASP 125 4.467 -6.440 -14.589 968 H THR 126 H THR 126 6.724 -4.322 -11.911 969 HA THR 126 HA THR 126 4.415 -2.552 -11.961 970 HB THR 126 HB THR 126 4.606 -3.930 -9.387 971 HG1 THR 126 HG1 THR 126 3.789 -5.396 -11.673 972 HG21 THR 126 HG21 THR 126 2.423 -3.181 -11.282 973 HG22 THR 126 HG22 THR 126 2.705 -2.637 -9.628 974 HG23 THR 126 HG23 THR 126 2.121 -4.273 -9.932 975 H LYS 127 H LYS 127 5.478 -0.690 -11.714 976 HA LYS 127 HA LYS 127 7.347 -0.453 -9.445 977 HB2 LYS 127 HB3 LYS 127 8.400 1.416 -10.769 978 HB3 LYS 127 HB2 LYS 127 8.623 -0.193 -11.441 979 HG2 LYS 127 HG3 LYS 127 7.116 0.194 -13.181 980 HG3 LYS 127 HG2 LYS 127 6.401 1.589 -12.370 981 HD2 LYS 127 HD3 LYS 127 7.732 2.807 -13.702 982 HD3 LYS 127 HD2 LYS 127 9.024 2.336 -12.597 983 HE2 LYS 127 HE3 LYS 127 10.031 1.533 -14.430 984 HE3 LYS 127 HE2 LYS 127 8.907 0.185 -14.270 985 HZ1 LYS 127 HZ1 LYS 127 7.425 1.225 -15.816 986 HZ2 LYS 127 HZ2 LYS 127 8.962 1.159 -16.518 987 HZ3 LYS 127 HZ3 LYS 127 8.383 2.618 -15.889 988 H MET 128 H MET 128 7.512 1.820 -8.601 989 HA MET 128 HA MET 128 4.944 2.743 -7.854 990 HB2 MET 128 HB3 MET 128 7.037 2.938 -6.478 991 HB3 MET 128 HB2 MET 128 7.563 4.219 -7.561 992 HG2 MET 128 HG3 MET 128 6.570 5.065 -5.482 993 HG3 MET 128 HG2 MET 128 5.703 5.597 -6.921 994 HE1 MET 128 HE1 MET 128 2.918 5.234 -4.160 995 HE2 MET 128 HE2 MET 128 3.453 6.261 -5.490 996 HE3 MET 128 HE3 MET 128 4.534 5.940 -4.134 997 H ILE 129 H ILE 129 4.218 5.019 -8.091 998 HA ILE 129 HA ILE 129 4.615 5.910 -10.865 999 HB ILE 129 HB ILE 129 2.455 7.055 -10.654 1000 HG12 ILE 129 HG13 ILE 129 1.147 6.080 -8.502 1001 HG13 ILE 129 HG12 ILE 129 2.768 6.212 -7.828 1002 HG21 ILE 129 HG21 ILE 129 1.438 4.531 -9.793 1003 HG22 ILE 129 HG22 ILE 129 2.897 4.270 -10.750 1004 HG23 ILE 129 HG23 ILE 129 1.550 5.186 -11.427 1005 HD11 ILE 129 HD11 ILE 129 1.362 8.194 -7.426 1006 HD12 ILE 129 HD12 ILE 129 1.290 8.461 -9.167 1007 HD13 ILE 129 HD13 ILE 129 2.836 8.557 -8.324 1008 HA PRO 130 HA PRO 130 6.478 9.705 -9.596 1009 HB2 PRO 130 HB3 PRO 130 5.444 11.466 -11.400 1010 HB3 PRO 130 HB2 PRO 130 6.693 10.283 -11.805 1011 HG2 PRO 130 HG3 PRO 130 3.739 10.151 -12.268 1012 HG3 PRO 130 HG2 PRO 130 5.064 9.699 -13.357 1013 HD2 PRO 130 HD3 PRO 130 3.672 7.866 -11.950 1014 HD3 PRO 130 HD2 PRO 130 5.399 7.668 -12.309 1015 H LEU 131 H LEU 131 6.038 10.980 -7.917 1016 HA LEU 131 HA LEU 131 3.326 12.103 -7.659 1017 HB2 LEU 131 HB3 LEU 131 4.793 11.586 -5.157 1018 HB3 LEU 131 HB2 LEU 131 3.089 11.402 -5.519 1019 HG LEU 131 HG LEU 131 4.429 9.367 -6.954 1020 HD11 LEU 131 HD11 LEU 131 5.297 8.269 -4.683 1021 HD12 LEU 131 HD12 LEU 131 5.659 9.959 -4.334 1022 HD13 LEU 131 HD13 LEU 131 6.343 9.189 -5.765 1023 HD21 LEU 131 HD21 LEU 131 2.813 8.100 -6.045 1024 HD22 LEU 131 HD22 LEU 131 2.174 9.641 -5.472 1025 HD23 LEU 131 HD23 LEU 131 3.165 8.645 -4.405 1026 H ASN 132 H ASN 132 3.286 13.960 -6.046 1027 HA ASN 132 HA ASN 132 5.357 15.837 -6.782 1028 HB2 ASN 132 HB3 ASN 132 2.710 16.149 -6.311 1029 HB3 ASN 132 HB2 ASN 132 3.351 16.595 -4.733 1030 HD21 ASN 132 HD21 ASN 132 5.652 17.863 -5.330 1031 HD22 ASN 132 HD22 ASN 132 5.337 19.286 -6.256 1032 H TRP 133 H TRP 133 7.050 14.570 -5.712 1033 HA TRP 133 HA TRP 133 7.155 14.093 -2.970 1034 HB2 TRP 133 HB3 TRP 133 9.399 14.534 -4.942 1035 HB3 TRP 133 HB2 TRP 133 9.621 13.925 -3.302 1036 HD1 TRP 133 HD1 TRP 133 8.061 12.922 -6.665 1037 HE1 TRP 133 HE1 TRP 133 7.785 10.362 -6.711 1038 HE3 TRP 133 HE3 TRP 133 9.455 11.876 -1.862 1039 HZ2 TRP 133 HZ2 TRP 133 8.131 8.186 -4.943 1040 HZ3 TRP 133 HZ3 TRP 133 9.459 9.531 -1.118 1041 HH2 TRP 133 HH2 TRP 133 8.809 7.725 -2.628 1042 H ASP 134 H ASP 134 8.067 17.020 -4.786 1043 HA ASP 134 HA ASP 134 9.475 18.322 -2.778 1044 HB2 ASP 134 HB3 ASP 134 8.111 19.065 -5.256 1045 HB3 ASP 134 HB2 ASP 134 8.091 20.351 -4.053 1046 H ASP 135 H ASP 135 5.990 18.205 -3.390 1047 HA ASP 135 HA ASP 135 5.322 19.972 -1.249 1048 HB2 ASP 135 HB3 ASP 135 3.899 18.447 -3.296 1049 HB3 ASP 135 HB2 ASP 135 3.037 18.499 -1.760 1050 H PHE 136 H PHE 136 6.585 16.946 -1.132 1051 HA PHE 136 HA PHE 136 5.229 16.349 1.412 1052 HB2 PHE 136 HB3 PHE 136 6.072 14.520 -0.812 1053 HB3 PHE 136 HB2 PHE 136 5.989 13.917 0.839 1054 HD1 PHE 136 HD2 PHE 136 3.852 16.075 -1.339 1055 HD2 PHE 136 HD1 PHE 136 4.087 12.739 1.291 1056 HE1 PHE 136 HE2 PHE 136 1.435 15.702 -1.604 1057 HE2 PHE 136 HE1 PHE 136 1.670 12.358 1.030 1058 HZ PHE 136 HZ PHE 136 0.341 13.841 -0.418 1059 H THR 137 H THR 137 6.487 16.097 3.144 1060 HA THR 137 HA THR 137 9.405 16.091 2.725 1061 HB THR 137 HB THR 137 7.749 17.296 4.946 1062 HG1 THR 137 HG1 THR 137 9.377 18.352 2.895 1063 HG21 THR 137 HG21 THR 137 9.867 18.170 5.848 1064 HG22 THR 137 HG22 THR 137 10.744 17.122 4.734 1065 HG23 THR 137 HG23 THR 137 9.723 16.418 5.989 1066 H LYS 138 H LYS 138 10.675 14.676 3.827 1067 HA LYS 138 HA LYS 138 9.530 12.252 4.700 1068 HB2 LYS 138 HB3 LYS 138 11.850 12.591 3.742 1069 HB3 LYS 138 HB2 LYS 138 12.323 13.205 5.321 1070 HG2 LYS 138 HG3 LYS 138 12.523 11.160 6.162 1071 HG3 LYS 138 HG2 LYS 138 10.961 10.657 5.518 1072 HD2 LYS 138 HD3 LYS 138 12.174 9.308 4.197 1073 HD3 LYS 138 HD2 LYS 138 12.474 10.769 3.255 1074 HE2 LYS 138 HE3 LYS 138 14.311 10.613 5.461 1075 HE3 LYS 138 HE2 LYS 138 14.362 9.122 4.521 1076 HZ1 LYS 138 HZ1 LYS 138 14.437 10.816 2.542 1077 HZ2 LYS 138 HZ2 LYS 138 15.846 10.386 3.373 1078 HZ3 LYS 138 HZ3 LYS 138 15.072 11.848 3.723 1079 H VAL 139 H VAL 139 8.611 11.782 6.567 1080 HA VAL 139 HA VAL 139 8.940 13.573 8.836 1081 HB VAL 139 HB VAL 139 7.214 11.130 8.927 1082 HG11 VAL 139 HG11 VAL 139 5.780 12.677 10.254 1083 HG12 VAL 139 HG12 VAL 139 7.038 13.903 10.091 1084 HG13 VAL 139 HG13 VAL 139 7.377 12.399 10.948 1085 HG21 VAL 139 HG21 VAL 139 5.363 12.562 7.970 1086 HG22 VAL 139 HG22 VAL 139 6.569 11.988 6.818 1087 HG23 VAL 139 HG23 VAL 139 6.624 13.653 7.397 1088 H SER 140 H SER 140 9.731 10.302 7.860 1089 HA SER 140 HA SER 140 11.566 10.091 10.096 1090 HB2 SER 140 HB3 SER 140 9.093 9.094 10.557 1091 HB3 SER 140 HB2 SER 140 9.864 7.686 9.827 1092 HG SER 140 HG SER 140 11.501 7.852 11.402 1093 H SER 141 H SER 141 13.059 8.315 9.891 1094 HA SER 141 HA SER 141 13.057 6.787 7.435 1095 HB2 SER 141 HB3 SER 141 15.491 7.651 7.006 1096 HB3 SER 141 HB2 SER 141 14.119 8.600 6.435 1097 HG SER 141 HG SER 141 16.024 9.267 8.218 1098 H ARG 142 H ARG 142 13.781 4.824 7.894 1099 HA ARG 142 HA ARG 142 15.885 4.500 9.911 1100 HB2 ARG 142 HB3 ARG 142 13.687 4.098 10.993 1101 HB3 ARG 142 HB2 ARG 142 13.366 2.831 9.818 1102 HG2 ARG 142 HG3 ARG 142 14.099 1.712 11.733 1103 HG3 ARG 142 HG2 ARG 142 15.496 1.726 10.655 1104 HD2 ARG 142 HD3 ARG 142 16.651 2.582 12.357 1105 HD3 ARG 142 HD2 ARG 142 15.746 4.073 12.100 1106 HE ARG 142 HE ARG 142 14.359 2.208 13.770 1107 HH11 ARG 142 HH11 ARG 142 16.813 4.689 13.734 1108 HH12 ARG 142 HH12 ARG 142 16.614 5.085 15.408 1109 HH21 ARG 142 HH21 ARG 142 14.095 2.728 15.971 1110 HH22 ARG 142 HH22 ARG 142 15.071 3.972 16.679 1111 H THR 143 H THR 143 17.244 2.737 9.596 1112 HA THR 143 HA THR 143 16.852 1.287 7.061 1113 HB THR 143 HB THR 143 19.528 1.986 8.268 1114 HG1 THR 143 HG1 THR 143 18.342 3.876 7.661 1115 HG21 THR 143 HG21 THR 143 18.896 0.236 6.233 1116 HG22 THR 143 HG22 THR 143 20.473 0.960 6.547 1117 HG23 THR 143 HG23 THR 143 19.372 1.713 5.394 1118 H VAL 144 H VAL 144 16.334 -0.748 7.497 1119 HA VAL 144 HA VAL 144 17.617 -2.080 9.782 1120 HB VAL 144 HB VAL 144 15.663 -3.810 9.094 1121 HG11 VAL 144 HG11 VAL 144 15.886 -1.614 11.049 1122 HG12 VAL 144 HG12 VAL 144 15.646 -3.342 11.303 1123 HG13 VAL 144 HG13 VAL 144 14.284 -2.321 10.843 1124 HG21 VAL 144 HG21 VAL 144 14.485 -1.091 8.543 1125 HG22 VAL 144 HG22 VAL 144 13.613 -2.623 8.594 1126 HG23 VAL 144 HG23 VAL 144 14.803 -2.328 7.327 1127 H GLU 145 H GLU 145 18.939 -3.767 9.440 1128 HA GLU 145 HA GLU 145 19.011 -4.929 6.734 1129 HB2 GLU 145 HB3 GLU 145 21.507 -5.252 7.197 1130 HB3 GLU 145 HB2 GLU 145 20.960 -3.624 6.821 1131 HG2 GLU 145 HG3 GLU 145 21.565 -2.831 8.811 1132 HG3 GLU 145 HG2 GLU 145 20.933 -4.234 9.670 1133 H ASP 146 H ASP 146 19.407 -7.109 6.557 1134 HA ASP 146 HA ASP 146 19.193 -8.636 9.064 1135 HB2 ASP 146 HB3 ASP 146 17.870 -8.859 6.468 1136 HB3 ASP 146 HB2 ASP 146 18.563 -10.385 7.008 1137 H THR 147 H THR 147 19.917 -11.121 8.261 1138 HA THR 147 HA THR 147 22.713 -11.043 8.326 1139 HB THR 147 HB THR 147 22.306 -13.525 7.392 1140 HG1 THR 147 HG1 THR 147 20.151 -13.315 6.923 1141 HG21 THR 147 HG21 THR 147 21.465 -14.070 9.820 1142 HG22 THR 147 HG22 THR 147 21.915 -12.389 10.103 1143 HG23 THR 147 HG23 THR 147 23.118 -13.536 9.515 1144 H ASN 148 H ASN 148 20.463 -11.464 5.642 1145 HA ASN 148 HA ASN 148 22.653 -11.614 3.730 1146 HB2 ASN 148 HB3 ASN 148 19.672 -11.947 3.534 1147 HB3 ASN 148 HB2 ASN 148 20.648 -11.727 2.085 1148 HD21 ASN 148 HD21 ASN 148 19.553 -13.903 4.433 1149 HD22 ASN 148 HD22 ASN 148 20.464 -15.282 3.929 1150 HA PRO 149 HA PRO 149 22.664 -7.248 2.911 1151 HB2 PRO 149 HB3 PRO 149 23.487 -7.959 0.165 1152 HB3 PRO 149 HB2 PRO 149 24.338 -7.000 1.380 1153 HG2 PRO 149 HG3 PRO 149 25.156 -9.464 0.730 1154 HG3 PRO 149 HG2 PRO 149 25.261 -8.856 2.390 1155 HD2 PRO 149 HD3 PRO 149 23.263 -10.727 1.186 1156 HD3 PRO 149 HD2 PRO 149 24.051 -10.787 2.777 1157 H ALA 150 H ALA 150 21.066 -9.544 0.843 1158 HA ALA 150 HA ALA 150 19.637 -7.600 -0.709 1159 HB1 ALA 150 HB1 ALA 150 20.055 -9.686 -1.750 1160 HB2 ALA 150 HB2 ALA 150 18.318 -9.609 -1.458 1161 HB3 ALA 150 HB3 ALA 150 19.348 -10.578 -0.404 1162 H LEU 151 H LEU 151 19.160 -9.100 2.365 1163 HA LEU 151 HA LEU 151 16.309 -8.541 2.387 1164 HB2 LEU 151 HB3 LEU 151 18.181 -9.805 4.371 1165 HB3 LEU 151 HB2 LEU 151 16.528 -9.398 4.788 1166 HG LEU 151 HG LEU 151 17.508 -11.464 2.838 1167 HD11 LEU 151 HD11 LEU 151 16.577 -12.988 4.243 1168 HD12 LEU 151 HD12 LEU 151 15.316 -11.883 4.789 1169 HD13 LEU 151 HD13 LEU 151 16.956 -11.729 5.418 1170 HD21 LEU 151 HD21 LEU 151 15.851 -10.643 1.491 1171 HD22 LEU 151 HD22 LEU 151 14.918 -9.998 2.842 1172 HD23 LEU 151 HD23 LEU 151 14.905 -11.730 2.508 1173 H THR 152 H THR 152 18.741 -6.524 2.523 1174 HA THR 152 HA THR 152 18.128 -5.113 4.972 1175 HB THR 152 HB THR 152 19.819 -4.136 2.669 1176 HG1 THR 152 HG1 THR 152 20.669 -5.644 4.913 1177 HG21 THR 152 HG21 THR 152 19.493 -3.322 5.506 1178 HG22 THR 152 HG22 THR 152 19.713 -2.335 4.061 1179 HG23 THR 152 HG23 THR 152 21.085 -3.193 4.760 1180 H HIS 153 H HIS 153 16.492 -3.733 5.176 1181 HA HIS 153 HA HIS 153 15.549 -2.314 2.771 1182 HB2 HIS 153 HB3 HIS 153 13.572 -2.845 4.914 1183 HB3 HIS 153 HB2 HIS 153 13.360 -2.814 3.168 1184 HD1 HIS 153 HD1 HIS 153 12.615 -5.070 5.503 1185 HD2 HIS 153 HD2 HIS 153 15.339 -5.300 2.375 1186 HE1 HIS 153 HE1 HIS 153 12.928 -7.525 5.064 1187 HE2 HIS 153 HE2 HIS 153 14.509 -7.638 3.107 1188 H THR 154 H THR 154 14.251 -0.339 3.316 1189 HA THR 154 HA THR 154 15.102 0.918 5.827 1190 HB THR 154 HB THR 154 15.327 2.213 3.103 1191 HG1 THR 154 HG1 THR 154 17.326 1.333 4.911 1192 HG21 THR 154 HG21 THR 154 14.849 3.599 5.305 1193 HG22 THR 154 HG22 THR 154 15.962 4.162 4.059 1194 HG23 THR 154 HG23 THR 154 16.586 3.380 5.511 1195 H TYR 155 H TYR 155 13.407 1.717 6.863 1196 HA TYR 155 HA TYR 155 10.910 2.156 5.419 1197 HB2 TYR 155 HB3 TYR 155 11.675 1.677 8.250 1198 HB3 TYR 155 HB2 TYR 155 10.248 2.669 7.974 1199 HD1 TYR 155 HD1 TYR 155 8.347 1.707 6.619 1200 HD2 TYR 155 HD2 TYR 155 11.588 -0.667 8.018 1201 HE1 TYR 155 HE1 TYR 155 6.997 -0.321 6.286 1202 HE2 TYR 155 HE2 TYR 155 10.248 -2.702 7.688 1203 HH TYR 155 HH TYR 155 7.542 -3.135 7.636 1204 H GLU 156 H GLU 156 10.053 4.123 5.016 1205 HA GLU 156 HA GLU 156 11.203 6.450 6.389 1206 HB2 GLU 156 HB3 GLU 156 11.058 5.964 3.435 1207 HB3 GLU 156 HB2 GLU 156 10.983 7.605 4.060 1208 HG2 GLU 156 HG3 GLU 156 13.144 7.510 4.919 1209 HG3 GLU 156 HG2 GLU 156 13.189 5.748 4.861 1210 H VAL 157 H VAL 157 9.837 8.169 6.705 1211 HA VAL 157 HA VAL 157 7.016 7.707 6.001 1212 HB VAL 157 HB VAL 157 7.999 9.425 8.278 1213 HG11 VAL 157 HG11 VAL 157 5.533 8.776 8.978 1214 HG12 VAL 157 HG12 VAL 157 5.339 8.586 7.234 1215 HG13 VAL 157 HG13 VAL 157 5.856 10.134 7.902 1216 HG21 VAL 157 HG21 VAL 157 7.684 7.656 9.782 1217 HG22 VAL 157 HG22 VAL 157 8.572 6.936 8.440 1218 HG23 VAL 157 HG23 VAL 157 6.834 6.675 8.588 1219 H TRP 158 H TRP 158 5.777 9.445 5.325 1220 HA TRP 158 HA TRP 158 7.136 11.967 4.737 1221 HB2 TRP 158 HB3 TRP 158 5.796 10.293 2.610 1222 HB3 TRP 158 HB2 TRP 158 6.352 11.946 2.384 1223 HD1 TRP 158 HD1 TRP 158 7.816 8.460 3.227 1224 HE1 TRP 158 HE1 TRP 158 10.214 8.360 2.295 1225 HE3 TRP 158 HE3 TRP 158 8.223 13.260 1.516 1226 HZ2 TRP 158 HZ2 TRP 158 12.035 10.088 1.003 1227 HZ3 TRP 158 HZ3 TRP 158 10.325 13.957 0.444 1228 HH2 TRP 158 HH2 TRP 158 12.191 12.402 0.194 1229 H GLN 159 H GLN 159 5.858 13.713 4.876 1230 HA GLN 159 HA GLN 159 2.947 13.353 4.839 1231 HB2 GLN 159 HB3 GLN 159 4.613 14.260 7.113 1232 HB3 GLN 159 HB2 GLN 159 3.165 15.205 6.798 1233 HG2 GLN 159 HG3 GLN 159 2.562 12.398 6.714 1234 HG3 GLN 159 HG2 GLN 159 3.370 12.813 8.225 1235 HE21 GLN 159 HE21 GLN 159 2.493 14.841 9.281 1236 HE22 GLN 159 HE22 GLN 159 0.774 15.011 9.311 1237 H LYS 160 H LYS 160 2.001 14.813 3.555 1238 HA LYS 160 HA LYS 160 3.420 16.735 2.124 1239 HB2 LYS 160 HB3 LYS 160 1.227 15.746 1.463 1240 HB3 LYS 160 HB2 LYS 160 0.452 16.738 2.690 1241 HG2 LYS 160 HG3 LYS 160 1.975 18.514 1.170 1242 HG3 LYS 160 HG2 LYS 160 1.232 17.416 0.006 1243 HD2 LYS 160 HD3 LYS 160 -0.952 17.836 1.249 1244 HD3 LYS 160 HD2 LYS 160 -0.115 19.172 2.042 1245 HE2 LYS 160 HE3 LYS 160 0.121 19.070 -0.894 1246 HE3 LYS 160 HE2 LYS 160 -1.492 19.409 -0.268 1247 HZ1 LYS 160 HZ1 LYS 160 0.332 21.286 -0.672 1248 HZ2 LYS 160 HZ2 LYS 160 0.696 20.901 0.934 1249 HZ3 LYS 160 HZ3 LYS 160 -0.863 21.410 0.519 1250 H LYS 161 H LYS 161 3.620 18.945 2.271 1251 HA LYS 161 HA LYS 161 3.740 20.038 4.885 1252 HB2 LYS 161 HB3 LYS 161 3.911 21.427 2.205 1253 HB3 LYS 161 HB2 LYS 161 4.360 22.137 3.749 1254 HG2 LYS 161 HG3 LYS 161 6.170 20.600 4.008 1255 HG3 LYS 161 HG2 LYS 161 5.652 19.676 2.596 1256 HD2 LYS 161 HD3 LYS 161 7.460 21.017 1.872 1257 HD3 LYS 161 HD2 LYS 161 6.002 21.791 1.250 1258 HE2 LYS 161 HE3 LYS 161 6.183 23.084 3.569 1259 HE3 LYS 161 HE2 LYS 161 7.888 22.692 3.354 1260 HZ1 LYS 161 HZ1 LYS 161 6.747 24.855 2.329 1261 HZ2 LYS 161 HZ2 LYS 161 6.529 23.791 1.033 1262 HZ3 LYS 161 HZ3 LYS 161 8.085 24.096 1.623 1263 H ALA 162 H ALA 162 2.183 20.930 6.056 1264 HA ALA 162 HA ALA 162 0.229 21.915 6.675 1265 HB1 ALA 162 HB1 ALA 162 -0.751 23.344 4.568 1266 HB2 ALA 162 HB2 ALA 162 0.966 23.247 4.175 1267 HB3 ALA 162 HB3 ALA 162 0.452 23.929 5.718 1268 H51A NDP 170 H51A NDP 170 -5.149 -1.598 -11.715 1269 H52A NDP 170 H52A NDP 170 -5.291 -0.377 -10.436 1270 H4B NDP 170 H4B NDP 170 -7.608 -1.780 -11.825 1271 H3B NDP 170 H3B NDP 170 -6.537 1.037 -12.077 1272 HO3A NDP 170 HO3A NDP 170 -6.123 -0.488 -13.761 1273 H2B NDP 170 H2B NDP 170 -8.805 1.755 -12.385 1274 H1B NDP 170 H1B NDP 170 -9.855 0.268 -10.310 1275 H8A NDP 170 H8A NDP 170 -6.320 1.740 -9.919 1276 H61A NDP 170 H61A NDP 170 -7.633 5.647 -7.326 1277 H62A NDP 170 H62A NDP 170 -9.171 6.231 -6.737 1278 H2A NDP 170 H2A NDP 170 -12.321 3.538 -8.461 1279 H51N NDP 170 H51N NDP 170 -1.422 -4.201 -7.641 1280 H52N NDP 170 H52N NDP 170 -0.634 -3.251 -8.913 1281 H4D NDP 170 H4D NDP 170 0.781 -5.252 -9.468 1282 H3D NDP 170 H3D NDP 170 -0.658 -6.517 -7.124 1283 HO3N NDP 170 HO3N NDP 170 -1.212 -7.734 -8.778 1284 H2D NDP 170 H2D NDP 170 1.403 -7.612 -6.592 1285 HO2N NDP 170 HO2N NDP 170 2.052 -7.081 -9.243 1286 H1D NDP 170 H1D NDP 170 3.003 -5.381 -6.950 1287 H2N NDP 170 H2N NDP 170 3.533 -5.263 -4.611 1288 H71N NDP 170 H71N NDP 170 5.351 -4.791 -1.990 1289 H72N NDP 170 H72N NDP 170 4.896 -5.400 -3.560 1290 H41N NDP 170 H41N NDP 170 0.533 -3.856 -2.395 1291 H42N NDP 170 H42N NDP 170 0.460 -5.629 -2.106 1292 H5N NDP 170 H5N NDP 170 -1.331 -4.888 -3.673 1293 H6N NDP 170 H6N NDP 170 -0.599 -5.317 -6.025 Start of MODEL 18 1 H1 THR 1 HT1 THR 1 -5.151 8.787 5.933 2 H2 THR 1 HT2 THR 1 -5.933 10.068 5.101 3 H3 THR 1 HT3 THR 1 -4.320 10.260 5.655 4 HA THR 1 HA THR 1 -5.062 8.159 3.758 5 HB THR 1 HB THR 1 -3.880 10.213 2.304 6 HG1 THR 1 HG1 THR 1 -4.461 11.569 4.162 7 HG21 THR 1 HG21 THR 1 -5.603 9.892 0.946 8 HG22 THR 1 HG22 THR 1 -6.773 10.331 2.191 9 HG23 THR 1 HG23 THR 1 -6.152 8.682 2.107 10 H ALA 2 H ALA 2 -3.425 6.779 4.046 11 HA ALA 2 HA ALA 2 -0.690 7.859 3.978 12 HB1 ALA 2 HB1 ALA 2 -1.129 7.290 6.280 13 HB2 ALA 2 HB2 ALA 2 0.002 6.122 5.596 14 HB3 ALA 2 HB3 ALA 2 -1.694 5.686 5.812 15 H PHE 3 H PHE 3 0.884 6.483 3.055 16 HA PHE 3 HA PHE 3 -0.246 4.338 1.375 17 HB2 PHE 3 HB3 PHE 3 1.719 6.498 0.835 18 HB3 PHE 3 HB2 PHE 3 2.037 4.937 0.090 19 HD1 PHE 3 HD1 PHE 3 -1.266 6.503 0.722 20 HD2 PHE 3 HD2 PHE 3 1.655 5.384 -2.163 21 HE1 PHE 3 HE1 PHE 3 -2.846 7.048 -1.083 22 HE2 PHE 3 HE2 PHE 3 0.081 5.927 -3.973 23 HZ PHE 3 HZ PHE 3 -2.172 6.761 -3.435 24 H LEU 4 H LEU 4 0.477 2.331 1.777 25 HA LEU 4 HA LEU 4 3.147 2.022 2.960 26 HB2 LEU 4 HB3 LEU 4 1.613 1.830 4.793 27 HB3 LEU 4 HB2 LEU 4 0.594 0.726 3.892 28 HG LEU 4 HG LEU 4 2.379 -0.968 3.954 29 HD11 LEU 4 HD11 LEU 4 4.229 -0.496 5.668 30 HD12 LEU 4 HD12 LEU 4 3.836 1.205 5.416 31 HD13 LEU 4 HD13 LEU 4 4.384 0.217 4.062 32 HD21 LEU 4 HD21 LEU 4 1.748 -1.721 5.990 33 HD22 LEU 4 HD22 LEU 4 0.617 -0.373 5.875 34 HD23 LEU 4 HD23 LEU 4 2.113 -0.192 6.791 35 H TRP 5 H TRP 5 4.329 0.880 1.583 36 HA TRP 5 HA TRP 5 3.419 -1.681 0.665 37 HB2 TRP 5 HB3 TRP 5 3.254 -1.330 -1.621 38 HB3 TRP 5 HB2 TRP 5 2.520 0.133 -0.979 39 HD1 TRP 5 HD1 TRP 5 5.561 -1.093 -2.914 40 HE1 TRP 5 HE1 TRP 5 6.799 0.938 -3.896 41 HE3 TRP 5 HE3 TRP 5 2.994 2.638 -0.550 42 HZ2 TRP 5 HZ2 TRP 5 6.701 3.752 -3.694 43 HZ3 TRP 5 HZ3 TRP 5 3.628 4.975 -1.001 44 HH2 TRP 5 HH2 TRP 5 5.443 5.518 -2.540 45 H ALA 6 H ALA 6 5.112 -2.901 -0.444 46 HA ALA 6 HA ALA 6 7.765 -2.025 0.460 47 HB1 ALA 6 HB1 ALA 6 7.151 -4.162 1.327 48 HB2 ALA 6 HB2 ALA 6 8.391 -4.423 0.101 49 HB3 ALA 6 HB3 ALA 6 6.699 -4.746 -0.274 50 H GLN 7 H GLN 7 9.538 -1.940 -0.919 51 HA GLN 7 HA GLN 7 9.184 -2.626 -3.718 52 HB2 GLN 7 HB3 GLN 7 9.900 -0.353 -4.468 53 HB3 GLN 7 HB2 GLN 7 8.302 -0.397 -3.734 54 HG2 GLN 7 HG3 GLN 7 10.219 0.114 -1.696 55 HG3 GLN 7 HG2 GLN 7 10.516 1.213 -3.042 56 HE21 GLN 7 HE21 GLN 7 7.993 0.011 -0.886 57 HE22 GLN 7 HE22 GLN 7 7.044 1.455 -0.900 58 H ASP 8 H ASP 8 11.184 -2.422 -4.977 59 HA ASP 8 HA ASP 8 13.480 -3.067 -3.301 60 HB2 ASP 8 HB3 ASP 8 14.497 -3.967 -5.307 61 HB3 ASP 8 HB2 ASP 8 12.853 -4.579 -5.169 62 H ARG 9 H ARG 9 15.584 -2.401 -4.935 63 HA ARG 9 HA ARG 9 16.062 0.256 -4.229 64 HB2 ARG 9 HB3 ARG 9 17.473 -1.854 -5.657 65 HB3 ARG 9 HB2 ARG 9 17.862 -0.252 -6.266 66 HG2 ARG 9 HG3 ARG 9 18.134 0.287 -3.703 67 HG3 ARG 9 HG2 ARG 9 18.401 -1.455 -3.606 68 HD2 ARG 9 HD3 ARG 9 20.330 -1.365 -4.852 69 HD3 ARG 9 HD2 ARG 9 19.850 0.112 -5.685 70 HE ARG 9 HE ARG 9 20.222 0.685 -2.965 71 HH11 ARG 9 HH11 ARG 9 22.079 -0.193 -5.786 72 HH12 ARG 9 HH12 ARG 9 23.517 0.605 -5.243 73 HH21 ARG 9 HH21 ARG 9 22.112 1.736 -2.249 74 HH22 ARG 9 HH22 ARG 9 23.536 1.700 -3.235 75 H ASP 10 H ASP 10 14.697 -1.065 -7.170 76 HA ASP 10 HA ASP 10 14.992 1.463 -8.576 77 HB2 ASP 10 HB3 ASP 10 13.966 -1.257 -9.304 78 HB3 ASP 10 HB2 ASP 10 13.527 0.129 -10.297 79 H GLY 11 H GLY 11 12.540 -0.416 -6.968 80 HA2 GLY 11 HA3 GLY 11 10.828 1.128 -5.884 81 HA3 GLY 11 HA2 GLY 11 10.564 1.707 -7.521 82 H LEU 12 H LEU 12 11.247 -1.573 -7.598 83 HA LEU 12 HA LEU 12 8.865 -2.416 -8.657 84 HB2 LEU 12 HB3 LEU 12 11.180 -3.621 -8.261 85 HB3 LEU 12 HB2 LEU 12 10.367 -4.265 -6.851 86 HG LEU 12 HG LEU 12 8.645 -5.280 -8.302 87 HD11 LEU 12 HD11 LEU 12 10.342 -4.222 -10.563 88 HD12 LEU 12 HD12 LEU 12 8.724 -3.665 -10.137 89 HD13 LEU 12 HD13 LEU 12 8.964 -5.311 -10.722 90 HD21 LEU 12 HD21 LEU 12 10.237 -6.847 -7.855 91 HD22 LEU 12 HD22 LEU 12 11.537 -5.900 -8.578 92 HD23 LEU 12 HD23 LEU 12 10.395 -6.762 -9.610 93 H ILE 13 H ILE 13 7.447 -4.188 -7.563 94 HA ILE 13 HA ILE 13 6.920 -3.771 -4.770 95 HB ILE 13 HB ILE 13 4.602 -3.119 -4.973 96 HG12 ILE 13 HG13 ILE 13 4.808 -2.392 -7.842 97 HG13 ILE 13 HG12 ILE 13 4.610 -4.102 -7.484 98 HG21 ILE 13 HG21 ILE 13 6.396 -1.399 -4.838 99 HG22 ILE 13 HG22 ILE 13 4.897 -0.825 -5.567 100 HG23 ILE 13 HG23 ILE 13 6.282 -1.213 -6.588 101 HD11 ILE 13 HD11 ILE 13 2.462 -3.127 -7.853 102 HD12 ILE 13 HD12 ILE 13 2.782 -1.864 -6.666 103 HD13 ILE 13 HD13 ILE 13 2.607 -3.539 -6.144 104 H GLY 14 H GLY 14 6.160 -5.289 -7.831 105 HA2 GLY 14 HA3 GLY 14 5.786 -7.810 -6.463 106 HA3 GLY 14 HA2 GLY 14 4.375 -7.216 -7.326 107 H LYS 15 H LYS 15 5.091 -9.516 -8.192 108 HA LYS 15 HA LYS 15 6.635 -9.028 -10.647 109 HB2 LYS 15 HB3 LYS 15 7.545 -11.221 -10.580 110 HB3 LYS 15 HB2 LYS 15 7.775 -10.546 -8.976 111 HG2 LYS 15 HG3 LYS 15 5.431 -12.308 -9.608 112 HG3 LYS 15 HG2 LYS 15 7.000 -12.971 -9.164 113 HD2 LYS 15 HD3 LYS 15 6.628 -12.568 -7.010 114 HD3 LYS 15 HD2 LYS 15 6.230 -10.881 -7.338 115 HE2 LYS 15 HE3 LYS 15 4.298 -11.776 -6.353 116 HE3 LYS 15 HE2 LYS 15 3.949 -11.742 -8.081 117 HZ1 LYS 15 HZ1 LYS 15 5.167 -14.199 -7.295 118 HZ2 LYS 15 HZ2 LYS 15 3.711 -13.936 -8.113 119 HZ3 LYS 15 HZ3 LYS 15 3.746 -13.910 -6.423 120 H ASP 16 H ASP 16 3.930 -8.529 -10.458 121 HA ASP 16 HA ASP 16 2.182 -8.803 -11.949 122 HB2 ASP 16 HB3 ASP 16 3.879 -10.479 -13.162 123 HB3 ASP 16 HB2 ASP 16 2.762 -11.671 -12.504 124 H GLY 17 H GLY 17 2.395 -9.373 -9.112 125 HA2 GLY 17 HA3 GLY 17 -0.194 -10.416 -8.666 126 HA3 GLY 17 HA2 GLY 17 1.008 -11.642 -8.281 127 H HIS 18 H HIS 18 3.010 -10.292 -7.125 128 HA HIS 18 HA HIS 18 2.311 -8.294 -5.275 129 HB2 HIS 18 HB3 HIS 18 2.192 -9.570 -3.207 130 HB3 HIS 18 HB2 HIS 18 0.932 -10.115 -4.308 131 HD1 HIS 18 HD1 HIS 18 3.383 -11.415 -2.090 132 HD2 HIS 18 HD2 HIS 18 1.917 -12.559 -5.806 133 HE1 HIS 18 HE1 HIS 18 3.983 -13.845 -2.330 134 HE2 HIS 18 HE2 HIS 18 3.008 -14.538 -4.548 135 H LEU 19 H LEU 19 3.995 -8.688 -3.211 136 HA LEU 19 HA LEU 19 6.529 -8.276 -4.376 137 HB2 LEU 19 HB3 LEU 19 7.364 -8.342 -2.022 138 HB3 LEU 19 HB2 LEU 19 6.053 -7.213 -2.307 139 HG LEU 19 HG LEU 19 4.571 -9.235 -1.464 140 HD11 LEU 19 HD11 LEU 19 5.670 -10.963 -0.624 141 HD12 LEU 19 HD12 LEU 19 6.464 -9.899 0.538 142 HD13 LEU 19 HD13 LEU 19 7.206 -10.200 -1.034 143 HD21 LEU 19 HD21 LEU 19 4.343 -8.092 0.509 144 HD22 LEU 19 HD22 LEU 19 5.137 -6.866 -0.482 145 HD23 LEU 19 HD23 LEU 19 6.077 -7.811 0.674 146 HA PRO 20 HA PRO 20 7.734 -12.576 -4.612 147 HB2 PRO 20 HB3 PRO 20 9.958 -12.252 -6.036 148 HB3 PRO 20 HB2 PRO 20 8.374 -11.924 -6.747 149 HG2 PRO 20 HG3 PRO 20 10.415 -10.010 -5.706 150 HG3 PRO 20 HG2 PRO 20 9.377 -9.875 -7.136 151 HD2 PRO 20 HD3 PRO 20 8.888 -8.687 -4.664 152 HD3 PRO 20 HD2 PRO 20 7.680 -8.951 -5.936 153 H TRP 21 H TRP 21 8.820 -10.519 -2.401 154 HA TRP 21 HA TRP 21 11.139 -12.199 -1.693 155 HB2 TRP 21 HB3 TRP 21 11.962 -10.183 -0.423 156 HB3 TRP 21 HB2 TRP 21 11.954 -10.005 -2.176 157 HD1 TRP 21 HD1 TRP 21 9.534 -9.155 0.745 158 HE1 TRP 21 HE1 TRP 21 8.456 -6.878 0.233 159 HE3 TRP 21 HE3 TRP 21 11.693 -8.240 -3.797 160 HZ2 TRP 21 HZ2 TRP 21 8.511 -4.945 -1.826 161 HZ3 TRP 21 HZ3 TRP 21 11.127 -6.154 -4.973 162 HH2 TRP 21 HH2 TRP 21 9.568 -4.543 -4.008 163 H HIS 22 H HIS 22 11.340 -12.909 0.403 164 HA HIS 22 HA HIS 22 8.892 -12.814 1.987 165 HB2 HIS 22 HB3 HIS 22 10.276 -14.950 1.410 166 HB3 HIS 22 HB2 HIS 22 11.324 -14.416 2.721 167 HD1 HIS 22 HD1 HIS 22 10.772 -15.601 4.806 168 HD2 HIS 22 HD2 HIS 22 7.382 -14.872 2.516 169 HE1 HIS 22 HE1 HIS 22 8.853 -16.546 6.127 170 HE2 HIS 22 HE2 HIS 22 6.823 -16.170 4.683 171 H LEU 23 H LEU 23 8.853 -10.908 3.076 172 HA LEU 23 HA LEU 23 11.195 -10.254 4.738 173 HB2 LEU 23 HB3 LEU 23 9.379 -8.642 3.117 174 HB3 LEU 23 HB2 LEU 23 9.557 -8.025 4.749 175 HG LEU 23 HG LEU 23 12.102 -8.236 4.309 176 HD11 LEU 23 HD11 LEU 23 11.444 -7.753 1.467 177 HD12 LEU 23 HD12 LEU 23 11.393 -9.423 2.033 178 HD13 LEU 23 HD13 LEU 23 12.875 -8.481 2.196 179 HD21 LEU 23 HD21 LEU 23 12.154 -5.992 3.391 180 HD22 LEU 23 HD22 LEU 23 10.866 -6.128 4.588 181 HD23 LEU 23 HD23 LEU 23 10.477 -6.144 2.868 182 HA PRO 24 HA PRO 24 8.220 -11.866 7.856 183 HB2 PRO 24 HB3 PRO 24 10.694 -11.442 9.459 184 HB3 PRO 24 HB2 PRO 24 9.601 -12.830 9.421 185 HG2 PRO 24 HG3 PRO 24 11.974 -12.940 8.221 186 HG3 PRO 24 HG2 PRO 24 10.545 -13.688 7.484 187 HD2 PRO 24 HD3 PRO 24 11.932 -11.141 6.776 188 HD3 PRO 24 HD2 PRO 24 11.151 -12.334 5.719 189 H ASP 25 H ASP 25 10.511 -9.176 8.181 190 HA ASP 25 HA ASP 25 9.243 -7.930 10.363 191 HB2 ASP 25 HB3 ASP 25 10.553 -5.913 9.548 192 HB3 ASP 25 HB2 ASP 25 11.496 -7.344 9.928 193 H ASP 26 H ASP 26 8.925 -7.526 6.862 194 HA ASP 26 HA ASP 26 7.208 -5.283 6.960 195 HB2 ASP 26 HB3 ASP 26 8.555 -6.334 4.967 196 HB3 ASP 26 HB2 ASP 26 7.078 -7.261 4.715 197 H LEU 27 H LEU 27 6.598 -8.764 6.872 198 HA LEU 27 HA LEU 27 3.800 -8.610 6.540 199 HB2 LEU 27 HB3 LEU 27 5.246 -10.798 8.015 200 HB3 LEU 27 HB2 LEU 27 3.737 -10.911 7.130 201 HG LEU 27 HG LEU 27 6.117 -10.108 5.561 202 HD11 LEU 27 HD11 LEU 27 6.378 -12.258 7.290 203 HD12 LEU 27 HD12 LEU 27 7.352 -11.933 5.856 204 HD13 LEU 27 HD13 LEU 27 5.945 -12.990 5.744 205 HD21 LEU 27 HD21 LEU 27 4.249 -10.331 4.243 206 HD22 LEU 27 HD22 LEU 27 3.609 -11.676 5.187 207 HD23 LEU 27 HD23 LEU 27 4.967 -11.934 4.091 208 H HIS 28 H HIS 28 5.635 -9.405 9.496 209 HA HIS 28 HA HIS 28 3.518 -9.272 11.281 210 HB2 HIS 28 HB3 HIS 28 5.887 -10.094 11.711 211 HB3 HIS 28 HB2 HIS 28 6.329 -8.407 11.959 212 HD1 HIS 28 HD1 HIS 28 3.395 -10.462 13.264 213 HD2 HIS 28 HD2 HIS 28 6.489 -8.046 14.627 214 HE1 HIS 28 HE1 HIS 28 3.085 -10.314 15.756 215 HE2 HIS 28 HE2 HIS 28 4.915 -8.774 16.546 216 H TYR 29 H TYR 29 5.742 -6.682 10.296 217 HA TYR 29 HA TYR 29 4.668 -4.683 11.960 218 HB2 TYR 29 HB3 TYR 29 6.877 -4.639 10.691 219 HB3 TYR 29 HB2 TYR 29 5.942 -4.190 9.269 220 HD1 TYR 29 HD1 TYR 29 6.535 -3.133 12.798 221 HD2 TYR 29 HD2 TYR 29 5.549 -1.945 8.834 222 HE1 TYR 29 HE1 TYR 29 6.635 -0.774 13.487 223 HE2 TYR 29 HE2 TYR 29 5.647 0.417 9.511 224 HH TYR 29 HH TYR 29 6.781 1.767 11.327 225 H PHE 30 H PHE 30 3.731 -5.878 8.809 226 HA PHE 30 HA PHE 30 2.062 -3.771 8.009 227 HB2 PHE 30 HB3 PHE 30 2.786 -5.568 6.496 228 HB3 PHE 30 HB2 PHE 30 1.806 -6.722 7.393 229 HD1 PHE 30 HD2 PHE 30 1.584 -3.608 5.385 230 HD2 PHE 30 HD1 PHE 30 -0.413 -7.083 6.812 231 HE1 PHE 30 HE2 PHE 30 -0.334 -3.096 3.933 232 HE2 PHE 30 HE1 PHE 30 -2.334 -6.580 5.361 233 HZ PHE 30 HZ PHE 30 -2.298 -4.583 3.920 234 H ARG 31 H ARG 31 1.081 -6.901 9.421 235 HA ARG 31 HA ARG 31 -1.578 -6.048 9.932 236 HB2 ARG 31 HB3 ARG 31 -0.699 -8.442 9.659 237 HB3 ARG 31 HB2 ARG 31 -0.198 -8.323 11.340 238 HG2 ARG 31 HG3 ARG 31 -2.373 -8.248 12.121 239 HG3 ARG 31 HG2 ARG 31 -3.019 -7.714 10.567 240 HD2 ARG 31 HD3 ARG 31 -3.619 -9.854 10.298 241 HD3 ARG 31 HD2 ARG 31 -1.919 -10.127 9.922 242 HE ARG 31 HE ARG 31 -1.691 -11.242 11.910 243 HH11 ARG 31 HH11 ARG 31 -4.686 -9.450 11.953 244 HH12 ARG 31 HH12 ARG 31 -5.240 -10.170 13.428 245 HH21 ARG 31 HH21 ARG 31 -2.418 -12.189 13.849 246 HH22 ARG 31 HH22 ARG 31 -3.953 -11.724 14.505 247 H ALA 32 H ALA 32 1.388 -5.875 11.736 248 HA ALA 32 HA ALA 32 0.248 -5.495 14.308 249 HB1 ALA 32 HB1 ALA 32 2.949 -4.999 13.122 250 HB2 ALA 32 HB2 ALA 32 2.469 -6.146 14.373 251 HB3 ALA 32 HB3 ALA 32 2.565 -4.425 14.745 252 H GLN 33 H GLN 33 0.927 -3.359 11.630 253 HA GLN 33 HA GLN 33 0.385 -0.996 13.253 254 HB2 GLN 33 HB3 GLN 33 1.801 -1.535 10.781 255 HB3 GLN 33 HB2 GLN 33 0.675 -0.198 10.590 256 HG2 GLN 33 HG3 GLN 33 2.232 -0.042 13.045 257 HG3 GLN 33 HG2 GLN 33 3.220 -0.032 11.585 258 HE21 GLN 33 HE21 GLN 33 2.282 1.450 9.826 259 HE22 GLN 33 HE22 GLN 33 1.791 3.019 10.358 260 H THR 34 H THR 34 -1.130 -3.030 10.876 261 HA THR 34 HA THR 34 -3.314 -1.132 10.485 262 HB THR 34 HB THR 34 -4.145 -2.816 8.846 263 HG1 THR 34 HG1 THR 34 -1.698 -4.151 9.338 264 HG21 THR 34 HG21 THR 34 -1.283 -1.976 8.466 265 HG22 THR 34 HG22 THR 34 -2.724 -1.080 7.986 266 HG23 THR 34 HG23 THR 34 -2.332 -2.609 7.198 267 H VAL 35 H VAL 35 -3.061 -2.147 13.101 268 HA VAL 35 HA VAL 35 -5.082 -4.221 13.383 269 HB VAL 35 HB VAL 35 -3.652 -2.740 15.589 270 HG11 VAL 35 HG11 VAL 35 -5.277 -3.826 16.726 271 HG12 VAL 35 HG12 VAL 35 -4.168 -5.188 16.561 272 HG13 VAL 35 HG13 VAL 35 -5.526 -5.017 15.449 273 HG21 VAL 35 HG21 VAL 35 -2.046 -3.817 14.056 274 HG22 VAL 35 HG22 VAL 35 -2.870 -5.356 14.306 275 HG23 VAL 35 HG23 VAL 35 -2.058 -4.561 15.655 276 H GLY 36 H GLY 36 -7.046 -3.345 12.878 277 HA2 GLY 36 HA3 GLY 36 -9.045 -2.403 13.686 278 HA3 GLY 36 HA2 GLY 36 -8.106 -1.425 14.803 279 H LYS 37 H LYS 37 -7.176 -1.568 11.465 280 HA LYS 37 HA LYS 37 -8.277 1.140 11.074 281 HB2 LYS 37 HB3 LYS 37 -5.669 0.006 10.045 282 HB3 LYS 37 HB2 LYS 37 -6.314 1.586 9.621 283 HG2 LYS 37 HG3 LYS 37 -6.181 2.265 11.970 284 HG3 LYS 37 HG2 LYS 37 -5.511 0.684 12.380 285 HD2 LYS 37 HD3 LYS 37 -3.504 1.114 11.302 286 HD3 LYS 37 HD2 LYS 37 -4.207 2.367 10.278 287 HE2 LYS 37 HE3 LYS 37 -4.248 3.928 12.040 288 HE3 LYS 37 HE2 LYS 37 -3.978 2.681 13.257 289 HZ1 LYS 37 HZ1 LYS 37 -1.937 3.105 11.192 290 HZ2 LYS 37 HZ2 LYS 37 -1.758 2.575 12.788 291 HZ3 LYS 37 HZ3 LYS 37 -2.040 4.212 12.468 292 H ILE 38 H ILE 38 -7.947 1.596 8.495 293 HA ILE 38 HA ILE 38 -9.251 -0.663 7.125 294 HB ILE 38 HB ILE 38 -9.927 1.791 5.821 295 HG12 ILE 38 HG13 ILE 38 -10.966 1.734 8.649 296 HG13 ILE 38 HG12 ILE 38 -9.535 2.662 8.215 297 HG21 ILE 38 HG21 ILE 38 -12.044 0.419 7.295 298 HG22 ILE 38 HG22 ILE 38 -11.055 -0.649 6.300 299 HG23 ILE 38 HG23 ILE 38 -11.878 0.727 5.568 300 HD11 ILE 38 HD11 ILE 38 -12.373 3.084 7.416 301 HD12 ILE 38 HD12 ILE 38 -11.067 3.692 6.399 302 HD13 ILE 38 HD13 ILE 38 -11.207 4.231 8.072 303 H MET 39 H MET 39 -8.308 -1.348 5.314 304 HA MET 39 HA MET 39 -6.249 0.374 4.096 305 HB2 MET 39 HB3 MET 39 -5.234 -1.556 5.136 306 HB3 MET 39 HB2 MET 39 -6.359 -2.637 4.326 307 HG2 MET 39 HG3 MET 39 -4.733 -0.909 2.578 308 HG3 MET 39 HG2 MET 39 -3.867 -2.159 3.468 309 HE1 MET 39 HE1 MET 39 -4.890 -4.471 3.748 310 HE2 MET 39 HE2 MET 39 -5.376 -5.422 2.345 311 HE3 MET 39 HE3 MET 39 -6.590 -4.556 3.287 312 H VAL 40 H VAL 40 -6.383 0.818 1.980 313 HA VAL 40 HA VAL 40 -8.673 -0.245 0.505 314 HB VAL 40 HB VAL 40 -6.807 1.979 -0.325 315 HG11 VAL 40 HG11 VAL 40 -9.621 1.806 -1.233 316 HG12 VAL 40 HG12 VAL 40 -8.483 0.639 -1.907 317 HG13 VAL 40 HG13 VAL 40 -8.184 2.368 -2.087 318 HG21 VAL 40 HG21 VAL 40 -8.076 2.308 1.878 319 HG22 VAL 40 HG22 VAL 40 -9.528 2.374 0.879 320 HG23 VAL 40 HG23 VAL 40 -8.241 3.555 0.643 321 H VAL 41 H VAL 41 -8.504 -1.503 -1.275 322 HA VAL 41 HA VAL 41 -5.810 -2.028 -2.327 323 HB VAL 41 HB VAL 41 -7.085 -3.828 -0.753 324 HG11 VAL 41 HG11 VAL 41 -7.746 -4.688 -3.565 325 HG12 VAL 41 HG12 VAL 41 -8.917 -4.110 -2.381 326 HG13 VAL 41 HG13 VAL 41 -8.028 -5.603 -2.085 327 HG21 VAL 41 HG21 VAL 41 -5.653 -5.472 -2.409 328 HG22 VAL 41 HG22 VAL 41 -4.991 -4.520 -1.080 329 HG23 VAL 41 HG23 VAL 41 -4.942 -3.890 -2.727 330 H GLY 42 H GLY 42 -5.707 -2.707 -4.527 331 HA2 GLY 42 HA3 GLY 42 -7.835 -1.560 -6.134 332 HA3 GLY 42 HA2 GLY 42 -6.279 -2.132 -6.717 333 H ARG 43 H ARG 43 -8.495 -2.704 -8.169 334 HA ARG 43 HA ARG 43 -9.939 -4.978 -7.614 335 HB2 ARG 43 HB3 ARG 43 -10.424 -3.592 -9.539 336 HB3 ARG 43 HB2 ARG 43 -8.886 -4.019 -10.275 337 HG2 ARG 43 HG3 ARG 43 -9.738 -6.431 -10.223 338 HG3 ARG 43 HG2 ARG 43 -11.323 -5.722 -9.911 339 HD2 ARG 43 HD3 ARG 43 -9.562 -5.044 -12.262 340 HD3 ARG 43 HD2 ARG 43 -10.910 -6.180 -12.306 341 HE ARG 43 HE ARG 43 -11.557 -3.519 -11.373 342 HH11 ARG 43 HH11 ARG 43 -11.384 -5.678 -14.115 343 HH12 ARG 43 HH12 ARG 43 -12.532 -4.781 -15.049 344 HH21 ARG 43 HH21 ARG 43 -13.067 -2.350 -12.599 345 HH22 ARG 43 HH22 ARG 43 -13.487 -2.890 -14.189 346 H ARG 44 H ARG 44 -6.994 -4.900 -9.624 347 HA ARG 44 HA ARG 44 -6.661 -7.661 -9.807 348 HB2 ARG 44 HB3 ARG 44 -4.564 -5.494 -9.902 349 HB3 ARG 44 HB2 ARG 44 -4.354 -7.139 -10.489 350 HG2 ARG 44 HG3 ARG 44 -6.372 -5.175 -11.554 351 HG3 ARG 44 HG2 ARG 44 -4.798 -5.503 -12.280 352 HD2 ARG 44 HD3 ARG 44 -5.477 -7.454 -13.170 353 HD3 ARG 44 HD2 ARG 44 -6.432 -7.884 -11.751 354 HE ARG 44 HE ARG 44 -7.892 -5.916 -12.857 355 HH11 ARG 44 HH11 ARG 44 -6.486 -8.824 -14.182 356 HH12 ARG 44 HH12 ARG 44 -7.705 -9.009 -15.397 357 HH21 ARG 44 HH21 ARG 44 -9.493 -6.157 -14.457 358 HH22 ARG 44 HH22 ARG 44 -9.412 -7.495 -15.554 359 H THR 45 H THR 45 -6.057 -5.549 -7.162 360 HA THR 45 HA THR 45 -4.065 -7.210 -5.924 361 HB THR 45 HB THR 45 -5.625 -5.177 -4.389 362 HG1 THR 45 HG1 THR 45 -5.255 -4.001 -6.183 363 HG21 THR 45 HG21 THR 45 -3.901 -6.153 -3.129 364 HG22 THR 45 HG22 THR 45 -3.286 -4.583 -3.646 365 HG23 THR 45 HG23 THR 45 -2.757 -6.051 -4.468 366 H TYR 46 H TYR 46 -7.510 -6.496 -5.204 367 HA TYR 46 HA TYR 46 -7.775 -8.132 -2.993 368 HB2 TYR 46 HB3 TYR 46 -10.133 -8.120 -3.342 369 HB3 TYR 46 HB2 TYR 46 -9.533 -6.569 -3.910 370 HD1 TYR 46 HD2 TYR 46 -10.188 -9.987 -5.316 371 HD2 TYR 46 HD1 TYR 46 -10.466 -5.773 -5.863 372 HE1 TYR 46 HE2 TYR 46 -11.291 -10.348 -7.469 373 HE2 TYR 46 HE1 TYR 46 -11.589 -6.132 -8.018 374 HH TYR 46 HH TYR 46 -12.836 -7.813 -9.193 375 H GLU 47 H GLU 47 -7.905 -9.010 -6.408 376 HA GLU 47 HA GLU 47 -8.493 -11.778 -5.843 377 HB2 GLU 47 HB3 GLU 47 -8.508 -10.070 -8.138 378 HB3 GLU 47 HB2 GLU 47 -7.495 -11.463 -8.489 379 HG2 GLU 47 HG3 GLU 47 -10.037 -12.109 -7.194 380 HG3 GLU 47 HG2 GLU 47 -10.188 -11.374 -8.788 381 H SER 48 H SER 48 -5.714 -9.800 -6.143 382 HA SER 48 HA SER 48 -3.960 -12.143 -6.401 383 HB2 SER 48 HB3 SER 48 -3.664 -10.185 -7.971 384 HB3 SER 48 HB2 SER 48 -3.148 -9.237 -6.576 385 HG SER 48 HG SER 48 -1.938 -11.687 -7.321 386 H PHE 49 H PHE 49 -5.421 -11.126 -3.931 387 HA PHE 49 HA PHE 49 -3.098 -10.602 -2.211 388 HB2 PHE 49 HB3 PHE 49 -5.436 -9.258 -2.281 389 HB3 PHE 49 HB2 PHE 49 -5.828 -10.474 -1.071 390 HD1 PHE 49 HD1 PHE 49 -3.073 -8.096 -1.913 391 HD2 PHE 49 HD2 PHE 49 -5.387 -9.982 1.122 392 HE1 PHE 49 HE1 PHE 49 -1.906 -6.770 -0.202 393 HE2 PHE 49 HE2 PHE 49 -4.222 -8.658 2.838 394 HZ PHE 49 HZ PHE 49 -2.480 -7.049 2.176 395 HA PRO 50 HA PRO 50 -3.532 -14.990 -1.217 396 HB2 PRO 50 HB3 PRO 50 -1.245 -14.419 0.555 397 HB3 PRO 50 HB2 PRO 50 -1.387 -15.594 -0.755 398 HG2 PRO 50 HG3 PRO 50 0.111 -13.387 -1.011 399 HG3 PRO 50 HG2 PRO 50 -0.802 -14.056 -2.377 400 HD2 PRO 50 HD3 PRO 50 -1.456 -11.717 -0.623 401 HD3 PRO 50 HD2 PRO 50 -1.637 -11.893 -2.381 402 H LYS 51 H LYS 51 -3.434 -12.284 0.998 403 HA LYS 51 HA LYS 51 -4.751 -13.976 3.022 404 HB2 LYS 51 HB3 LYS 51 -2.488 -13.238 3.703 405 HB3 LYS 51 HB2 LYS 51 -3.005 -11.565 3.536 406 HG2 LYS 51 HG3 LYS 51 -3.266 -11.858 5.781 407 HG3 LYS 51 HG2 LYS 51 -4.877 -12.308 5.217 408 HD2 LYS 51 HD3 LYS 51 -4.094 -14.693 5.187 409 HD3 LYS 51 HD2 LYS 51 -2.616 -14.148 5.982 410 HE2 LYS 51 HE3 LYS 51 -5.158 -13.290 7.215 411 HE3 LYS 51 HE2 LYS 51 -4.792 -15.012 7.307 412 HZ1 LYS 51 HZ1 LYS 51 -3.104 -14.664 8.727 413 HZ2 LYS 51 HZ2 LYS 51 -3.908 -13.214 9.060 414 HZ3 LYS 51 HZ3 LYS 51 -2.605 -13.229 7.982 415 H ARG 52 H ARG 52 -6.643 -13.217 1.596 416 HA ARG 52 HA ARG 52 -7.645 -10.674 2.688 417 HB2 ARG 52 HB3 ARG 52 -8.979 -10.406 0.630 418 HB3 ARG 52 HB2 ARG 52 -7.251 -10.419 0.310 419 HG2 ARG 52 HG3 ARG 52 -7.377 -12.251 -0.961 420 HG3 ARG 52 HG2 ARG 52 -8.510 -13.051 0.128 421 HD2 ARG 52 HD3 ARG 52 -9.486 -10.747 -1.477 422 HD3 ARG 52 HD2 ARG 52 -9.213 -12.279 -2.305 423 HE ARG 52 HE ARG 52 -10.698 -12.903 -0.079 424 HH11 ARG 52 HH11 ARG 52 -11.094 -10.827 -2.856 425 HH12 ARG 52 HH12 ARG 52 -12.819 -10.974 -2.876 426 HH21 ARG 52 HH21 ARG 52 -12.967 -13.098 -0.104 427 HH22 ARG 52 HH22 ARG 52 -13.883 -12.263 -1.314 428 HA PRO 53 HA PRO 53 -9.105 -9.717 3.394 429 HB2 PRO 53 HB3 PRO 53 -10.821 -9.507 5.578 430 HB3 PRO 53 HB2 PRO 53 -11.232 -9.127 3.906 431 HG2 PRO 53 HG3 PRO 53 -12.250 -11.249 5.508 432 HG3 PRO 53 HG2 PRO 53 -12.592 -10.920 3.803 433 HD2 PRO 53 HD3 PRO 53 -10.737 -12.879 5.010 434 HD3 PRO 53 HD2 PRO 53 -11.530 -12.899 3.422 435 H LEU 54 H LEU 54 -7.919 -8.638 5.003 436 HA LEU 54 HA LEU 54 -6.267 -10.290 6.609 437 HB2 LEU 54 HB3 LEU 54 -6.600 -7.294 6.594 438 HB3 LEU 54 HB2 LEU 54 -5.319 -8.154 7.427 439 HG LEU 54 HG LEU 54 -5.657 -8.571 4.490 440 HD11 LEU 54 HD11 LEU 54 -4.271 -6.650 3.999 441 HD12 LEU 54 HD12 LEU 54 -4.234 -6.209 5.706 442 HD13 LEU 54 HD13 LEU 54 -5.751 -6.136 4.809 443 HD21 LEU 54 HD21 LEU 54 -4.043 -9.946 5.584 444 HD22 LEU 54 HD22 LEU 54 -3.336 -8.557 6.409 445 HD23 LEU 54 HD23 LEU 54 -3.168 -8.724 4.661 446 HA PRO 55 HA PRO 55 -8.832 -10.556 10.226 447 HB2 PRO 55 HB3 PRO 55 -6.395 -11.197 11.727 448 HB3 PRO 55 HB2 PRO 55 -7.808 -12.203 11.398 449 HG2 PRO 55 HG3 PRO 55 -5.421 -12.664 10.240 450 HG3 PRO 55 HG2 PRO 55 -6.954 -12.985 9.409 451 HD2 PRO 55 HD3 PRO 55 -5.083 -10.665 9.106 452 HD3 PRO 55 HD2 PRO 55 -5.961 -11.577 7.860 453 H GLU 56 H GLU 56 -9.111 -9.672 12.320 454 HA GLU 56 HA GLU 56 -9.335 -7.837 13.654 455 HB2 GLU 56 HB3 GLU 56 -6.470 -8.618 13.680 456 HB3 GLU 56 HB2 GLU 56 -6.905 -7.112 14.477 457 HG2 GLU 56 HG3 GLU 56 -8.024 -8.153 16.144 458 HG3 GLU 56 HG2 GLU 56 -8.553 -9.481 15.112 459 H ARG 57 H ARG 57 -9.088 -7.175 10.769 460 HA ARG 57 HA ARG 57 -8.622 -4.349 11.164 461 HB2 ARG 57 HB3 ARG 57 -6.931 -4.016 9.599 462 HB3 ARG 57 HB2 ARG 57 -6.412 -5.459 10.452 463 HG2 ARG 57 HG3 ARG 57 -6.013 -6.060 8.283 464 HG3 ARG 57 HG2 ARG 57 -7.637 -6.704 8.516 465 HD2 ARG 57 HD3 ARG 57 -7.084 -5.330 6.378 466 HD3 ARG 57 HD2 ARG 57 -8.615 -5.076 7.209 467 HE ARG 57 HE ARG 57 -7.952 -2.945 7.702 468 HH11 ARG 57 HH11 ARG 57 -5.154 -4.794 6.742 469 HH12 ARG 57 HH12 ARG 57 -4.100 -3.421 6.714 470 HH21 ARG 57 HH21 ARG 57 -6.568 -1.137 7.668 471 HH22 ARG 57 HH22 ARG 57 -4.903 -1.344 7.241 472 H THR 58 H THR 58 -9.383 -3.036 9.348 473 HA THR 58 HA THR 58 -11.662 -4.337 8.058 474 HB THR 58 HB THR 58 -11.015 -1.388 8.154 475 HG1 THR 58 HG1 THR 58 -11.485 -1.557 10.182 476 HG21 THR 58 HG21 THR 58 -13.670 -2.752 7.801 477 HG22 THR 58 HG22 THR 58 -12.703 -2.093 6.481 478 HG23 THR 58 HG23 THR 58 -13.335 -1.022 7.732 479 H ASN 59 H ASN 59 -11.668 -4.824 5.960 480 HA ASN 59 HA ASN 59 -9.437 -3.876 4.318 481 HB2 ASN 59 HB3 ASN 59 -11.323 -6.211 4.077 482 HB3 ASN 59 HB2 ASN 59 -10.303 -5.703 2.734 483 HD21 ASN 59 HD21 ASN 59 -10.007 -6.317 6.217 484 HD22 ASN 59 HD22 ASN 59 -8.526 -7.197 6.110 485 H VAL 60 H VAL 60 -9.737 -3.024 2.249 486 HA VAL 60 HA VAL 60 -12.460 -2.232 1.511 487 HB VAL 60 HB VAL 60 -10.111 -0.344 1.724 488 HG11 VAL 60 HG11 VAL 60 -11.022 0.591 -0.115 489 HG12 VAL 60 HG12 VAL 60 -12.179 1.246 1.045 490 HG13 VAL 60 HG13 VAL 60 -12.579 -0.203 0.121 491 HG21 VAL 60 HG21 VAL 60 -10.968 -0.226 3.811 492 HG22 VAL 60 HG22 VAL 60 -12.550 -0.827 3.313 493 HG23 VAL 60 HG23 VAL 60 -12.119 0.860 3.031 494 H VAL 61 H VAL 61 -12.862 -2.610 -0.568 495 HA VAL 61 HA VAL 61 -10.596 -3.185 -2.344 496 HB VAL 61 HB VAL 61 -13.490 -4.031 -2.526 497 HG11 VAL 61 HG11 VAL 61 -12.802 -5.379 -4.459 498 HG12 VAL 61 HG12 VAL 61 -11.201 -4.642 -4.393 499 HG13 VAL 61 HG13 VAL 61 -12.614 -3.651 -4.758 500 HG21 VAL 61 HG21 VAL 61 -12.186 -5.211 -0.826 501 HG22 VAL 61 HG22 VAL 61 -10.980 -5.632 -2.043 502 HG23 VAL 61 HG23 VAL 61 -12.617 -6.277 -2.163 503 H LEU 62 H LEU 62 -10.505 -2.346 -4.431 504 HA LEU 62 HA LEU 62 -12.368 -0.151 -5.032 505 HB2 LEU 62 HB3 LEU 62 -10.100 0.596 -4.144 506 HB3 LEU 62 HB2 LEU 62 -9.420 -0.034 -5.632 507 HG LEU 62 HG LEU 62 -10.861 1.534 -6.913 508 HD11 LEU 62 HD11 LEU 62 -11.913 3.397 -5.683 509 HD12 LEU 62 HD12 LEU 62 -11.557 2.565 -4.169 510 HD13 LEU 62 HD13 LEU 62 -12.659 1.836 -5.338 511 HD21 LEU 62 HD21 LEU 62 -9.518 3.443 -5.194 512 HD22 LEU 62 HD22 LEU 62 -9.188 3.001 -6.868 513 HD23 LEU 62 HD23 LEU 62 -8.504 2.046 -5.555 514 H THR 63 H THR 63 -13.511 -1.186 -6.598 515 HA THR 63 HA THR 63 -12.038 -1.896 -9.033 516 HB THR 63 HB THR 63 -12.694 -3.979 -7.898 517 HG1 THR 63 HG1 THR 63 -13.053 -4.720 -9.809 518 HG21 THR 63 HG21 THR 63 -15.230 -2.602 -7.574 519 HG22 THR 63 HG22 THR 63 -14.572 -3.995 -6.715 520 HG23 THR 63 HG23 THR 63 -15.400 -4.219 -8.256 521 H HIS 64 H HIS 64 -13.015 -1.250 -10.948 522 HA HIS 64 HA HIS 64 -14.876 0.874 -10.790 523 HB2 HIS 64 HB3 HIS 64 -13.842 -0.727 -13.130 524 HB3 HIS 64 HB2 HIS 64 -14.962 0.614 -13.318 525 HD1 HIS 64 HD1 HIS 64 -14.041 3.003 -12.580 526 HD2 HIS 64 HD2 HIS 64 -11.207 -0.021 -12.856 527 HE1 HIS 64 HE1 HIS 64 -11.815 4.171 -12.646 528 HE2 HIS 64 HE2 HIS 64 -10.121 2.325 -12.905 529 H GLN 65 H GLN 65 -15.229 -2.555 -11.222 530 HA GLN 65 HA GLN 65 -17.679 -2.789 -12.446 531 HB2 GLN 65 HB3 GLN 65 -16.192 -4.415 -10.451 532 HB3 GLN 65 HB2 GLN 65 -17.890 -4.800 -10.697 533 HG2 GLN 65 HG3 GLN 65 -17.564 -5.489 -12.862 534 HG3 GLN 65 HG2 GLN 65 -16.106 -4.520 -13.064 535 HE21 GLN 65 HE21 GLN 65 -14.489 -5.228 -11.108 536 HE22 GLN 65 HE22 GLN 65 -14.126 -6.916 -11.149 537 H GLU 66 H GLU 66 -19.723 -2.326 -11.948 538 HA GLU 66 HA GLU 66 -20.280 -0.962 -9.461 539 HB2 GLU 66 HB3 GLU 66 -22.560 -0.670 -10.452 540 HB3 GLU 66 HB2 GLU 66 -21.255 -0.014 -11.430 541 HG2 GLU 66 HG3 GLU 66 -21.649 -2.676 -12.267 542 HG3 GLU 66 HG2 GLU 66 -23.241 -1.933 -12.129 543 H ASP 67 H ASP 67 -21.015 -4.035 -10.977 544 HA ASP 67 HA ASP 67 -22.737 -4.794 -8.744 545 HB2 ASP 67 HB3 ASP 67 -22.950 -5.300 -11.415 546 HB3 ASP 67 HB2 ASP 67 -22.206 -6.790 -10.843 547 H TYR 68 H TYR 68 -19.687 -4.541 -8.657 548 HA TYR 68 HA TYR 68 -18.709 -7.205 -8.324 549 HB2 TYR 68 HB3 TYR 68 -17.224 -5.302 -8.864 550 HB3 TYR 68 HB2 TYR 68 -17.562 -4.605 -7.283 551 HD1 TYR 68 HD1 TYR 68 -16.135 -7.624 -8.924 552 HD2 TYR 68 HD2 TYR 68 -16.264 -5.199 -5.431 553 HE1 TYR 68 HE1 TYR 68 -14.282 -8.922 -7.961 554 HE2 TYR 68 HE2 TYR 68 -14.409 -6.489 -4.462 555 HH TYR 68 HH TYR 68 -13.307 -9.436 -5.828 556 H GLN 69 H GLN 69 -18.432 -8.400 -6.470 557 HA GLN 69 HA GLN 69 -19.630 -7.295 -4.015 558 HB2 GLN 69 HB3 GLN 69 -19.857 -10.125 -5.053 559 HB3 GLN 69 HB2 GLN 69 -20.474 -9.560 -3.506 560 HG2 GLN 69 HG3 GLN 69 -21.372 -8.626 -6.223 561 HG3 GLN 69 HG2 GLN 69 -22.247 -9.718 -5.151 562 HE21 GLN 69 HE21 GLN 69 -21.729 -6.519 -6.049 563 HE22 GLN 69 HE22 GLN 69 -22.600 -5.752 -4.769 564 H ALA 70 H ALA 70 -17.940 -6.907 -2.725 565 HA ALA 70 HA ALA 70 -15.809 -8.920 -2.527 566 HB1 ALA 70 HB1 ALA 70 -15.504 -6.300 -2.910 567 HB2 ALA 70 HB2 ALA 70 -14.337 -7.270 -2.012 568 HB3 ALA 70 HB3 ALA 70 -15.541 -6.313 -1.148 569 H GLN 71 H GLN 71 -16.636 -10.414 -1.133 570 HA GLN 71 HA GLN 71 -18.057 -9.739 1.238 571 HB2 GLN 71 HB3 GLN 71 -16.651 -12.355 0.744 572 HB3 GLN 71 HB2 GLN 71 -18.093 -12.060 1.705 573 HG2 GLN 71 HG3 GLN 71 -19.400 -12.437 -0.036 574 HG3 GLN 71 HG2 GLN 71 -18.547 -11.231 -0.998 575 HE21 GLN 71 HE21 GLN 71 -16.996 -11.873 -2.442 576 HE22 GLN 71 HE22 GLN 71 -16.717 -13.527 -2.858 577 H GLY 72 H GLY 72 -17.269 -9.035 3.101 578 HA2 GLY 72 HA3 GLY 72 -15.823 -9.326 4.987 579 HA3 GLY 72 HA2 GLY 72 -14.566 -9.877 3.892 580 H ALA 73 H ALA 73 -15.199 -7.545 2.031 581 HA ALA 73 HA ALA 73 -14.018 -5.413 3.683 582 HB1 ALA 73 HB1 ALA 73 -12.271 -6.447 2.338 583 HB2 ALA 73 HB2 ALA 73 -12.588 -4.800 1.793 584 HB3 ALA 73 HB3 ALA 73 -13.217 -6.168 0.875 585 H VAL 74 H VAL 74 -14.131 -3.241 2.510 586 HA VAL 74 HA VAL 74 -16.879 -2.821 1.694 587 HB VAL 74 HB VAL 74 -14.757 -0.689 1.778 588 HG11 VAL 74 HG11 VAL 74 -17.140 -0.367 0.858 589 HG12 VAL 74 HG12 VAL 74 -16.516 0.815 2.009 590 HG13 VAL 74 HG13 VAL 74 -17.641 -0.432 2.548 591 HG21 VAL 74 HG21 VAL 74 -14.579 -1.862 3.890 592 HG22 VAL 74 HG22 VAL 74 -16.326 -1.779 4.115 593 HG23 VAL 74 HG23 VAL 74 -15.362 -0.302 4.140 594 H VAL 75 H VAL 75 -17.582 -2.263 -0.320 595 HA VAL 75 HA VAL 75 -15.563 -2.369 -2.456 596 HB VAL 75 HB VAL 75 -18.525 -2.932 -2.631 597 HG11 VAL 75 HG11 VAL 75 -18.065 -3.704 -4.890 598 HG12 VAL 75 HG12 VAL 75 -16.363 -3.281 -4.708 599 HG13 VAL 75 HG13 VAL 75 -17.590 -2.015 -4.712 600 HG21 VAL 75 HG21 VAL 75 -16.233 -4.574 -1.927 601 HG22 VAL 75 HG22 VAL 75 -17.127 -5.218 -3.304 602 HG23 VAL 75 HG23 VAL 75 -17.958 -4.915 -1.778 603 H VAL 76 H VAL 76 -15.246 -0.731 -3.778 604 HA VAL 76 HA VAL 76 -17.266 1.331 -4.145 605 HB VAL 76 HB VAL 76 -15.707 3.169 -3.722 606 HG11 VAL 76 HG11 VAL 76 -16.084 1.264 -1.419 607 HG12 VAL 76 HG12 VAL 76 -17.152 2.578 -1.912 608 HG13 VAL 76 HG13 VAL 76 -15.561 2.938 -1.241 609 HG21 VAL 76 HG21 VAL 76 -13.728 1.780 -2.173 610 HG22 VAL 76 HG22 VAL 76 -13.515 2.881 -3.536 611 HG23 VAL 76 HG23 VAL 76 -13.753 1.158 -3.824 612 H HIS 77 H HIS 77 -16.570 2.872 -5.930 613 HA HIS 77 HA HIS 77 -14.773 1.490 -7.812 614 HB2 HIS 77 HB3 HIS 77 -17.108 3.009 -8.877 615 HB3 HIS 77 HB2 HIS 77 -16.268 1.618 -9.556 616 HD1 HIS 77 HD1 HIS 77 -16.571 -0.383 -7.261 617 HD2 HIS 77 HD2 HIS 77 -19.644 2.063 -8.617 618 HE1 HIS 77 HE1 HIS 77 -18.698 -1.534 -6.574 619 HE2 HIS 77 HE2 HIS 77 -20.545 -0.076 -7.475 620 H ASP 78 H ASP 78 -15.552 4.435 -6.275 621 HA ASP 78 HA ASP 78 -13.592 5.797 -7.976 622 HB2 ASP 78 HB3 ASP 78 -16.237 7.011 -7.152 623 HB3 ASP 78 HB2 ASP 78 -14.963 7.823 -8.057 624 H VAL 79 H VAL 79 -12.743 7.795 -6.994 625 HA VAL 79 HA VAL 79 -11.891 7.353 -4.365 626 HB VAL 79 HB VAL 79 -11.156 9.820 -4.558 627 HG11 VAL 79 HG11 VAL 79 -10.181 7.428 -5.967 628 HG12 VAL 79 HG12 VAL 79 -9.365 8.473 -4.804 629 HG13 VAL 79 HG13 VAL 79 -9.495 8.966 -6.492 630 HG21 VAL 79 HG21 VAL 79 -12.832 9.757 -6.758 631 HG22 VAL 79 HG22 VAL 79 -11.212 9.685 -7.448 632 HG23 VAL 79 HG23 VAL 79 -11.654 11.011 -6.373 633 H ALA 80 H ALA 80 -14.431 9.375 -5.712 634 HA ALA 80 HA ALA 80 -15.040 10.809 -3.363 635 HB1 ALA 80 HB1 ALA 80 -16.680 10.127 -5.794 636 HB2 ALA 80 HB2 ALA 80 -15.896 11.657 -5.401 637 HB3 ALA 80 HB3 ALA 80 -17.297 11.121 -4.475 638 H ALA 81 H ALA 81 -16.357 7.817 -4.728 639 HA ALA 81 HA ALA 81 -18.334 7.290 -2.856 640 HB1 ALA 81 HB1 ALA 81 -17.096 4.822 -3.542 641 HB2 ALA 81 HB2 ALA 81 -17.048 5.877 -4.954 642 HB3 ALA 81 HB3 ALA 81 -18.588 5.519 -4.173 643 H VAL 82 H VAL 82 -15.080 5.804 -2.854 644 HA VAL 82 HA VAL 82 -15.173 4.716 -0.320 645 HB VAL 82 HB VAL 82 -13.404 4.416 -2.155 646 HG11 VAL 82 HG11 VAL 82 -11.389 5.775 -1.934 647 HG12 VAL 82 HG12 VAL 82 -12.195 6.778 -0.731 648 HG13 VAL 82 HG13 VAL 82 -12.779 6.753 -2.395 649 HG21 VAL 82 HG21 VAL 82 -11.721 3.698 -0.581 650 HG22 VAL 82 HG22 VAL 82 -13.323 3.328 0.057 651 HG23 VAL 82 HG23 VAL 82 -12.425 4.713 0.678 652 H PHE 83 H PHE 83 -14.525 8.023 -1.296 653 HA PHE 83 HA PHE 83 -13.365 8.938 1.091 654 HB2 PHE 83 HB3 PHE 83 -14.614 10.163 -1.281 655 HB3 PHE 83 HB2 PHE 83 -14.713 11.139 0.181 656 HD1 PHE 83 HD2 PHE 83 -12.226 10.667 1.535 657 HD2 PHE 83 HD1 PHE 83 -12.983 11.044 -2.636 658 HE1 PHE 83 HE2 PHE 83 -9.911 11.423 1.187 659 HE2 PHE 83 HE1 PHE 83 -10.668 11.800 -2.992 660 HZ PHE 83 HZ PHE 83 -9.129 11.991 -1.078 661 H ALA 84 H ALA 84 -16.765 8.787 0.070 662 HA ALA 84 HA ALA 84 -17.852 10.032 2.345 663 HB1 ALA 84 HB1 ALA 84 -19.211 9.692 0.379 664 HB2 ALA 84 HB2 ALA 84 -19.953 8.849 1.739 665 HB3 ALA 84 HB3 ALA 84 -19.050 7.942 0.526 666 H TYR 85 H TYR 85 -16.959 6.718 1.656 667 HA TYR 85 HA TYR 85 -17.995 5.557 4.010 668 HB2 TYR 85 HB3 TYR 85 -17.266 3.688 3.007 669 HB3 TYR 85 HB2 TYR 85 -16.490 4.671 1.775 670 HD1 TYR 85 HD1 TYR 85 -15.849 3.425 5.248 671 HD2 TYR 85 HD2 TYR 85 -14.239 4.394 1.436 672 HE1 TYR 85 HE1 TYR 85 -13.648 2.601 5.976 673 HE2 TYR 85 HE2 TYR 85 -12.032 3.571 2.152 674 HH TYR 85 HH TYR 85 -10.832 3.293 4.440 675 H ALA 86 H ALA 86 -14.608 6.449 3.257 676 HA ALA 86 HA ALA 86 -13.451 6.153 5.681 677 HB1 ALA 86 HB1 ALA 86 -12.210 6.870 3.728 678 HB2 ALA 86 HB2 ALA 86 -11.896 7.961 5.078 679 HB3 ALA 86 HB3 ALA 86 -12.991 8.450 3.785 680 H LYS 87 H LYS 87 -15.607 8.777 4.747 681 HA LYS 87 HA LYS 87 -15.159 10.362 7.070 682 HB2 LYS 87 HB3 LYS 87 -16.521 10.716 4.711 683 HB3 LYS 87 HB2 LYS 87 -17.838 10.514 5.858 684 HG2 LYS 87 HG3 LYS 87 -17.604 12.731 6.110 685 HG3 LYS 87 HG2 LYS 87 -16.301 12.266 7.207 686 HD2 LYS 87 HD3 LYS 87 -15.152 13.733 5.897 687 HD3 LYS 87 HD2 LYS 87 -14.915 12.270 4.939 688 HE2 LYS 87 HE3 LYS 87 -17.110 12.992 3.761 689 HE3 LYS 87 HE2 LYS 87 -16.760 14.576 4.451 690 HZ1 LYS 87 HZ1 LYS 87 -14.966 13.023 2.665 691 HZ2 LYS 87 HZ2 LYS 87 -14.604 14.529 3.344 692 HZ3 LYS 87 HZ3 LYS 87 -15.865 14.387 2.226 693 H GLN 88 H GLN 88 -17.566 7.973 6.139 694 HA GLN 88 HA GLN 88 -19.120 8.027 8.473 695 HB2 GLN 88 HB3 GLN 88 -19.458 6.829 6.141 696 HB3 GLN 88 HB2 GLN 88 -18.747 5.463 6.989 697 HG2 GLN 88 HG3 GLN 88 -20.536 5.216 8.386 698 HG3 GLN 88 HG2 GLN 88 -20.993 6.916 8.281 699 HE21 GLN 88 HE21 GLN 88 -21.530 7.529 5.879 700 HE22 GLN 88 HE22 GLN 88 -22.661 6.471 5.113 701 H HIS 89 H HIS 89 -15.992 6.731 7.898 702 HA HIS 89 HA HIS 89 -16.118 5.205 10.412 703 HB2 HIS 89 HB3 HIS 89 -14.643 4.812 7.861 704 HB3 HIS 89 HB2 HIS 89 -13.819 4.343 9.346 705 HD1 HIS 89 HD1 HIS 89 -16.203 3.149 10.891 706 HD2 HIS 89 HD2 HIS 89 -15.386 2.383 6.891 707 HE1 HIS 89 HE1 HIS 89 -17.315 0.950 10.388 708 HE2 HIS 89 HE2 HIS 89 -16.738 0.467 7.983 709 HA PRO 90 HA PRO 90 -13.374 8.850 11.277 710 HB2 PRO 90 HB3 PRO 90 -14.578 9.690 13.521 711 HB3 PRO 90 HB2 PRO 90 -15.201 10.117 11.922 712 HG2 PRO 90 HG3 PRO 90 -16.134 7.988 13.810 713 HG3 PRO 90 HG2 PRO 90 -17.094 9.132 12.853 714 HD2 PRO 90 HD3 PRO 90 -16.648 6.537 12.110 715 HD3 PRO 90 HD2 PRO 90 -16.954 7.851 10.958 716 H ASP 91 H ASP 91 -14.078 5.885 12.666 717 HA ASP 91 HA ASP 91 -12.273 6.257 14.939 718 HB2 ASP 91 HB3 ASP 91 -14.370 4.267 14.228 719 HB3 ASP 91 HB2 ASP 91 -13.042 3.730 15.252 720 H GLN 92 H GLN 92 -11.814 5.665 11.809 721 HA GLN 92 HA GLN 92 -9.491 3.962 12.345 722 HB2 GLN 92 HB3 GLN 92 -11.463 3.550 10.093 723 HB3 GLN 92 HB2 GLN 92 -9.910 2.735 10.220 724 HG2 GLN 92 HG3 GLN 92 -10.840 1.157 11.448 725 HG3 GLN 92 HG2 GLN 92 -11.260 2.355 12.671 726 HE21 GLN 92 HE21 GLN 92 -12.545 -0.068 11.106 727 HE22 GLN 92 HE22 GLN 92 -14.164 0.486 10.866 728 H GLU 93 H GLU 93 -8.049 3.897 10.304 729 HA GLU 93 HA GLU 93 -7.922 6.620 9.182 730 HB2 GLU 93 HB3 GLU 93 -6.107 5.955 10.825 731 HB3 GLU 93 HB2 GLU 93 -5.567 4.787 9.627 732 HG2 GLU 93 HG3 GLU 93 -5.078 6.537 8.060 733 HG3 GLU 93 HG2 GLU 93 -5.775 7.747 9.135 734 H LEU 94 H LEU 94 -6.833 6.776 7.061 735 HA LEU 94 HA LEU 94 -7.629 4.516 5.370 736 HB2 LEU 94 HB3 LEU 94 -7.562 7.429 5.052 737 HB3 LEU 94 HB2 LEU 94 -6.951 6.554 3.660 738 HG LEU 94 HG LEU 94 -9.077 5.270 3.582 739 HD11 LEU 94 HD11 LEU 94 -10.102 7.264 5.587 740 HD12 LEU 94 HD12 LEU 94 -9.593 5.632 6.018 741 HD13 LEU 94 HD13 LEU 94 -10.944 5.870 4.910 742 HD21 LEU 94 HD21 LEU 94 -8.783 8.153 3.118 743 HD22 LEU 94 HD22 LEU 94 -10.449 7.577 3.178 744 HD23 LEU 94 HD23 LEU 94 -9.313 6.873 2.027 745 H VAL 95 H VAL 95 -6.146 3.223 4.524 746 HA VAL 95 HA VAL 95 -3.452 4.267 4.018 747 HB VAL 95 HB VAL 95 -3.936 1.580 5.304 748 HG11 VAL 95 HG11 VAL 95 -1.893 1.958 3.847 749 HG12 VAL 95 HG12 VAL 95 -1.593 1.408 5.496 750 HG13 VAL 95 HG13 VAL 95 -1.355 3.104 5.075 751 HG21 VAL 95 HG21 VAL 95 -4.530 3.240 6.923 752 HG22 VAL 95 HG22 VAL 95 -3.094 4.193 6.549 753 HG23 VAL 95 HG23 VAL 95 -2.930 2.624 7.336 754 H ILE 96 H ILE 96 -2.634 3.675 2.102 755 HA ILE 96 HA ILE 96 -4.180 1.784 0.483 756 HB ILE 96 HB ILE 96 -1.975 3.613 -0.460 757 HG12 ILE 96 HG13 ILE 96 -3.726 4.985 0.519 758 HG13 ILE 96 HG12 ILE 96 -3.795 5.112 -1.236 759 HG21 ILE 96 HG21 ILE 96 -2.575 1.670 -1.886 760 HG22 ILE 96 HG22 ILE 96 -2.870 3.230 -2.653 761 HG23 ILE 96 HG23 ILE 96 -4.217 2.305 -1.990 762 HD11 ILE 96 HD11 ILE 96 -5.573 3.356 0.439 763 HD12 ILE 96 HD12 ILE 96 -5.676 3.604 -1.305 764 HD13 ILE 96 HD13 ILE 96 -6.011 4.939 -0.203 765 H ALA 97 H ALA 97 -3.410 -0.159 -0.079 766 HA ALA 97 HA ALA 97 -0.598 -0.756 0.571 767 HB1 ALA 97 HB1 ALA 97 -2.860 -2.738 0.440 768 HB2 ALA 97 HB2 ALA 97 -2.340 -1.934 1.921 769 HB3 ALA 97 HB3 ALA 97 -1.231 -3.001 1.060 770 H GLY 98 H GLY 98 -2.986 -0.737 -1.928 771 HA2 GLY 98 HA3 GLY 98 -1.289 -0.927 -4.055 772 HA3 GLY 98 HA2 GLY 98 -1.632 -2.601 -3.649 773 H GLY 99 H GLY 99 -4.058 -1.749 -6.233 774 HA2 GLY 99 HA3 GLY 99 -1.255 -2.302 -5.695 775 HA3 GLY 99 HA2 GLY 99 -2.105 -2.564 -7.206 776 H ALA 100 H ALA 100 -0.411 -1.616 -8.375 777 HA ALA 100 HA ALA 100 0.708 0.895 -7.906 778 HB1 ALA 100 HB1 ALA 100 1.208 0.818 -10.409 779 HB2 ALA 100 HB2 ALA 100 0.406 -0.753 -10.393 780 HB3 ALA 100 HB3 ALA 100 1.845 -0.487 -9.409 781 H GLN 101 H GLN 101 -2.061 0.009 -9.965 782 HA GLN 101 HA GLN 101 -2.550 2.587 -10.965 783 HB2 GLN 101 HB3 GLN 101 -3.696 0.042 -11.236 784 HB3 GLN 101 HB2 GLN 101 -4.994 1.075 -10.652 785 HG2 GLN 101 HG3 GLN 101 -3.269 1.719 -13.029 786 HG3 GLN 101 HG2 GLN 101 -4.831 0.906 -13.126 787 HE21 GLN 101 HE21 GLN 101 -6.646 2.097 -12.033 788 HE22 GLN 101 HE22 GLN 101 -6.701 3.810 -12.251 789 H ILE 102 H ILE 102 -3.502 1.018 -7.984 790 HA ILE 102 HA ILE 102 -5.457 2.947 -7.226 791 HB ILE 102 HB ILE 102 -3.886 1.181 -5.354 792 HG12 ILE 102 HG13 ILE 102 -4.838 -0.159 -7.199 793 HG13 ILE 102 HG12 ILE 102 -5.617 -0.506 -5.660 794 HG21 ILE 102 HG21 ILE 102 -6.596 2.483 -5.192 795 HG22 ILE 102 HG22 ILE 102 -5.174 2.846 -4.214 796 HG23 ILE 102 HG23 ILE 102 -5.995 1.296 -4.035 797 HD11 ILE 102 HD11 ILE 102 -7.008 -0.169 -7.858 798 HD12 ILE 102 HD12 ILE 102 -6.845 1.534 -7.431 799 HD13 ILE 102 HD13 ILE 102 -7.601 0.410 -6.302 800 H PHE 103 H PHE 103 -2.033 2.472 -6.449 801 HA PHE 103 HA PHE 103 -1.729 4.528 -4.595 802 HB2 PHE 103 HB3 PHE 103 0.210 3.358 -6.594 803 HB3 PHE 103 HB2 PHE 103 0.685 4.547 -5.385 804 HD1 PHE 103 HD1 PHE 103 -0.840 3.647 -3.041 805 HD2 PHE 103 HD2 PHE 103 1.286 1.408 -5.969 806 HE1 PHE 103 HE1 PHE 103 -0.490 1.845 -1.403 807 HE2 PHE 103 HE2 PHE 103 1.638 -0.399 -4.337 808 HZ PHE 103 HZ PHE 103 0.750 -0.181 -2.051 809 H THR 104 H THR 104 -2.025 4.614 -8.056 810 HA THR 104 HA THR 104 -0.990 7.230 -8.454 811 HB THR 104 HB THR 104 -2.900 5.616 -10.154 812 HG1 THR 104 HG1 THR 104 -0.107 5.955 -10.453 813 HG21 THR 104 HG21 THR 104 -2.724 8.126 -10.625 814 HG22 THR 104 HG22 THR 104 -2.462 7.004 -11.960 815 HG23 THR 104 HG23 THR 104 -1.085 7.766 -11.165 816 H ALA 105 H ALA 105 -4.328 5.976 -8.242 817 HA ALA 105 HA ALA 105 -5.663 8.387 -8.589 818 HB1 ALA 105 HB1 ALA 105 -6.483 6.052 -6.867 819 HB2 ALA 105 HB2 ALA 105 -6.813 6.244 -8.589 820 HB3 ALA 105 HB3 ALA 105 -7.550 7.342 -7.422 821 H PHE 106 H PHE 106 -4.916 6.857 -5.421 822 HA PHE 106 HA PHE 106 -5.630 9.201 -4.005 823 HB2 PHE 106 HB3 PHE 106 -4.112 6.721 -3.186 824 HB3 PHE 106 HB2 PHE 106 -4.569 8.001 -2.066 825 HD1 PHE 106 HD2 PHE 106 -5.933 5.483 -4.416 826 HD2 PHE 106 HD1 PHE 106 -6.716 8.074 -1.131 827 HE1 PHE 106 HE2 PHE 106 -8.134 4.423 -4.111 828 HE2 PHE 106 HE1 PHE 106 -8.917 7.018 -0.820 829 HZ PHE 106 HZ PHE 106 -9.629 5.191 -2.312 830 H LYS 107 H LYS 107 -2.847 8.375 -5.774 831 HA LYS 107 HA LYS 107 -0.705 9.368 -4.409 832 HB2 LYS 107 HB3 LYS 107 0.380 9.466 -6.415 833 HB3 LYS 107 HB2 LYS 107 -1.033 8.564 -6.936 834 HG2 LYS 107 HG3 LYS 107 -2.053 10.769 -7.607 835 HG3 LYS 107 HG2 LYS 107 -0.468 11.490 -7.321 836 HD2 LYS 107 HD3 LYS 107 0.475 10.466 -9.135 837 HD3 LYS 107 HD2 LYS 107 -0.610 9.077 -9.051 838 HE2 LYS 107 HE3 LYS 107 -2.118 10.027 -10.413 839 HE3 LYS 107 HE2 LYS 107 -1.965 11.602 -9.635 840 HZ1 LYS 107 HZ1 LYS 107 -0.798 10.673 -12.054 841 HZ2 LYS 107 HZ2 LYS 107 0.398 11.221 -10.991 842 HZ3 LYS 107 HZ3 LYS 107 -0.870 12.247 -11.436 843 H ASP 108 H ASP 108 -3.292 11.179 -5.916 844 HA ASP 108 HA ASP 108 -2.077 13.736 -5.260 845 HB2 ASP 108 HB3 ASP 108 -4.529 12.880 -6.760 846 HB3 ASP 108 HB2 ASP 108 -4.400 14.536 -6.174 847 H ASP 109 H ASP 109 -4.728 11.665 -4.230 848 HA ASP 109 HA ASP 109 -5.635 13.581 -2.246 849 HB2 ASP 109 HB3 ASP 109 -6.588 10.978 -3.302 850 HB3 ASP 109 HB2 ASP 109 -7.037 11.371 -1.645 851 H VAL 110 H VAL 110 -2.974 11.798 -2.257 852 HA VAL 110 HA VAL 110 -3.222 10.530 0.337 853 HB VAL 110 HB VAL 110 -1.909 9.447 -1.437 854 HG11 VAL 110 HG11 VAL 110 0.437 11.153 -1.186 855 HG12 VAL 110 HG12 VAL 110 -0.930 11.966 -1.947 856 HG13 VAL 110 HG13 VAL 110 -0.313 10.459 -2.624 857 HG21 VAL 110 HG21 VAL 110 -0.068 10.263 0.798 858 HG22 VAL 110 HG22 VAL 110 -0.113 8.731 -0.074 859 HG23 VAL 110 HG23 VAL 110 -1.422 9.158 1.028 860 H ASP 111 H ASP 111 -1.711 10.965 2.085 861 HA ASP 111 HA ASP 111 -0.755 13.746 2.143 862 HB2 ASP 111 HB3 ASP 111 -2.868 12.650 3.682 863 HB3 ASP 111 HB2 ASP 111 -1.515 12.909 4.778 864 H THR 112 H THR 112 -0.441 10.471 3.443 865 HA THR 112 HA THR 112 2.289 11.160 4.305 866 HB THR 112 HB THR 112 0.487 8.980 5.374 867 HG1 THR 112 HG1 THR 112 -0.033 11.156 6.014 868 HG21 THR 112 HG21 THR 112 3.289 9.773 6.107 869 HG22 THR 112 HG22 THR 112 2.673 8.179 5.670 870 HG23 THR 112 HG23 THR 112 2.222 8.906 7.211 871 H LEU 113 H LEU 113 3.910 9.466 4.083 872 HA LEU 113 HA LEU 113 3.298 7.443 2.061 873 HB2 LEU 113 HB3 LEU 113 4.539 9.789 1.410 874 HB3 LEU 113 HB2 LEU 113 5.906 8.744 1.733 875 HG LEU 113 HG LEU 113 5.229 7.209 0.016 876 HD11 LEU 113 HD11 LEU 113 3.092 8.539 -1.266 877 HD12 LEU 113 HD12 LEU 113 2.653 8.366 0.433 878 HD13 LEU 113 HD13 LEU 113 3.091 6.944 -0.514 879 HD21 LEU 113 HD21 LEU 113 5.528 10.078 -0.532 880 HD22 LEU 113 HD22 LEU 113 4.913 9.111 -1.874 881 HD23 LEU 113 HD23 LEU 113 6.458 8.704 -1.128 882 H LEU 114 H LEU 114 3.798 5.577 2.964 883 HA LEU 114 HA LEU 114 6.258 5.378 4.579 884 HB2 LEU 114 HB3 LEU 114 3.594 4.010 4.871 885 HB3 LEU 114 HB2 LEU 114 5.050 3.321 5.563 886 HG LEU 114 HG LEU 114 4.388 6.150 6.223 887 HD11 LEU 114 HD11 LEU 114 2.894 3.739 7.183 888 HD12 LEU 114 HD12 LEU 114 2.267 5.302 6.657 889 HD13 LEU 114 HD13 LEU 114 3.091 5.160 8.210 890 HD21 LEU 114 HD21 LEU 114 5.762 3.840 7.556 891 HD22 LEU 114 HD22 LEU 114 5.277 5.277 8.454 892 HD23 LEU 114 HD23 LEU 114 6.422 5.416 7.119 893 H VAL 115 H VAL 115 7.769 4.486 3.293 894 HA VAL 115 HA VAL 115 6.966 2.135 1.705 895 HB VAL 115 HB VAL 115 8.544 2.795 -0.036 896 HG11 VAL 115 HG11 VAL 115 7.263 4.617 -0.974 897 HG12 VAL 115 HG12 VAL 115 6.614 5.016 0.617 898 HG13 VAL 115 HG13 VAL 115 6.180 3.491 -0.155 899 HG21 VAL 115 HG21 VAL 115 10.224 4.052 0.909 900 HG22 VAL 115 HG22 VAL 115 9.105 5.027 1.862 901 HG23 VAL 115 HG23 VAL 115 9.263 5.307 0.128 902 H THR 116 H THR 116 8.419 0.490 1.437 903 HA THR 116 HA THR 116 10.772 0.532 3.212 904 HB THR 116 HB THR 116 8.909 -1.719 2.439 905 HG1 THR 116 HG1 THR 116 8.539 -1.818 4.609 906 HG21 THR 116 HG21 THR 116 11.617 -1.907 3.713 907 HG22 THR 116 HG22 THR 116 10.989 -2.793 2.323 908 HG23 THR 116 HG23 THR 116 10.370 -3.133 3.939 909 H ARG 117 H ARG 117 12.358 1.127 1.793 910 HA ARG 117 HA ARG 117 12.461 -0.010 -0.862 911 HB2 ARG 117 HB3 ARG 117 13.945 2.103 0.617 912 HB3 ARG 117 HB2 ARG 117 14.752 1.339 -0.745 913 HG2 ARG 117 HG3 ARG 117 13.108 2.073 -2.263 914 HG3 ARG 117 HG2 ARG 117 12.002 2.523 -0.964 915 HD2 ARG 117 HD3 ARG 117 12.811 4.590 -1.416 916 HD3 ARG 117 HD2 ARG 117 14.077 4.070 -0.305 917 HE ARG 117 HE ARG 117 15.556 4.010 -2.059 918 HH11 ARG 117 HH11 ARG 117 12.308 4.280 -3.309 919 HH12 ARG 117 HH12 ARG 117 12.825 4.580 -4.934 920 HH21 ARG 117 HH21 ARG 117 16.236 4.404 -4.196 921 HH22 ARG 117 HH22 ARG 117 15.054 4.650 -5.438 922 H LEU 118 H LEU 118 13.097 -2.060 -1.010 923 HA LEU 118 HA LEU 118 14.924 -3.306 0.774 924 HB2 LEU 118 HB3 LEU 118 13.257 -4.063 -1.459 925 HB3 LEU 118 HB2 LEU 118 14.843 -4.795 -1.611 926 HG LEU 118 HG LEU 118 14.566 -5.696 0.715 927 HD11 LEU 118 HD11 LEU 118 12.972 -4.624 1.889 928 HD12 LEU 118 HD12 LEU 118 11.908 -5.817 1.144 929 HD13 LEU 118 HD13 LEU 118 12.045 -4.201 0.450 930 HD21 LEU 118 HD21 LEU 118 13.661 -7.598 -0.105 931 HD22 LEU 118 HD22 LEU 118 13.823 -6.744 -1.639 932 HD23 LEU 118 HD23 LEU 118 12.271 -6.765 -0.802 933 H ALA 119 H ALA 119 17.079 -3.829 0.502 934 HA ALA 119 HA ALA 119 18.632 -2.055 -1.093 935 HB1 ALA 119 HB1 ALA 119 20.507 -2.976 -0.062 936 HB2 ALA 119 HB2 ALA 119 19.723 -4.536 0.184 937 HB3 ALA 119 HB3 ALA 119 19.241 -3.144 1.155 938 H GLY 120 H GLY 120 17.824 -5.494 -1.315 939 HA2 GLY 120 HA3 GLY 120 19.484 -6.184 -3.449 940 HA3 GLY 120 HA2 GLY 120 17.962 -6.972 -3.064 941 H SER 121 H SER 121 19.193 -6.321 -5.662 942 HA SER 121 HA SER 121 17.304 -4.368 -6.752 943 HB2 SER 121 HB3 SER 121 19.658 -5.735 -8.081 944 HB3 SER 121 HB2 SER 121 18.681 -4.445 -8.782 945 HG SER 121 HG SER 121 20.671 -3.733 -7.795 946 H PHE 122 H PHE 122 15.433 -5.100 -7.490 947 HA PHE 122 HA PHE 122 15.364 -7.761 -8.755 948 HB2 PHE 122 HB3 PHE 122 13.157 -6.448 -7.155 949 HB3 PHE 122 HB2 PHE 122 13.081 -8.034 -7.917 950 HD1 PHE 122 HD2 PHE 122 14.648 -6.074 -5.222 951 HD2 PHE 122 HD1 PHE 122 14.044 -9.942 -6.891 952 HE1 PHE 122 HE2 PHE 122 15.553 -7.094 -3.174 953 HE2 PHE 122 HE1 PHE 122 14.947 -10.970 -4.845 954 HZ PHE 122 HZ PHE 122 15.703 -9.545 -2.984 955 H GLU 123 H GLU 123 13.556 -8.039 -10.305 956 HA GLU 123 HA GLU 123 12.596 -5.579 -11.543 957 HB2 GLU 123 HB3 GLU 123 13.354 -6.273 -13.777 958 HB3 GLU 123 HB2 GLU 123 14.705 -5.998 -12.687 959 HG2 GLU 123 HG3 GLU 123 14.153 -8.686 -12.381 960 HG3 GLU 123 HG2 GLU 123 13.916 -8.397 -14.104 961 H GLY 124 H GLY 124 10.696 -5.822 -12.701 962 HA2 GLY 124 HA3 GLY 124 9.648 -8.445 -13.298 963 HA3 GLY 124 HA2 GLY 124 8.836 -7.647 -11.960 964 H ASP 125 H ASP 125 6.979 -6.793 -12.596 965 HA ASP 125 HA ASP 125 6.937 -5.113 -14.981 966 HB2 ASP 125 HB3 ASP 125 5.162 -7.512 -14.546 967 HB3 ASP 125 HB2 ASP 125 4.714 -6.196 -15.628 968 H THR 126 H THR 126 6.800 -4.683 -12.067 969 HA THR 126 HA THR 126 4.414 -3.019 -12.076 970 HB THR 126 HB THR 126 4.820 -4.529 -9.557 971 HG1 THR 126 HG1 THR 126 4.757 -6.344 -10.637 972 HG21 THR 126 HG21 THR 126 2.289 -3.953 -11.067 973 HG22 THR 126 HG22 THR 126 3.008 -2.845 -9.899 974 HG23 THR 126 HG23 THR 126 2.460 -4.439 -9.381 975 H LYS 127 H LYS 127 5.398 -1.107 -11.848 976 HA LYS 127 HA LYS 127 7.293 -0.790 -9.612 977 HB2 LYS 127 HB3 LYS 127 7.716 -0.282 -12.344 978 HB3 LYS 127 HB2 LYS 127 7.533 1.297 -11.594 979 HG2 LYS 127 HG3 LYS 127 9.455 1.116 -10.413 980 HG3 LYS 127 HG2 LYS 127 9.306 -0.632 -10.225 981 HD2 LYS 127 HD3 LYS 127 9.697 -0.572 -12.846 982 HD3 LYS 127 HD2 LYS 127 10.492 0.952 -12.444 983 HE2 LYS 127 HE3 LYS 127 12.291 -0.350 -12.095 984 HE3 LYS 127 HE2 LYS 127 11.522 -0.682 -10.544 985 HZ1 LYS 127 HZ1 LYS 127 11.852 -2.404 -12.854 986 HZ2 LYS 127 HZ2 LYS 127 10.347 -2.504 -12.089 987 HZ3 LYS 127 HZ3 LYS 127 11.762 -2.799 -11.211 988 H MET 128 H MET 128 7.383 1.486 -8.771 989 HA MET 128 HA MET 128 4.803 2.303 -7.962 990 HB2 MET 128 HB3 MET 128 6.932 2.610 -6.660 991 HB3 MET 128 HB2 MET 128 7.355 3.908 -7.768 992 HG2 MET 128 HG3 MET 128 6.390 4.714 -5.657 993 HG3 MET 128 HG2 MET 128 5.455 5.198 -7.070 994 HE1 MET 128 HE1 MET 128 2.599 5.321 -5.695 995 HE2 MET 128 HE2 MET 128 4.143 5.921 -5.090 996 HE3 MET 128 HE3 MET 128 3.131 4.902 -4.066 997 H ILE 129 H ILE 129 3.966 4.546 -8.193 998 HA ILE 129 HA ILE 129 4.245 5.426 -10.985 999 HB ILE 129 HB ILE 129 2.031 6.483 -10.707 1000 HG12 ILE 129 HG13 ILE 129 0.793 5.389 -8.592 1001 HG13 ILE 129 HG12 ILE 129 2.414 5.521 -7.920 1002 HG21 ILE 129 HG21 ILE 129 0.897 4.088 -10.137 1003 HG22 ILE 129 HG22 ILE 129 2.546 3.600 -10.529 1004 HG23 ILE 129 HG23 ILE 129 1.596 4.516 -11.699 1005 HD11 ILE 129 HD11 ILE 129 0.925 7.448 -7.436 1006 HD12 ILE 129 HD12 ILE 129 0.928 7.816 -9.161 1007 HD13 ILE 129 HD13 ILE 129 2.432 7.874 -8.245 1008 HA PRO 130 HA PRO 130 6.017 9.340 -10.048 1009 HB2 PRO 130 HB3 PRO 130 4.244 11.032 -11.389 1010 HB3 PRO 130 HB2 PRO 130 5.656 10.243 -12.095 1011 HG2 PRO 130 HG3 PRO 130 2.785 9.434 -12.186 1012 HG3 PRO 130 HG2 PRO 130 4.030 9.309 -13.443 1013 HD2 PRO 130 HD3 PRO 130 3.254 7.163 -12.056 1014 HD3 PRO 130 HD2 PRO 130 4.957 7.392 -12.506 1015 H LEU 131 H LEU 131 5.875 10.974 -8.566 1016 HA LEU 131 HA LEU 131 3.280 11.692 -7.448 1017 HB2 LEU 131 HB3 LEU 131 5.364 11.111 -5.425 1018 HB3 LEU 131 HB2 LEU 131 3.622 10.960 -5.316 1019 HG LEU 131 HG LEU 131 5.049 9.011 -7.053 1020 HD11 LEU 131 HD11 LEU 131 5.162 7.671 -4.750 1021 HD12 LEU 131 HD12 LEU 131 5.475 9.298 -4.144 1022 HD13 LEU 131 HD13 LEU 131 6.518 8.603 -5.384 1023 HD21 LEU 131 HD21 LEU 131 2.894 8.532 -5.022 1024 HD22 LEU 131 HD22 LEU 131 3.288 7.591 -6.460 1025 HD23 LEU 131 HD23 LEU 131 2.532 9.175 -6.623 1026 H ASN 132 H ASN 132 3.345 13.615 -6.127 1027 HA ASN 132 HA ASN 132 5.321 15.501 -7.054 1028 HB2 ASN 132 HB3 ASN 132 2.675 15.694 -6.232 1029 HB3 ASN 132 HB2 ASN 132 3.569 16.444 -4.913 1030 HD21 ASN 132 HD21 ASN 132 4.923 18.236 -5.386 1031 HD22 ASN 132 HD22 ASN 132 4.621 19.226 -6.769 1032 H TRP 133 H TRP 133 7.131 14.356 -6.085 1033 HA TRP 133 HA TRP 133 7.489 13.891 -3.381 1034 HB2 TRP 133 HB3 TRP 133 9.539 14.585 -5.486 1035 HB3 TRP 133 HB2 TRP 133 9.927 13.956 -3.887 1036 HD1 TRP 133 HD1 TRP 133 8.341 12.892 -7.214 1037 HE1 TRP 133 HE1 TRP 133 8.287 10.320 -7.310 1038 HE3 TRP 133 HE3 TRP 133 9.905 11.867 -2.455 1039 HZ2 TRP 133 HZ2 TRP 133 8.837 8.145 -5.597 1040 HZ3 TRP 133 HZ3 TRP 133 10.113 9.514 -1.763 1041 HH2 TRP 133 HH2 TRP 133 9.588 7.693 -3.304 1042 H ASP 134 H ASP 134 8.093 16.904 -5.193 1043 HA ASP 134 HA ASP 134 9.474 18.284 -3.219 1044 HB2 ASP 134 HB3 ASP 134 8.918 18.937 -5.671 1045 HB3 ASP 134 HB2 ASP 134 7.463 19.650 -4.982 1046 H ASP 135 H ASP 135 5.980 17.967 -3.719 1047 HA ASP 135 HA ASP 135 5.275 19.728 -1.599 1048 HB2 ASP 135 HB3 ASP 135 3.922 18.566 -3.686 1049 HB3 ASP 135 HB2 ASP 135 3.284 17.689 -2.299 1050 H PHE 136 H PHE 136 6.644 16.702 -1.474 1051 HA PHE 136 HA PHE 136 5.508 16.236 1.204 1052 HB2 PHE 136 HB3 PHE 136 6.370 14.161 -0.821 1053 HB3 PHE 136 HB2 PHE 136 5.889 13.809 0.836 1054 HD1 PHE 136 HD1 PHE 136 3.542 15.075 1.437 1055 HD2 PHE 136 HD2 PHE 136 4.781 13.709 -2.396 1056 HE1 PHE 136 HE1 PHE 136 1.190 14.947 0.729 1057 HE2 PHE 136 HE2 PHE 136 2.430 13.575 -3.114 1058 HZ PHE 136 HZ PHE 136 0.631 14.195 -1.550 1059 H THR 137 H THR 137 6.900 16.054 2.831 1060 HA THR 137 HA THR 137 9.773 15.977 2.176 1061 HB THR 137 HB THR 137 8.308 17.351 4.430 1062 HG1 THR 137 HG1 THR 137 9.256 19.188 3.497 1063 HG21 THR 137 HG21 THR 137 11.282 17.118 4.045 1064 HG22 THR 137 HG22 THR 137 10.339 16.447 5.376 1065 HG23 THR 137 HG23 THR 137 10.475 18.195 5.184 1066 H LYS 138 H LYS 138 11.164 14.757 3.456 1067 HA LYS 138 HA LYS 138 10.098 12.326 4.449 1068 HB2 LYS 138 HB3 LYS 138 12.523 13.059 3.527 1069 HB3 LYS 138 HB2 LYS 138 12.839 13.112 5.255 1070 HG2 LYS 138 HG3 LYS 138 13.221 10.932 5.153 1071 HG3 LYS 138 HG2 LYS 138 11.492 10.715 4.875 1072 HD2 LYS 138 HD3 LYS 138 12.103 9.745 2.951 1073 HD3 LYS 138 HD2 LYS 138 12.414 11.387 2.382 1074 HE2 LYS 138 HE3 LYS 138 14.375 10.196 1.889 1075 HE3 LYS 138 HE2 LYS 138 14.751 11.106 3.351 1076 HZ1 LYS 138 HZ1 LYS 138 15.217 8.503 3.073 1077 HZ2 LYS 138 HZ2 LYS 138 13.677 8.443 3.769 1078 HZ3 LYS 138 HZ3 LYS 138 14.935 9.242 4.568 1079 H VAL 139 H VAL 139 9.223 11.943 6.364 1080 HA VAL 139 HA VAL 139 9.652 13.848 8.540 1081 HB VAL 139 HB VAL 139 7.785 11.537 8.817 1082 HG11 VAL 139 HG11 VAL 139 6.629 12.929 10.277 1083 HG12 VAL 139 HG12 VAL 139 7.304 14.396 9.569 1084 HG13 VAL 139 HG13 VAL 139 8.317 13.350 10.564 1085 HG21 VAL 139 HG21 VAL 139 6.001 12.783 7.683 1086 HG22 VAL 139 HG22 VAL 139 7.299 12.340 6.577 1087 HG23 VAL 139 HG23 VAL 139 7.178 13.994 7.174 1088 H SER 140 H SER 140 10.226 10.509 7.665 1089 HA SER 140 HA SER 140 12.045 10.260 9.917 1090 HB2 SER 140 HB3 SER 140 9.460 9.292 10.209 1091 HB3 SER 140 HB2 SER 140 10.391 7.864 9.760 1092 HG SER 140 HG SER 140 11.761 8.251 11.495 1093 H SER 141 H SER 141 13.474 8.445 9.757 1094 HA SER 141 HA SER 141 13.438 6.845 7.351 1095 HB2 SER 141 HB3 SER 141 15.560 7.597 6.478 1096 HB3 SER 141 HB2 SER 141 14.509 9.003 6.649 1097 HG SER 141 HG SER 141 15.587 9.290 8.749 1098 H ARG 142 H ARG 142 14.101 4.878 7.888 1099 HA ARG 142 HA ARG 142 16.197 4.568 9.913 1100 HB2 ARG 142 HB3 ARG 142 13.801 4.287 10.840 1101 HB3 ARG 142 HB2 ARG 142 13.779 2.780 9.935 1102 HG2 ARG 142 HG3 ARG 142 14.981 1.733 11.480 1103 HG3 ARG 142 HG2 ARG 142 16.183 3.024 11.523 1104 HD2 ARG 142 HD3 ARG 142 15.423 3.587 13.533 1105 HD3 ARG 142 HD2 ARG 142 13.901 4.059 12.781 1106 HE ARG 142 HE ARG 142 13.618 1.393 13.105 1107 HH11 ARG 142 HH11 ARG 142 14.529 3.969 15.277 1108 HH12 ARG 142 HH12 ARG 142 13.872 3.189 16.677 1109 HH21 ARG 142 HH21 ARG 142 12.753 0.367 14.946 1110 HH22 ARG 142 HH22 ARG 142 12.865 1.145 16.489 1111 H THR 143 H THR 143 17.724 3.175 9.298 1112 HA THR 143 HA THR 143 17.176 1.486 6.962 1113 HB THR 143 HB THR 143 19.856 2.255 8.127 1114 HG1 THR 143 HG1 THR 143 18.989 4.114 7.359 1115 HG21 THR 143 HG21 THR 143 19.193 0.344 6.182 1116 HG22 THR 143 HG22 THR 143 20.792 0.949 6.616 1117 HG23 THR 143 HG23 THR 143 19.875 1.727 5.326 1118 H VAL 144 H VAL 144 16.567 -0.501 7.513 1119 HA VAL 144 HA VAL 144 17.879 -1.807 9.794 1120 HB VAL 144 HB VAL 144 15.889 -3.519 9.190 1121 HG11 VAL 144 HG11 VAL 144 15.903 -2.961 11.379 1122 HG12 VAL 144 HG12 VAL 144 14.546 -1.947 10.890 1123 HG13 VAL 144 HG13 VAL 144 16.156 -1.246 11.053 1124 HG21 VAL 144 HG21 VAL 144 13.837 -2.233 8.733 1125 HG22 VAL 144 HG22 VAL 144 14.974 -2.193 7.385 1126 HG23 VAL 144 HG23 VAL 144 14.823 -0.797 8.453 1127 H GLU 145 H GLU 145 19.148 -3.544 9.485 1128 HA GLU 145 HA GLU 145 19.179 -4.755 6.801 1129 HB2 GLU 145 HB3 GLU 145 21.676 -5.152 7.310 1130 HB3 GLU 145 HB2 GLU 145 21.170 -3.541 6.821 1131 HG2 GLU 145 HG3 GLU 145 21.598 -2.633 8.850 1132 HG3 GLU 145 HG2 GLU 145 21.221 -4.121 9.720 1133 H ASP 146 H ASP 146 19.513 -6.947 6.657 1134 HA ASP 146 HA ASP 146 19.287 -8.427 9.193 1135 HB2 ASP 146 HB3 ASP 146 18.046 -8.779 6.512 1136 HB3 ASP 146 HB2 ASP 146 18.467 -10.242 7.397 1137 H THR 147 H THR 147 19.940 -10.927 8.520 1138 HA THR 147 HA THR 147 22.736 -10.916 8.425 1139 HB THR 147 HB THR 147 21.550 -12.779 9.401 1140 HG1 THR 147 HG1 THR 147 23.592 -13.148 8.236 1141 HG21 THR 147 HG21 THR 147 20.707 -13.928 6.816 1142 HG22 THR 147 HG22 THR 147 19.721 -12.624 7.479 1143 HG23 THR 147 HG23 THR 147 19.997 -14.088 8.422 1144 H ASN 148 H ASN 148 20.339 -11.554 5.903 1145 HA ASN 148 HA ASN 148 22.333 -11.999 3.880 1146 HB2 ASN 148 HB3 ASN 148 19.367 -11.981 4.005 1147 HB3 ASN 148 HB2 ASN 148 20.093 -11.629 2.439 1148 HD21 ASN 148 HD21 ASN 148 18.672 -13.994 3.908 1149 HD22 ASN 148 HD22 ASN 148 19.596 -15.358 3.386 1150 HA PRO 149 HA PRO 149 23.150 -7.713 2.977 1151 HB2 PRO 149 HB3 PRO 149 23.721 -8.719 0.244 1152 HB3 PRO 149 HB2 PRO 149 24.749 -7.787 1.338 1153 HG2 PRO 149 HG3 PRO 149 25.206 -10.379 0.902 1154 HG3 PRO 149 HG2 PRO 149 25.430 -9.663 2.507 1155 HD2 PRO 149 HD3 PRO 149 23.191 -11.356 1.487 1156 HD3 PRO 149 HD2 PRO 149 23.971 -11.354 3.083 1157 H ALA 150 H ALA 150 21.229 -9.740 0.850 1158 HA ALA 150 HA ALA 150 20.014 -7.513 -0.516 1159 HB1 ALA 150 HB1 ALA 150 18.732 -9.167 -1.708 1160 HB2 ALA 150 HB2 ALA 150 19.212 -10.417 -0.561 1161 HB3 ALA 150 HB3 ALA 150 20.415 -9.685 -1.623 1162 H LEU 151 H LEU 151 19.452 -9.124 2.434 1163 HA LEU 151 HA LEU 151 16.604 -8.574 2.469 1164 HB2 LEU 151 HB3 LEU 151 18.505 -9.855 4.407 1165 HB3 LEU 151 HB2 LEU 151 16.882 -9.410 4.895 1166 HG LEU 151 HG LEU 151 17.720 -11.485 2.887 1167 HD11 LEU 151 HD11 LEU 151 17.312 -11.758 5.496 1168 HD12 LEU 151 HD12 LEU 151 16.854 -13.005 4.336 1169 HD13 LEU 151 HD13 LEU 151 15.638 -11.888 4.957 1170 HD21 LEU 151 HD21 LEU 151 15.990 -10.374 1.726 1171 HD22 LEU 151 HD22 LEU 151 15.035 -10.164 3.194 1172 HD23 LEU 151 HD23 LEU 151 15.234 -11.770 2.494 1173 H THR 152 H THR 152 18.978 -6.505 2.579 1174 HA THR 152 HA THR 152 18.389 -5.119 5.046 1175 HB THR 152 HB THR 152 19.998 -4.109 2.697 1176 HG1 THR 152 HG1 THR 152 20.778 -5.731 4.881 1177 HG21 THR 152 HG21 THR 152 19.594 -3.190 5.467 1178 HG22 THR 152 HG22 THR 152 19.971 -2.278 4.005 1179 HG23 THR 152 HG23 THR 152 21.247 -3.152 4.854 1180 H HIS 153 H HIS 153 16.805 -3.682 5.314 1181 HA HIS 153 HA HIS 153 15.655 -2.412 2.914 1182 HB2 HIS 153 HB3 HIS 153 13.913 -2.821 5.288 1183 HB3 HIS 153 HB2 HIS 153 13.507 -2.846 3.576 1184 HD1 HIS 153 HD1 HIS 153 13.247 -5.023 6.183 1185 HD2 HIS 153 HD2 HIS 153 15.175 -5.359 2.520 1186 HE1 HIS 153 HE1 HIS 153 13.464 -7.492 5.763 1187 HE2 HIS 153 HE2 HIS 153 14.548 -7.671 3.496 1188 H THR 154 H THR 154 14.403 -0.407 3.426 1189 HA THR 154 HA THR 154 15.414 1.031 5.768 1190 HB THR 154 HB THR 154 15.532 2.122 2.949 1191 HG1 THR 154 HG1 THR 154 17.651 1.427 4.698 1192 HG21 THR 154 HG21 THR 154 16.958 3.424 5.181 1193 HG22 THR 154 HG22 THR 154 15.212 3.654 5.097 1194 HG23 THR 154 HG23 THR 154 16.229 4.119 3.734 1195 H TYR 155 H TYR 155 13.769 1.927 6.809 1196 HA TYR 155 HA TYR 155 11.223 2.295 5.435 1197 HB2 TYR 155 HB3 TYR 155 12.095 2.004 8.257 1198 HB3 TYR 155 HB2 TYR 155 10.681 3.014 7.975 1199 HD1 TYR 155 HD1 TYR 155 8.808 1.955 6.493 1200 HD2 TYR 155 HD2 TYR 155 11.831 -0.290 8.474 1201 HE1 TYR 155 HE1 TYR 155 7.396 -0.053 6.359 1202 HE2 TYR 155 HE2 TYR 155 10.427 -2.305 8.345 1203 HH TYR 155 HH TYR 155 7.610 -2.463 6.412 1204 H GLU 156 H GLU 156 10.339 4.237 4.963 1205 HA GLU 156 HA GLU 156 11.608 6.647 6.063 1206 HB2 GLU 156 HB3 GLU 156 10.868 6.346 3.152 1207 HB3 GLU 156 HB2 GLU 156 11.689 7.706 3.905 1208 HG2 GLU 156 HG3 GLU 156 13.672 6.493 4.194 1209 HG3 GLU 156 HG2 GLU 156 12.870 4.951 3.902 1210 H VAL 157 H VAL 157 10.265 8.327 6.492 1211 HA VAL 157 HA VAL 157 7.405 7.898 5.944 1212 HB VAL 157 HB VAL 157 8.525 9.617 8.156 1213 HG11 VAL 157 HG11 VAL 157 6.393 10.335 8.086 1214 HG12 VAL 157 HG12 VAL 157 6.040 8.819 8.913 1215 HG13 VAL 157 HG13 VAL 157 5.841 8.936 7.164 1216 HG21 VAL 157 HG21 VAL 157 7.420 6.833 8.465 1217 HG22 VAL 157 HG22 VAL 157 8.193 7.837 9.692 1218 HG23 VAL 157 HG23 VAL 157 9.146 7.181 8.360 1219 H TRP 158 H TRP 158 6.153 9.624 5.321 1220 HA TRP 158 HA TRP 158 7.492 12.135 4.624 1221 HB2 TRP 158 HB3 TRP 158 5.898 10.552 2.607 1222 HB3 TRP 158 HB2 TRP 158 6.619 12.132 2.343 1223 HD1 TRP 158 HD1 TRP 158 7.890 8.588 3.332 1224 HE1 TRP 158 HE1 TRP 158 10.131 8.198 2.130 1225 HE3 TRP 158 HE3 TRP 158 8.355 13.111 0.995 1226 HZ2 TRP 158 HZ2 TRP 158 11.866 9.619 0.415 1227 HZ3 TRP 158 HZ3 TRP 158 10.334 13.515 -0.409 1228 HH2 TRP 158 HH2 TRP 158 12.053 11.804 -0.692 1229 H GLN 159 H GLN 159 6.255 13.900 4.844 1230 HA GLN 159 HA GLN 159 3.345 13.613 4.969 1231 HB2 GLN 159 HB3 GLN 159 5.128 14.498 7.188 1232 HB3 GLN 159 HB2 GLN 159 3.598 15.337 6.982 1233 HG2 GLN 159 HG3 GLN 159 2.509 13.047 7.009 1234 HG3 GLN 159 HG2 GLN 159 4.060 12.435 7.581 1235 HE21 GLN 159 HE21 GLN 159 4.716 12.867 9.651 1236 HE22 GLN 159 HE22 GLN 159 3.688 13.588 10.838 1237 H LYS 160 H LYS 160 2.280 15.283 4.031 1238 HA LYS 160 HA LYS 160 3.636 17.108 2.423 1239 HB2 LYS 160 HB3 LYS 160 1.190 16.327 2.306 1240 HB3 LYS 160 HB2 LYS 160 0.859 17.596 3.477 1241 HG2 LYS 160 HG3 LYS 160 2.359 18.821 1.465 1242 HG3 LYS 160 HG2 LYS 160 1.210 17.775 0.629 1243 HD2 LYS 160 HD3 LYS 160 -0.642 18.839 1.632 1244 HD3 LYS 160 HD2 LYS 160 0.373 19.646 2.830 1245 HE2 LYS 160 HE3 LYS 160 1.108 21.231 1.338 1246 HE3 LYS 160 HE2 LYS 160 0.851 20.188 -0.060 1247 HZ1 LYS 160 HZ1 LYS 160 -1.528 20.962 1.422 1248 HZ2 LYS 160 HZ2 LYS 160 -1.291 20.816 -0.246 1249 HZ3 LYS 160 HZ3 LYS 160 -0.754 22.199 0.566 1250 H LYS 161 H LYS 161 4.286 19.185 2.650 1251 HA LYS 161 HA LYS 161 4.902 20.151 5.223 1252 HB2 LYS 161 HB3 LYS 161 4.903 21.498 2.522 1253 HB3 LYS 161 HB2 LYS 161 5.476 22.283 3.987 1254 HG2 LYS 161 HG3 LYS 161 7.468 21.379 3.672 1255 HG3 LYS 161 HG2 LYS 161 6.755 19.774 3.849 1256 HD2 LYS 161 HD3 LYS 161 7.461 19.447 1.744 1257 HD3 LYS 161 HD2 LYS 161 6.061 20.419 1.287 1258 HE2 LYS 161 HE3 LYS 161 7.329 22.159 0.651 1259 HE3 LYS 161 HE2 LYS 161 8.421 21.988 2.025 1260 HZ1 LYS 161 HZ1 LYS 161 9.499 21.590 -0.138 1261 HZ2 LYS 161 HZ2 LYS 161 8.483 20.262 -0.391 1262 HZ3 LYS 161 HZ3 LYS 161 9.588 20.248 0.889 1263 H ALA 162 H ALA 162 4.034 21.793 6.459 1264 HA ALA 162 HA ALA 162 2.435 23.142 7.355 1265 HB1 ALA 162 HB1 ALA 162 0.767 24.053 5.449 1266 HB2 ALA 162 HB2 ALA 162 2.139 23.569 4.453 1267 HB3 ALA 162 HB3 ALA 162 2.365 24.734 5.757 1268 H51A NDP 170 H51A NDP 170 -4.825 -1.810 -11.649 1269 H52A NDP 170 H52A NDP 170 -5.282 -0.578 -10.454 1270 H4B NDP 170 H4B NDP 170 -7.212 -2.524 -11.792 1271 H3B NDP 170 H3B NDP 170 -6.668 0.407 -12.309 1272 HO3A NDP 170 HO3A NDP 170 -7.281 -1.894 -13.897 1273 H2B NDP 170 H2B NDP 170 -9.016 0.648 -12.753 1274 H1B NDP 170 H1B NDP 170 -9.859 -0.769 -10.546 1275 H8A NDP 170 H8A NDP 170 -6.648 1.143 -9.861 1276 H61A NDP 170 H61A NDP 170 -10.364 5.793 -8.114 1277 H62A NDP 170 H62A NDP 170 -8.716 5.209 -8.148 1278 H2A NDP 170 H2A NDP 170 -12.919 2.570 -9.908 1279 H51N NDP 170 H51N NDP 170 -1.577 -4.578 -7.824 1280 H52N NDP 170 H52N NDP 170 -0.782 -3.660 -9.115 1281 H4D NDP 170 H4D NDP 170 0.745 -5.625 -9.497 1282 H3D NDP 170 H3D NDP 170 -0.713 -6.798 -7.118 1283 HO3N NDP 170 HO3N NDP 170 0.426 -8.462 -8.912 1284 H2D NDP 170 H2D NDP 170 1.383 -7.754 -6.453 1285 HO2N NDP 170 HO2N NDP 170 2.708 -6.835 -8.763 1286 H1D NDP 170 H1D NDP 170 2.887 -5.478 -6.933 1287 H2N NDP 170 H2N NDP 170 3.361 -5.330 -4.575 1288 H71N NDP 170 H71N NDP 170 5.118 -4.773 -1.931 1289 H72N NDP 170 H72N NDP 170 4.694 -5.424 -3.493 1290 H41N NDP 170 H41N NDP 170 0.334 -3.757 -2.514 1291 H42N NDP 170 H42N NDP 170 0.212 -5.511 -2.148 1292 H5N NDP 170 H5N NDP 170 -1.515 -4.797 -3.802 1293 H6N NDP 170 H6N NDP 170 -0.728 -5.359 -6.107 Start of MODEL 19 1 H1 THR 1 HT1 THR 1 -5.692 8.574 5.332 2 H2 THR 1 HT2 THR 1 -4.248 9.374 5.799 3 H3 THR 1 HT3 THR 1 -4.291 7.661 5.709 4 HA THR 1 HA THR 1 -4.743 7.840 3.339 5 HB THR 1 HB THR 1 -3.810 10.673 3.477 6 HG1 THR 1 HG1 THR 1 -5.545 10.700 4.894 7 HG21 THR 1 HG21 THR 1 -5.921 9.546 1.685 8 HG22 THR 1 HG22 THR 1 -4.206 9.325 1.337 9 HG23 THR 1 HG23 THR 1 -4.883 10.951 1.441 10 H ALA 2 H ALA 2 -2.936 6.446 4.090 11 HA ALA 2 HA ALA 2 -0.364 7.670 3.362 12 HB1 ALA 2 HB1 ALA 2 0.706 6.993 5.227 13 HB2 ALA 2 HB2 ALA 2 -0.238 5.509 5.359 14 HB3 ALA 2 HB3 ALA 2 -0.914 7.036 5.924 15 H PHE 3 H PHE 3 1.100 6.322 2.289 16 HA PHE 3 HA PHE 3 -0.122 3.911 1.133 17 HB2 PHE 3 HB3 PHE 3 2.188 5.602 0.159 18 HB3 PHE 3 HB2 PHE 3 1.603 4.151 -0.641 19 HD1 PHE 3 HD1 PHE 3 -1.306 5.497 0.506 20 HD2 PHE 3 HD2 PHE 3 1.771 6.340 -2.313 21 HE1 PHE 3 HE1 PHE 3 -2.879 6.862 -0.802 22 HE2 PHE 3 HE2 PHE 3 0.202 7.704 -3.623 23 HZ PHE 3 HZ PHE 3 -2.123 7.966 -2.868 24 H LEU 4 H LEU 4 0.651 1.957 1.641 25 HA LEU 4 HA LEU 4 3.379 1.780 2.728 26 HB2 LEU 4 HB3 LEU 4 1.776 1.583 4.554 27 HB3 LEU 4 HB2 LEU 4 0.928 0.311 3.696 28 HG LEU 4 HG LEU 4 2.857 -1.164 3.915 29 HD11 LEU 4 HD11 LEU 4 4.804 0.002 3.940 30 HD12 LEU 4 HD12 LEU 4 4.594 -0.193 5.681 31 HD13 LEU 4 HD13 LEU 4 4.133 1.320 4.901 32 HD21 LEU 4 HD21 LEU 4 1.088 -0.546 5.842 33 HD22 LEU 4 HD22 LEU 4 2.596 -0.188 6.684 34 HD23 LEU 4 HD23 LEU 4 2.321 -1.796 6.013 35 H TRP 5 H TRP 5 4.577 0.662 1.324 36 HA TRP 5 HA TRP 5 3.666 -1.930 0.436 37 HB2 TRP 5 HB3 TRP 5 3.621 -1.573 -1.877 38 HB3 TRP 5 HB2 TRP 5 2.771 -0.179 -1.222 39 HD1 TRP 5 HD1 TRP 5 6.034 -1.148 -2.968 40 HE1 TRP 5 HE1 TRP 5 7.141 0.985 -3.887 41 HE3 TRP 5 HE3 TRP 5 2.952 2.332 -0.854 42 HZ2 TRP 5 HZ2 TRP 5 6.757 3.778 -3.736 43 HZ3 TRP 5 HZ3 TRP 5 3.390 4.716 -1.294 44 HH2 TRP 5 HH2 TRP 5 5.252 5.421 -2.703 45 H ALA 6 H ALA 6 5.346 -3.130 -0.758 46 HA ALA 6 HA ALA 6 8.010 -2.332 0.202 47 HB1 ALA 6 HB1 ALA 6 7.092 -4.525 0.934 48 HB2 ALA 6 HB2 ALA 6 8.627 -4.647 0.074 49 HB3 ALA 6 HB3 ALA 6 7.120 -5.050 -0.750 50 H GLN 7 H GLN 7 9.806 -2.318 -1.171 51 HA GLN 7 HA GLN 7 9.393 -2.879 -3.998 52 HB2 GLN 7 HB3 GLN 7 10.408 -0.630 -4.590 53 HB3 GLN 7 HB2 GLN 7 8.751 -0.603 -4.004 54 HG2 GLN 7 HG3 GLN 7 10.488 -0.337 -1.773 55 HG3 GLN 7 HG2 GLN 7 10.999 0.801 -3.019 56 HE21 GLN 7 HE21 GLN 7 8.341 -0.210 -0.982 57 HE22 GLN 7 HE22 GLN 7 7.446 1.263 -1.087 58 H ASP 8 H ASP 8 11.407 -2.814 -5.258 59 HA ASP 8 HA ASP 8 13.629 -3.753 -3.621 60 HB2 ASP 8 HB3 ASP 8 14.562 -4.650 -5.675 61 HB3 ASP 8 HB2 ASP 8 12.876 -5.131 -5.534 62 H ARG 9 H ARG 9 15.806 -3.233 -5.173 63 HA ARG 9 HA ARG 9 16.464 -0.623 -4.401 64 HB2 ARG 9 HB3 ARG 9 17.786 -2.854 -5.707 65 HB3 ARG 9 HB2 ARG 9 18.333 -1.307 -6.338 66 HG2 ARG 9 HG3 ARG 9 18.268 -2.001 -3.412 67 HG3 ARG 9 HG2 ARG 9 19.685 -2.185 -4.448 68 HD2 ARG 9 HD3 ARG 9 19.962 0.095 -4.696 69 HD3 ARG 9 HD2 ARG 9 18.275 0.444 -4.324 70 HE ARG 9 HE ARG 9 19.233 -0.563 -2.000 71 HH11 ARG 9 HH11 ARG 9 20.295 1.997 -4.120 72 HH12 ARG 9 HH12 ARG 9 21.002 2.930 -2.844 73 HH21 ARG 9 HH21 ARG 9 20.161 0.663 -0.320 74 HH22 ARG 9 HH22 ARG 9 20.926 2.173 -0.687 75 H ASP 10 H ASP 10 15.072 -1.784 -7.374 76 HA ASP 10 HA ASP 10 15.739 0.675 -8.781 77 HB2 ASP 10 HB3 ASP 10 14.114 -1.738 -9.615 78 HB3 ASP 10 HB2 ASP 10 14.453 -0.358 -10.656 79 H GLY 11 H GLY 11 13.008 -0.908 -7.307 80 HA2 GLY 11 HA3 GLY 11 11.487 0.886 -6.253 81 HA3 GLY 11 HA2 GLY 11 11.309 1.424 -7.916 82 H LEU 12 H LEU 12 11.618 -1.867 -8.025 83 HA LEU 12 HA LEU 12 9.108 -2.446 -8.976 84 HB2 LEU 12 HB3 LEU 12 11.311 -3.868 -8.789 85 HB3 LEU 12 HB2 LEU 12 10.570 -4.470 -7.321 86 HG LEU 12 HG LEU 12 8.671 -5.341 -8.608 87 HD11 LEU 12 HD11 LEU 12 8.637 -3.669 -10.390 88 HD12 LEU 12 HD12 LEU 12 8.709 -5.303 -11.048 89 HD13 LEU 12 HD13 LEU 12 10.159 -4.300 -11.017 90 HD21 LEU 12 HD21 LEU 12 10.967 -6.354 -10.164 91 HD22 LEU 12 HD22 LEU 12 9.755 -7.223 -9.221 92 HD23 LEU 12 HD23 LEU 12 11.105 -6.432 -8.407 93 H ILE 13 H ILE 13 7.672 -4.229 -7.770 94 HA ILE 13 HA ILE 13 7.351 -3.748 -4.964 95 HB ILE 13 HB ILE 13 5.083 -2.958 -4.988 96 HG12 ILE 13 HG13 ILE 13 5.139 -2.510 -7.955 97 HG13 ILE 13 HG12 ILE 13 4.629 -4.068 -7.317 98 HG21 ILE 13 HG21 ILE 13 6.703 -1.216 -6.833 99 HG22 ILE 13 HG22 ILE 13 6.937 -1.320 -5.088 100 HG23 ILE 13 HG23 ILE 13 5.417 -0.707 -5.739 101 HD11 ILE 13 HD11 ILE 13 2.727 -3.216 -6.369 102 HD12 ILE 13 HD12 ILE 13 2.880 -2.213 -7.813 103 HD13 ILE 13 HD13 ILE 13 3.390 -1.587 -6.245 104 H GLY 14 H GLY 14 6.140 -5.169 -7.941 105 HA2 GLY 14 HA3 GLY 14 5.783 -7.699 -6.538 106 HA3 GLY 14 HA2 GLY 14 4.370 -7.026 -7.334 107 H LYS 15 H LYS 15 4.894 -9.355 -8.236 108 HA LYS 15 HA LYS 15 6.241 -8.930 -10.811 109 HB2 LYS 15 HB3 LYS 15 6.904 -11.378 -10.694 110 HB3 LYS 15 HB2 LYS 15 7.781 -10.290 -9.626 111 HG2 LYS 15 HG3 LYS 15 7.125 -11.399 -7.823 112 HG3 LYS 15 HG2 LYS 15 5.436 -11.356 -8.327 113 HD2 LYS 15 HD3 LYS 15 6.901 -13.210 -9.962 114 HD3 LYS 15 HD2 LYS 15 7.159 -13.578 -8.256 115 HE2 LYS 15 HE3 LYS 15 4.559 -13.426 -9.759 116 HE3 LYS 15 HE2 LYS 15 5.252 -14.809 -8.914 117 HZ1 LYS 15 HZ1 LYS 15 3.857 -12.474 -7.826 118 HZ2 LYS 15 HZ2 LYS 15 5.062 -13.192 -6.882 119 HZ3 LYS 15 HZ3 LYS 15 3.732 -14.104 -7.391 120 H ASP 16 H ASP 16 3.801 -8.406 -11.052 121 HA ASP 16 HA ASP 16 1.918 -8.937 -12.229 122 HB2 ASP 16 HB3 ASP 16 3.684 -10.854 -13.104 123 HB3 ASP 16 HB2 ASP 16 2.366 -11.830 -12.462 124 H GLY 17 H GLY 17 2.220 -9.131 -9.333 125 HA2 GLY 17 HA3 GLY 17 -0.330 -10.132 -8.680 126 HA3 GLY 17 HA2 GLY 17 0.880 -11.325 -8.229 127 H HIS 18 H HIS 18 2.862 -10.170 -7.085 128 HA HIS 18 HA HIS 18 2.383 -7.886 -5.508 129 HB2 HIS 18 HB3 HIS 18 2.024 -8.909 -3.320 130 HB3 HIS 18 HB2 HIS 18 0.729 -9.362 -4.423 131 HD1 HIS 18 HD1 HIS 18 3.948 -10.819 -3.030 132 HD2 HIS 18 HD2 HIS 18 0.294 -12.038 -4.590 133 HE1 HIS 18 HE1 HIS 18 3.899 -13.318 -2.754 134 HE2 HIS 18 HE2 HIS 18 1.640 -14.022 -3.619 135 H LEU 19 H LEU 19 3.899 -8.320 -3.294 136 HA LEU 19 HA LEU 19 6.520 -8.354 -4.342 137 HB2 LEU 19 HB3 LEU 19 7.230 -8.294 -1.960 138 HB3 LEU 19 HB2 LEU 19 6.079 -7.048 -2.400 139 HG LEU 19 HG LEU 19 4.369 -8.899 -1.469 140 HD11 LEU 19 HD11 LEU 19 6.755 -10.086 -0.852 141 HD12 LEU 19 HD12 LEU 19 5.217 -10.404 -0.052 142 HD13 LEU 19 HD13 LEU 19 6.351 -9.247 0.646 143 HD21 LEU 19 HD21 LEU 19 5.930 -6.931 0.201 144 HD22 LEU 19 HD22 LEU 19 4.379 -7.649 0.640 145 HD23 LEU 19 HD23 LEU 19 4.491 -6.576 -0.756 146 HA PRO 20 HA PRO 20 6.966 -12.826 -4.123 147 HB2 PRO 20 HB3 PRO 20 9.106 -13.051 -5.687 148 HB3 PRO 20 HB2 PRO 20 7.540 -12.579 -6.356 149 HG2 PRO 20 HG3 PRO 20 9.904 -10.875 -5.681 150 HG3 PRO 20 HG2 PRO 20 8.830 -10.789 -7.087 151 HD2 PRO 20 HD3 PRO 20 8.632 -9.184 -4.834 152 HD3 PRO 20 HD2 PRO 20 7.316 -9.489 -5.983 153 H TRP 21 H TRP 21 9.243 -10.447 -3.037 154 HA TRP 21 HA TRP 21 11.218 -12.289 -2.097 155 HB2 TRP 21 HB3 TRP 21 11.993 -10.229 -0.770 156 HB3 TRP 21 HB2 TRP 21 12.040 -10.130 -2.527 157 HD1 TRP 21 HD1 TRP 21 9.475 -9.209 0.243 158 HE1 TRP 21 HE1 TRP 21 8.412 -6.952 -0.388 159 HE3 TRP 21 HE3 TRP 21 11.869 -8.407 -4.197 160 HZ2 TRP 21 HZ2 TRP 21 8.565 -5.084 -2.500 161 HZ3 TRP 21 HZ3 TRP 21 11.351 -6.364 -5.466 162 HH2 TRP 21 HH2 TRP 21 9.733 -4.737 -4.633 163 H HIS 22 H HIS 22 11.611 -13.009 -0.024 164 HA HIS 22 HA HIS 22 9.272 -13.219 1.664 165 HB2 HIS 22 HB3 HIS 22 11.936 -14.545 1.523 166 HB3 HIS 22 HB2 HIS 22 11.102 -14.548 3.073 167 HD1 HIS 22 HD1 HIS 22 9.740 -15.099 -0.439 168 HD2 HIS 22 HD2 HIS 22 9.982 -17.002 3.247 169 HE1 HIS 22 HE1 HIS 22 8.435 -17.233 -0.697 170 HE2 HIS 22 HE2 HIS 22 8.527 -18.328 1.570 171 H LEU 23 H LEU 23 9.002 -11.132 2.481 172 HA LEU 23 HA LEU 23 11.124 -10.194 4.294 173 HB2 LEU 23 HB3 LEU 23 9.363 -8.828 2.413 174 HB3 LEU 23 HB2 LEU 23 9.325 -8.108 4.011 175 HG LEU 23 HG LEU 23 11.862 -8.021 3.890 176 HD11 LEU 23 HD11 LEU 23 11.626 -8.098 0.939 177 HD12 LEU 23 HD12 LEU 23 11.673 -9.640 1.793 178 HD13 LEU 23 HD13 LEU 23 12.995 -8.488 1.981 179 HD21 LEU 23 HD21 LEU 23 10.180 -6.408 1.980 180 HD22 LEU 23 HD22 LEU 23 11.832 -5.999 2.445 181 HD23 LEU 23 HD23 LEU 23 10.554 -6.023 3.660 182 HA PRO 24 HA PRO 24 7.865 -11.720 7.157 183 HB2 PRO 24 HB3 PRO 24 9.601 -11.969 9.264 184 HB3 PRO 24 HB2 PRO 24 9.313 -13.236 8.067 185 HG2 PRO 24 HG3 PRO 24 11.544 -11.250 8.224 186 HG3 PRO 24 HG2 PRO 24 11.606 -12.975 7.817 187 HD2 PRO 24 HD3 PRO 24 11.710 -11.067 5.926 188 HD3 PRO 24 HD2 PRO 24 10.891 -12.617 5.645 189 H ASP 25 H ASP 25 10.351 -9.258 7.662 190 HA ASP 25 HA ASP 25 9.234 -8.024 9.910 191 HB2 ASP 25 HB3 ASP 25 10.554 -6.014 9.057 192 HB3 ASP 25 HB2 ASP 25 11.469 -7.476 9.386 193 H ASP 26 H ASP 26 8.627 -7.628 6.467 194 HA ASP 26 HA ASP 26 7.045 -5.285 6.681 195 HB2 ASP 26 HB3 ASP 26 7.621 -7.298 4.581 196 HB3 ASP 26 HB2 ASP 26 6.122 -6.393 4.403 197 H LEU 27 H LEU 27 6.088 -8.684 6.137 198 HA LEU 27 HA LEU 27 3.343 -8.291 6.375 199 HB2 LEU 27 HB3 LEU 27 3.444 -10.786 7.142 200 HB3 LEU 27 HB2 LEU 27 3.828 -10.343 5.494 201 HG LEU 27 HG LEU 27 6.241 -10.262 7.016 202 HD11 LEU 27 HD11 LEU 27 5.666 -11.740 8.634 203 HD12 LEU 27 HD12 LEU 27 6.137 -12.878 7.372 204 HD13 LEU 27 HD13 LEU 27 4.432 -12.520 7.646 205 HD21 LEU 27 HD21 LEU 27 5.246 -12.151 4.887 206 HD22 LEU 27 HD22 LEU 27 6.922 -11.993 5.411 207 HD23 LEU 27 HD23 LEU 27 6.113 -10.638 4.623 208 H HIS 28 H HIS 28 5.725 -9.219 8.848 209 HA HIS 28 HA HIS 28 3.951 -9.526 10.984 210 HB2 HIS 28 HB3 HIS 28 6.866 -8.961 10.734 211 HB3 HIS 28 HB2 HIS 28 6.115 -8.698 12.304 212 HD1 HIS 28 HD1 HIS 28 4.704 -10.902 13.190 213 HD2 HIS 28 HD2 HIS 28 7.663 -11.517 10.338 214 HE1 HIS 28 HE1 HIS 28 5.252 -13.353 13.308 215 HE2 HIS 28 HE2 HIS 28 7.110 -13.683 11.638 216 H TYR 29 H TYR 29 5.662 -6.656 9.815 217 HA TYR 29 HA TYR 29 4.605 -4.938 11.847 218 HB2 TYR 29 HB3 TYR 29 6.769 -4.658 10.435 219 HB3 TYR 29 HB2 TYR 29 5.698 -3.968 9.221 220 HD1 TYR 29 HD1 TYR 29 5.987 -3.642 12.940 221 HD2 TYR 29 HD2 TYR 29 5.838 -1.672 9.171 222 HE1 TYR 29 HE1 TYR 29 6.111 -1.466 14.079 223 HE2 TYR 29 HE2 TYR 29 5.962 0.509 10.300 224 HH TYR 29 HH TYR 29 5.397 0.946 13.526 225 H PHE 30 H PHE 30 3.621 -5.947 8.665 226 HA PHE 30 HA PHE 30 1.835 -3.892 8.023 227 HB2 PHE 30 HB3 PHE 30 2.666 -5.901 6.601 228 HB3 PHE 30 HB2 PHE 30 1.300 -6.760 7.304 229 HD1 PHE 30 HD1 PHE 30 -1.014 -5.886 6.923 230 HD2 PHE 30 HD2 PHE 30 2.375 -4.379 4.837 231 HE1 PHE 30 HE1 PHE 30 -2.499 -4.922 5.214 232 HE2 PHE 30 HE2 PHE 30 0.897 -3.411 3.125 233 HZ PHE 30 HZ PHE 30 -1.544 -3.682 3.312 234 H ARG 31 H ARG 31 1.013 -7.109 9.335 235 HA ARG 31 HA ARG 31 -1.643 -6.405 9.988 236 HB2 ARG 31 HB3 ARG 31 0.120 -8.713 10.357 237 HB3 ARG 31 HB2 ARG 31 -1.040 -8.509 11.662 238 HG2 ARG 31 HG3 ARG 31 -2.718 -9.244 10.410 239 HG3 ARG 31 HG2 ARG 31 -2.280 -8.187 9.068 240 HD2 ARG 31 HD3 ARG 31 -2.089 -10.371 8.224 241 HD3 ARG 31 HD2 ARG 31 -0.437 -9.856 8.552 242 HE ARG 31 HE ARG 31 -1.991 -11.807 10.095 243 HH11 ARG 31 HH11 ARG 31 1.053 -10.196 9.479 244 HH12 ARG 31 HH12 ARG 31 1.971 -11.313 10.429 245 HH21 ARG 31 HH21 ARG 31 -0.776 -13.267 11.339 246 HH22 ARG 31 HH22 ARG 31 0.937 -13.053 11.482 247 H ALA 32 H ALA 32 1.376 -6.177 11.726 248 HA ALA 32 HA ALA 32 0.273 -5.784 14.312 249 HB1 ALA 32 HB1 ALA 32 2.617 -4.668 14.655 250 HB2 ALA 32 HB2 ALA 32 2.951 -5.367 13.072 251 HB3 ALA 32 HB3 ALA 32 2.480 -6.409 14.414 252 H GLN 33 H GLN 33 0.801 -3.688 11.590 253 HA GLN 33 HA GLN 33 0.291 -1.313 13.226 254 HB2 GLN 33 HB3 GLN 33 1.541 -1.810 10.587 255 HB3 GLN 33 HB2 GLN 33 0.635 -0.312 10.747 256 HG2 GLN 33 HG3 GLN 33 2.143 -0.352 13.036 257 HG3 GLN 33 HG2 GLN 33 3.225 -1.062 11.839 258 HE21 GLN 33 HE21 GLN 33 3.531 0.157 9.835 259 HE22 GLN 33 HE22 GLN 33 3.513 1.883 9.904 260 H THR 34 H THR 34 -1.150 -3.313 10.751 261 HA THR 34 HA THR 34 -3.341 -1.441 10.348 262 HB THR 34 HB THR 34 -4.146 -3.089 8.697 263 HG1 THR 34 HG1 THR 34 -1.804 -4.554 9.301 264 HG21 THR 34 HG21 THR 34 -2.721 -1.559 7.685 265 HG22 THR 34 HG22 THR 34 -2.072 -3.129 7.211 266 HG23 THR 34 HG23 THR 34 -1.296 -2.206 8.498 267 H VAL 35 H VAL 35 -2.991 -2.667 12.980 268 HA VAL 35 HA VAL 35 -5.244 -4.514 13.159 269 HB VAL 35 HB VAL 35 -4.520 -4.204 15.740 270 HG11 VAL 35 HG11 VAL 35 -2.736 -6.064 14.374 271 HG12 VAL 35 HG12 VAL 35 -4.417 -6.184 13.852 272 HG13 VAL 35 HG13 VAL 35 -4.007 -6.369 15.558 273 HG21 VAL 35 HG21 VAL 35 -2.113 -4.078 15.946 274 HG22 VAL 35 HG22 VAL 35 -2.722 -2.615 15.171 275 HG23 VAL 35 HG23 VAL 35 -1.947 -3.869 14.203 276 H GLY 36 H GLY 36 -7.149 -3.517 13.089 277 HA2 GLY 36 HA3 GLY 36 -8.905 -2.405 14.201 278 HA3 GLY 36 HA2 GLY 36 -7.716 -1.518 15.143 279 H LYS 37 H LYS 37 -7.151 -1.686 11.759 280 HA LYS 37 HA LYS 37 -8.286 1.010 11.411 281 HB2 LYS 37 HB3 LYS 37 -5.648 0.013 10.319 282 HB3 LYS 37 HB2 LYS 37 -6.349 1.597 10.021 283 HG2 LYS 37 HG3 LYS 37 -6.284 1.346 12.796 284 HG3 LYS 37 HG2 LYS 37 -4.749 0.684 12.232 285 HD2 LYS 37 HD3 LYS 37 -5.687 3.249 11.055 286 HD3 LYS 37 HD2 LYS 37 -5.066 3.271 12.707 287 HE2 LYS 37 HE3 LYS 37 -2.958 2.445 12.027 288 HE3 LYS 37 HE2 LYS 37 -3.564 2.006 10.430 289 HZ1 LYS 37 HZ1 LYS 37 -3.360 4.104 9.678 290 HZ2 LYS 37 HZ2 LYS 37 -2.215 4.237 10.916 291 HZ3 LYS 37 HZ3 LYS 37 -3.787 4.812 11.155 292 H ILE 38 H ILE 38 -7.907 1.467 8.808 293 HA ILE 38 HA ILE 38 -9.179 -0.824 7.460 294 HB ILE 38 HB ILE 38 -9.824 1.661 6.150 295 HG12 ILE 38 HG13 ILE 38 -10.865 1.452 8.980 296 HG13 ILE 38 HG12 ILE 38 -9.554 2.529 8.509 297 HG21 ILE 38 HG21 ILE 38 -12.171 0.627 7.069 298 HG22 ILE 38 HG22 ILE 38 -11.121 -0.790 7.080 299 HG23 ILE 38 HG23 ILE 38 -11.351 0.124 5.591 300 HD11 ILE 38 HD11 ILE 38 -12.437 2.634 7.711 301 HD12 ILE 38 HD12 ILE 38 -11.187 3.502 6.819 302 HD13 ILE 38 HD13 ILE 38 -11.467 3.863 8.523 303 H MET 39 H MET 39 -8.204 -1.550 5.693 304 HA MET 39 HA MET 39 -6.054 0.086 4.525 305 HB2 MET 39 HB3 MET 39 -5.234 -1.981 5.463 306 HB3 MET 39 HB2 MET 39 -6.448 -2.908 4.596 307 HG2 MET 39 HG3 MET 39 -5.333 -1.962 2.474 308 HG3 MET 39 HG2 MET 39 -3.988 -1.576 3.545 309 HE1 MET 39 HE1 MET 39 -5.604 -5.824 2.808 310 HE2 MET 39 HE2 MET 39 -6.456 -4.316 2.478 311 HE3 MET 39 HE3 MET 39 -6.243 -4.862 4.142 312 H VAL 40 H VAL 40 -6.139 0.681 2.446 313 HA VAL 40 HA VAL 40 -8.476 -0.136 0.880 314 HB VAL 40 HB VAL 40 -6.493 2.051 0.251 315 HG11 VAL 40 HG11 VAL 40 -7.973 2.772 -1.401 316 HG12 VAL 40 HG12 VAL 40 -9.314 1.835 -0.741 317 HG13 VAL 40 HG13 VAL 40 -7.987 1.016 -1.565 318 HG21 VAL 40 HG21 VAL 40 -7.594 3.510 1.559 319 HG22 VAL 40 HG22 VAL 40 -8.142 2.068 2.413 320 HG23 VAL 40 HG23 VAL 40 -9.169 2.810 1.186 321 H VAL 41 H VAL 41 -8.328 -1.392 -0.884 322 HA VAL 41 HA VAL 41 -5.688 -1.794 -2.098 323 HB VAL 41 HB VAL 41 -6.561 -3.645 -0.406 324 HG11 VAL 41 HG11 VAL 41 -8.646 -3.852 -1.991 325 HG12 VAL 41 HG12 VAL 41 -7.941 -5.276 -1.226 326 HG13 VAL 41 HG13 VAL 41 -7.567 -4.904 -2.909 327 HG21 VAL 41 HG21 VAL 41 -5.026 -3.866 -2.942 328 HG22 VAL 41 HG22 VAL 41 -5.384 -5.335 -2.034 329 HG23 VAL 41 HG23 VAL 41 -4.483 -4.025 -1.272 330 H GLY 42 H GLY 42 -5.677 -2.195 -4.297 331 HA2 GLY 42 HA3 GLY 42 -7.942 -1.263 -5.755 332 HA3 GLY 42 HA2 GLY 42 -6.458 -1.898 -6.446 333 H ARG 43 H ARG 43 -8.308 -2.677 -7.946 334 HA ARG 43 HA ARG 43 -9.874 -4.873 -7.043 335 HB2 ARG 43 HB3 ARG 43 -10.054 -5.204 -9.656 336 HB3 ARG 43 HB2 ARG 43 -10.914 -3.917 -8.832 337 HG2 ARG 43 HG3 ARG 43 -9.638 -2.287 -9.752 338 HG3 ARG 43 HG2 ARG 43 -8.199 -3.304 -9.838 339 HD2 ARG 43 HD3 ARG 43 -8.930 -2.911 -12.070 340 HD3 ARG 43 HD2 ARG 43 -9.321 -4.583 -11.673 341 HE ARG 43 HE ARG 43 -11.540 -2.996 -11.075 342 HH11 ARG 43 HH11 ARG 43 -9.730 -4.074 -13.857 343 HH12 ARG 43 HH12 ARG 43 -11.092 -4.011 -14.925 344 HH21 ARG 43 HH21 ARG 43 -13.334 -2.913 -12.479 345 HH22 ARG 43 HH22 ARG 43 -13.138 -3.351 -14.143 346 H ARG 44 H ARG 44 -7.086 -4.681 -9.248 347 HA ARG 44 HA ARG 44 -6.758 -7.396 -9.695 348 HB2 ARG 44 HB3 ARG 44 -5.355 -5.022 -10.291 349 HB3 ARG 44 HB2 ARG 44 -4.192 -6.111 -9.551 350 HG2 ARG 44 HG3 ARG 44 -4.003 -6.635 -11.784 351 HG3 ARG 44 HG2 ARG 44 -5.139 -7.859 -11.211 352 HD2 ARG 44 HD3 ARG 44 -5.881 -5.269 -12.568 353 HD3 ARG 44 HD2 ARG 44 -5.853 -6.855 -13.337 354 HE ARG 44 HE ARG 44 -7.851 -5.831 -11.513 355 HH11 ARG 44 HH11 ARG 44 -6.496 -8.660 -13.047 356 HH12 ARG 44 HH12 ARG 44 -7.928 -9.610 -12.840 357 HH21 ARG 44 HH21 ARG 44 -9.732 -7.081 -11.239 358 HH22 ARG 44 HH22 ARG 44 -9.765 -8.714 -11.814 359 H THR 45 H THR 45 -6.084 -5.574 -6.843 360 HA THR 45 HA THR 45 -4.153 -7.405 -5.777 361 HB THR 45 HB THR 45 -5.685 -5.587 -3.990 362 HG1 THR 45 HG1 THR 45 -5.285 -3.935 -5.191 363 HG21 THR 45 HG21 THR 45 -3.197 -5.019 -3.436 364 HG22 THR 45 HG22 THR 45 -2.889 -6.566 -4.225 365 HG23 THR 45 HG23 THR 45 -3.947 -6.489 -2.816 366 H TYR 46 H TYR 46 -7.554 -6.667 -4.876 367 HA TYR 46 HA TYR 46 -7.875 -8.537 -2.904 368 HB2 TYR 46 HB3 TYR 46 -10.232 -8.451 -3.260 369 HB3 TYR 46 HB2 TYR 46 -9.601 -6.861 -3.660 370 HD1 TYR 46 HD2 TYR 46 -10.320 -10.101 -5.413 371 HD2 TYR 46 HD1 TYR 46 -10.491 -5.849 -5.529 372 HE1 TYR 46 HE2 TYR 46 -11.410 -10.213 -7.600 373 HE2 TYR 46 HE1 TYR 46 -11.600 -5.956 -7.719 374 HH TYR 46 HH TYR 46 -12.884 -7.484 -9.064 375 H GLU 47 H GLU 47 -8.007 -9.085 -6.390 376 HA GLU 47 HA GLU 47 -8.694 -11.865 -6.094 377 HB2 GLU 47 HB3 GLU 47 -8.592 -9.960 -8.218 378 HB3 GLU 47 HB2 GLU 47 -7.613 -11.347 -8.677 379 HG2 GLU 47 HG3 GLU 47 -10.193 -12.049 -7.503 380 HG3 GLU 47 HG2 GLU 47 -10.306 -11.134 -9.006 381 H SER 48 H SER 48 -5.798 -9.983 -6.356 382 HA SER 48 HA SER 48 -4.203 -12.458 -6.513 383 HB2 SER 48 HB3 SER 48 -4.019 -10.407 -8.217 384 HB3 SER 48 HB2 SER 48 -2.916 -9.815 -6.975 385 HG SER 48 HG SER 48 -2.737 -12.149 -8.543 386 H PHE 49 H PHE 49 -5.352 -11.492 -4.043 387 HA PHE 49 HA PHE 49 -3.023 -10.457 -2.604 388 HB2 PHE 49 HB3 PHE 49 -5.575 -9.672 -2.401 389 HB3 PHE 49 HB2 PHE 49 -5.587 -10.945 -1.185 390 HD1 PHE 49 HD1 PHE 49 -3.164 -8.269 -2.179 391 HD2 PHE 49 HD2 PHE 49 -5.395 -10.127 0.937 392 HE1 PHE 49 HE1 PHE 49 -2.165 -6.726 -0.546 393 HE2 PHE 49 HE2 PHE 49 -4.398 -8.584 2.573 394 HZ PHE 49 HZ PHE 49 -2.782 -6.881 1.833 395 HA PRO 50 HA PRO 50 -1.935 -14.495 -1.126 396 HB2 PRO 50 HB3 PRO 50 -0.862 -13.094 1.246 397 HB3 PRO 50 HB2 PRO 50 -0.035 -14.135 0.082 398 HG2 PRO 50 HG3 PRO 50 0.352 -11.489 0.096 399 HG3 PRO 50 HG2 PRO 50 0.307 -12.410 -1.419 400 HD2 PRO 50 HD3 PRO 50 -1.804 -10.685 -0.184 401 HD3 PRO 50 HD2 PRO 50 -1.330 -10.845 -1.888 402 H LYS 51 H LYS 51 -3.853 -12.262 0.723 403 HA LYS 51 HA LYS 51 -5.386 -14.373 1.863 404 HB2 LYS 51 HB3 LYS 51 -3.109 -13.687 3.320 405 HB3 LYS 51 HB2 LYS 51 -4.419 -12.845 4.136 406 HG2 LYS 51 HG3 LYS 51 -5.043 -15.617 3.462 407 HG3 LYS 51 HG2 LYS 51 -3.681 -15.436 4.569 408 HD2 LYS 51 HD3 LYS 51 -5.058 -14.072 6.053 409 HD3 LYS 51 HD2 LYS 51 -6.417 -14.215 4.937 410 HE2 LYS 51 HE3 LYS 51 -6.852 -15.824 6.573 411 HE3 LYS 51 HE2 LYS 51 -6.157 -16.743 5.239 412 HZ1 LYS 51 HZ1 LYS 51 -4.848 -17.560 6.848 413 HZ2 LYS 51 HZ2 LYS 51 -5.106 -16.256 7.893 414 HZ3 LYS 51 HZ3 LYS 51 -3.971 -16.127 6.645 415 H ARG 52 H ARG 52 -7.130 -13.308 1.007 416 HA ARG 52 HA ARG 52 -7.784 -10.720 2.247 417 HB2 ARG 52 HB3 ARG 52 -9.200 -10.356 0.149 418 HB3 ARG 52 HB2 ARG 52 -7.456 -10.216 -0.022 419 HG2 ARG 52 HG3 ARG 52 -7.598 -11.639 -1.712 420 HG3 ARG 52 HG2 ARG 52 -7.993 -12.893 -0.538 421 HD2 ARG 52 HD3 ARG 52 -10.407 -11.713 -0.837 422 HD3 ARG 52 HD2 ARG 52 -9.727 -11.474 -2.445 423 HE ARG 52 HE ARG 52 -9.247 -14.087 -1.967 424 HH11 ARG 52 HH11 ARG 52 -12.127 -12.128 -1.761 425 HH12 ARG 52 HH12 ARG 52 -13.196 -13.437 -2.141 426 HH21 ARG 52 HH21 ARG 52 -10.650 -15.810 -2.466 427 HH22 ARG 52 HH22 ARG 52 -12.357 -15.527 -2.541 428 HA PRO 53 HA PRO 53 -9.106 -9.603 3.011 429 HB2 PRO 53 HB3 PRO 53 -10.662 -9.070 5.114 430 HB3 PRO 53 HB2 PRO 53 -11.299 -9.018 3.467 431 HG2 PRO 53 HG3 PRO 53 -11.644 -11.098 5.568 432 HG3 PRO 53 HG2 PRO 53 -12.788 -10.544 4.334 433 HD2 PRO 53 HD3 PRO 53 -11.194 -12.852 4.204 434 HD3 PRO 53 HD2 PRO 53 -12.069 -12.106 2.854 435 H LEU 54 H LEU 54 -7.964 -8.689 4.847 436 HA LEU 54 HA LEU 54 -6.324 -10.586 6.171 437 HB2 LEU 54 HB3 LEU 54 -6.632 -7.606 6.396 438 HB3 LEU 54 HB2 LEU 54 -5.522 -8.495 7.421 439 HG LEU 54 HG LEU 54 -5.385 -8.669 4.422 440 HD11 LEU 54 HD11 LEU 54 -3.913 -6.719 6.186 441 HD12 LEU 54 HD12 LEU 54 -5.218 -6.308 5.074 442 HD13 LEU 54 HD13 LEU 54 -3.694 -6.938 4.450 443 HD21 LEU 54 HD21 LEU 54 -2.882 -8.971 5.320 444 HD22 LEU 54 HD22 LEU 54 -4.009 -10.316 5.134 445 HD23 LEU 54 HD23 LEU 54 -3.767 -9.579 6.719 446 HA PRO 55 HA PRO 55 -8.767 -11.320 9.781 447 HB2 PRO 55 HB3 PRO 55 -6.878 -12.319 11.426 448 HB3 PRO 55 HB2 PRO 55 -7.483 -13.212 10.025 449 HG2 PRO 55 HG3 PRO 55 -4.969 -11.609 10.309 450 HG3 PRO 55 HG2 PRO 55 -5.204 -13.196 9.554 451 HD2 PRO 55 HD3 PRO 55 -5.044 -10.885 8.129 452 HD3 PRO 55 HD2 PRO 55 -5.994 -12.286 7.596 453 H GLU 56 H GLU 56 -9.260 -10.514 11.784 454 HA GLU 56 HA GLU 56 -9.476 -8.906 13.371 455 HB2 GLU 56 HB3 GLU 56 -6.480 -9.262 13.365 456 HB3 GLU 56 HB2 GLU 56 -7.352 -8.346 14.587 457 HG2 GLU 56 HG3 GLU 56 -8.341 -11.072 14.119 458 HG3 GLU 56 HG2 GLU 56 -6.717 -10.959 14.797 459 H ARG 57 H ARG 57 -9.183 -7.947 10.579 460 HA ARG 57 HA ARG 57 -8.744 -5.169 11.268 461 HB2 ARG 57 HB3 ARG 57 -7.056 -4.675 9.730 462 HB3 ARG 57 HB2 ARG 57 -6.524 -6.174 10.472 463 HG2 ARG 57 HG3 ARG 57 -6.102 -6.594 8.263 464 HG3 ARG 57 HG2 ARG 57 -7.714 -7.286 8.439 465 HD2 ARG 57 HD3 ARG 57 -7.176 -5.738 6.414 466 HD3 ARG 57 HD2 ARG 57 -8.719 -5.587 7.248 467 HE ARG 57 HE ARG 57 -8.097 -3.499 7.967 468 HH11 ARG 57 HH11 ARG 57 -5.302 -5.147 6.683 469 HH12 ARG 57 HH12 ARG 57 -4.301 -3.735 6.716 470 HH21 ARG 57 HH21 ARG 57 -6.783 -1.644 8.015 471 HH22 ARG 57 HH22 ARG 57 -5.141 -1.746 7.474 472 H THR 58 H THR 58 -9.379 -3.692 9.476 473 HA THR 58 HA THR 58 -11.643 -4.858 8.009 474 HB THR 58 HB THR 58 -11.076 -1.961 8.677 475 HG1 THR 58 HG1 THR 58 -12.722 -3.904 9.900 476 HG21 THR 58 HG21 THR 58 -12.974 -1.334 7.662 477 HG22 THR 58 HG22 THR 58 -13.806 -2.842 8.045 478 HG23 THR 58 HG23 THR 58 -12.682 -2.776 6.688 479 H ASN 59 H ASN 59 -11.432 -5.147 5.888 480 HA ASN 59 HA ASN 59 -9.256 -3.763 4.498 481 HB2 ASN 59 HB3 ASN 59 -10.872 -6.172 3.652 482 HB3 ASN 59 HB2 ASN 59 -9.510 -5.489 2.768 483 HD21 ASN 59 HD21 ASN 59 -10.418 -6.892 5.873 484 HD22 ASN 59 HD22 ASN 59 -8.884 -7.615 6.198 485 H VAL 60 H VAL 60 -9.563 -2.931 2.382 486 HA VAL 60 HA VAL 60 -12.326 -2.249 1.667 487 HB VAL 60 HB VAL 60 -10.018 -0.324 1.934 488 HG11 VAL 60 HG11 VAL 60 -10.787 0.603 0.033 489 HG12 VAL 60 HG12 VAL 60 -12.052 1.240 1.084 490 HG13 VAL 60 HG13 VAL 60 -12.344 -0.219 0.137 491 HG21 VAL 60 HG21 VAL 60 -12.698 0.342 2.939 492 HG22 VAL 60 HG22 VAL 60 -11.114 0.572 3.679 493 HG23 VAL 60 HG23 VAL 60 -11.898 -1.006 3.748 494 H VAL 61 H VAL 61 -12.747 -2.593 -0.426 495 HA VAL 61 HA VAL 61 -10.481 -3.163 -2.206 496 HB VAL 61 HB VAL 61 -13.374 -3.982 -2.502 497 HG11 VAL 61 HG11 VAL 61 -12.525 -3.931 -4.668 498 HG12 VAL 61 HG12 VAL 61 -12.274 -5.605 -4.173 499 HG13 VAL 61 HG13 VAL 61 -10.924 -4.470 -4.158 500 HG21 VAL 61 HG21 VAL 61 -12.946 -5.885 -1.391 501 HG22 VAL 61 HG22 VAL 61 -11.596 -4.984 -0.700 502 HG23 VAL 61 HG23 VAL 61 -11.332 -6.044 -2.085 503 H LEU 62 H LEU 62 -10.358 -2.285 -4.255 504 HA LEU 62 HA LEU 62 -12.273 -0.146 -4.895 505 HB2 LEU 62 HB3 LEU 62 -9.952 0.567 -3.962 506 HB3 LEU 62 HB2 LEU 62 -9.358 0.109 -5.546 507 HG LEU 62 HG LEU 62 -10.973 1.731 -6.555 508 HD11 LEU 62 HD11 LEU 62 -12.609 2.541 -5.294 509 HD12 LEU 62 HD12 LEU 62 -11.401 3.449 -4.383 510 HD13 LEU 62 HD13 LEU 62 -11.893 1.845 -3.839 511 HD21 LEU 62 HD21 LEU 62 -9.706 3.778 -5.643 512 HD22 LEU 62 HD22 LEU 62 -8.784 2.510 -6.452 513 HD23 LEU 62 HD23 LEU 62 -8.797 2.604 -4.690 514 H THR 63 H THR 63 -13.347 -1.189 -6.495 515 HA THR 63 HA THR 63 -11.782 -1.941 -8.864 516 HB THR 63 HB THR 63 -12.540 -3.977 -7.689 517 HG1 THR 63 HG1 THR 63 -13.635 -4.881 -9.496 518 HG21 THR 63 HG21 THR 63 -15.089 -2.559 -7.636 519 HG22 THR 63 HG22 THR 63 -14.489 -3.868 -6.618 520 HG23 THR 63 HG23 THR 63 -15.199 -4.229 -8.191 521 H HIS 64 H HIS 64 -12.721 -1.453 -10.852 522 HA HIS 64 HA HIS 64 -14.489 0.762 -10.877 523 HB2 HIS 64 HB3 HIS 64 -13.188 -0.939 -12.960 524 HB3 HIS 64 HB2 HIS 64 -14.511 0.120 -13.439 525 HD1 HIS 64 HD1 HIS 64 -13.698 2.484 -11.481 526 HD2 HIS 64 HD2 HIS 64 -11.186 0.540 -14.159 527 HE1 HIS 64 HE1 HIS 64 -11.833 4.104 -11.950 528 HE2 HIS 64 HE2 HIS 64 -10.371 2.938 -13.638 529 H GLN 65 H GLN 65 -14.929 -2.683 -11.318 530 HA GLN 65 HA GLN 65 -17.354 -2.845 -12.572 531 HB2 GLN 65 HB3 GLN 65 -15.989 -4.500 -10.512 532 HB3 GLN 65 HB2 GLN 65 -17.686 -4.836 -10.828 533 HG2 GLN 65 HG3 GLN 65 -17.282 -5.682 -12.881 534 HG3 GLN 65 HG2 GLN 65 -15.936 -4.586 -13.190 535 HE21 GLN 65 HE21 GLN 65 -13.879 -5.119 -12.422 536 HE22 GLN 65 HE22 GLN 65 -13.469 -6.733 -11.965 537 H GLU 66 H GLU 66 -19.404 -2.353 -12.128 538 HA GLU 66 HA GLU 66 -19.990 -0.929 -9.679 539 HB2 GLU 66 HB3 GLU 66 -22.287 -0.706 -10.758 540 HB3 GLU 66 HB2 GLU 66 -20.946 0.059 -11.598 541 HG2 GLU 66 HG3 GLU 66 -21.349 -2.659 -12.493 542 HG3 GLU 66 HG2 GLU 66 -22.809 -1.687 -12.668 543 H ASP 67 H ASP 67 -20.747 -3.996 -11.183 544 HA ASP 67 HA ASP 67 -22.557 -4.716 -9.017 545 HB2 ASP 67 HB3 ASP 67 -21.937 -5.819 -11.713 546 HB3 ASP 67 HB2 ASP 67 -22.545 -6.931 -10.489 547 H TYR 68 H TYR 68 -19.497 -4.464 -8.783 548 HA TYR 68 HA TYR 68 -18.666 -7.171 -8.222 549 HB2 TYR 68 HB3 TYR 68 -17.053 -5.484 -9.030 550 HB3 TYR 68 HB2 TYR 68 -17.306 -4.550 -7.560 551 HD1 TYR 68 HD1 TYR 68 -16.014 -7.770 -8.859 552 HD2 TYR 68 HD2 TYR 68 -16.135 -5.070 -5.573 553 HE1 TYR 68 HE1 TYR 68 -14.236 -9.054 -7.746 554 HE2 TYR 68 HE2 TYR 68 -14.357 -6.345 -4.452 555 HH TYR 68 HH TYR 68 -13.337 -9.432 -5.549 556 H GLN 69 H GLN 69 -18.752 -8.210 -6.314 557 HA GLN 69 HA GLN 69 -19.575 -6.651 -3.952 558 HB2 GLN 69 HB3 GLN 69 -20.394 -9.469 -4.679 559 HB3 GLN 69 HB2 GLN 69 -20.836 -8.630 -3.199 560 HG2 GLN 69 HG3 GLN 69 -21.603 -7.788 -5.985 561 HG3 GLN 69 HG2 GLN 69 -22.646 -8.625 -4.836 562 HE21 GLN 69 HE21 GLN 69 -21.445 -5.632 -5.897 563 HE22 GLN 69 HE22 GLN 69 -22.195 -4.635 -4.703 564 H ALA 70 H ALA 70 -18.031 -6.594 -2.485 565 HA ALA 70 HA ALA 70 -16.218 -8.901 -2.229 566 HB1 ALA 70 HB1 ALA 70 -15.453 -6.409 -2.788 567 HB2 ALA 70 HB2 ALA 70 -14.469 -7.510 -1.824 568 HB3 ALA 70 HB3 ALA 70 -15.473 -6.298 -1.028 569 H GLN 71 H GLN 71 -17.263 -10.131 -0.733 570 HA GLN 71 HA GLN 71 -18.531 -9.068 1.581 571 HB2 GLN 71 HB3 GLN 71 -17.635 -11.897 0.998 572 HB3 GLN 71 HB2 GLN 71 -18.723 -11.414 2.292 573 HG2 GLN 71 HG3 GLN 71 -20.331 -11.932 0.834 574 HG3 GLN 71 HG2 GLN 71 -19.977 -10.351 0.140 575 HE21 GLN 71 HE21 GLN 71 -19.336 -10.249 -1.908 576 HE22 GLN 71 HE22 GLN 71 -18.897 -11.603 -2.887 577 H GLY 72 H GLY 72 -17.694 -8.540 3.488 578 HA2 GLY 72 HA3 GLY 72 -16.253 -8.973 5.351 579 HA3 GLY 72 HA2 GLY 72 -15.075 -9.648 4.235 580 H ALA 73 H ALA 73 -15.473 -7.352 2.346 581 HA ALA 73 HA ALA 73 -14.100 -5.273 3.924 582 HB1 ALA 73 HB1 ALA 73 -13.421 -6.116 1.109 583 HB2 ALA 73 HB2 ALA 73 -12.497 -6.531 2.553 584 HB3 ALA 73 HB3 ALA 73 -12.626 -4.847 2.042 585 H VAL 74 H VAL 74 -14.054 -3.130 2.702 586 HA VAL 74 HA VAL 74 -16.774 -2.528 1.872 587 HB VAL 74 HB VAL 74 -14.505 -0.552 2.046 588 HG11 VAL 74 HG11 VAL 74 -16.392 0.400 1.012 589 HG12 VAL 74 HG12 VAL 74 -16.455 0.946 2.688 590 HG13 VAL 74 HG13 VAL 74 -17.503 -0.366 2.148 591 HG21 VAL 74 HG21 VAL 74 -14.330 -1.224 4.201 592 HG22 VAL 74 HG22 VAL 74 -15.938 -1.948 4.221 593 HG23 VAL 74 HG23 VAL 74 -15.755 -0.203 4.398 594 H VAL 75 H VAL 75 -17.415 -2.131 -0.171 595 HA VAL 75 HA VAL 75 -15.339 -2.177 -2.253 596 HB VAL 75 HB VAL 75 -18.277 -2.836 -2.489 597 HG11 VAL 75 HG11 VAL 75 -17.687 -2.060 -4.603 598 HG12 VAL 75 HG12 VAL 75 -17.425 -3.800 -4.726 599 HG13 VAL 75 HG13 VAL 75 -16.053 -2.716 -4.495 600 HG21 VAL 75 HG21 VAL 75 -16.916 -5.096 -3.128 601 HG22 VAL 75 HG22 VAL 75 -17.586 -4.749 -1.534 602 HG23 VAL 75 HG23 VAL 75 -15.886 -4.420 -1.866 603 H VAL 76 H VAL 76 -15.114 -0.595 -3.686 604 HA VAL 76 HA VAL 76 -17.156 1.370 -4.187 605 HB VAL 76 HB VAL 76 -15.847 3.326 -3.553 606 HG11 VAL 76 HG11 VAL 76 -17.437 2.313 -1.941 607 HG12 VAL 76 HG12 VAL 76 -16.129 3.210 -1.169 608 HG13 VAL 76 HG13 VAL 76 -16.086 1.447 -1.207 609 HG21 VAL 76 HG21 VAL 76 -13.738 1.393 -3.278 610 HG22 VAL 76 HG22 VAL 76 -13.913 2.322 -1.790 611 HG23 VAL 76 HG23 VAL 76 -13.646 3.153 -3.323 612 H HIS 77 H HIS 77 -16.598 2.757 -6.001 613 HA HIS 77 HA HIS 77 -14.352 1.675 -7.577 614 HB2 HIS 77 HB3 HIS 77 -16.618 2.884 -9.045 615 HB3 HIS 77 HB2 HIS 77 -15.644 1.472 -9.436 616 HD1 HIS 77 HD1 HIS 77 -16.215 -0.408 -7.175 617 HD2 HIS 77 HD2 HIS 77 -19.155 1.973 -8.893 618 HE1 HIS 77 HE1 HIS 77 -18.395 -1.546 -6.648 619 HE2 HIS 77 HE2 HIS 77 -20.164 -0.039 -7.619 620 H ASP 78 H ASP 78 -15.642 4.470 -6.164 621 HA ASP 78 HA ASP 78 -14.001 6.150 -7.942 622 HB2 ASP 78 HB3 ASP 78 -16.706 6.521 -6.837 623 HB3 ASP 78 HB2 ASP 78 -15.662 7.934 -6.713 624 H VAL 79 H VAL 79 -13.041 8.060 -6.940 625 HA VAL 79 HA VAL 79 -11.695 7.371 -4.513 626 HB VAL 79 HB VAL 79 -11.646 10.026 -5.945 627 HG11 VAL 79 HG11 VAL 79 -9.938 10.624 -4.605 628 HG12 VAL 79 HG12 VAL 79 -9.274 8.991 -4.545 629 HG13 VAL 79 HG13 VAL 79 -10.638 9.427 -3.514 630 HG21 VAL 79 HG21 VAL 79 -9.743 9.215 -7.186 631 HG22 VAL 79 HG22 VAL 79 -11.116 8.142 -7.458 632 HG23 VAL 79 HG23 VAL 79 -9.823 7.659 -6.359 633 H ALA 80 H ALA 80 -14.262 9.580 -5.423 634 HA ALA 80 HA ALA 80 -14.377 10.945 -2.920 635 HB1 ALA 80 HB1 ALA 80 -16.074 12.164 -3.829 636 HB2 ALA 80 HB2 ALA 80 -16.809 10.764 -4.609 637 HB3 ALA 80 HB3 ALA 80 -15.385 11.524 -5.321 638 H ALA 81 H ALA 81 -15.871 8.110 -4.303 639 HA ALA 81 HA ALA 81 -17.913 7.645 -2.467 640 HB1 ALA 81 HB1 ALA 81 -16.225 5.779 -4.108 641 HB2 ALA 81 HB2 ALA 81 -17.893 6.284 -4.378 642 HB3 ALA 81 HB3 ALA 81 -17.507 5.188 -3.051 643 H VAL 82 H VAL 82 -14.765 5.963 -2.456 644 HA VAL 82 HA VAL 82 -14.920 4.872 0.064 645 HB VAL 82 HB VAL 82 -13.141 4.554 -1.788 646 HG11 VAL 82 HG11 VAL 82 -11.530 6.467 -0.149 647 HG12 VAL 82 HG12 VAL 82 -12.464 7.035 -1.533 648 HG13 VAL 82 HG13 VAL 82 -11.203 5.823 -1.758 649 HG21 VAL 82 HG21 VAL 82 -11.622 3.553 -0.243 650 HG22 VAL 82 HG22 VAL 82 -13.252 3.369 0.406 651 HG23 VAL 82 HG23 VAL 82 -12.176 4.602 1.063 652 H PHE 83 H PHE 83 -13.972 8.140 -0.857 653 HA PHE 83 HA PHE 83 -12.834 8.940 1.568 654 HB2 PHE 83 HB3 PHE 83 -14.087 10.349 -0.743 655 HB3 PHE 83 HB2 PHE 83 -13.838 11.265 0.737 656 HD1 PHE 83 HD2 PHE 83 -11.281 10.100 1.682 657 HD2 PHE 83 HD1 PHE 83 -12.541 11.251 -2.217 658 HE1 PHE 83 HE2 PHE 83 -8.937 10.483 1.040 659 HE2 PHE 83 HE1 PHE 83 -10.200 11.636 -2.865 660 HZ PHE 83 HZ PHE 83 -8.394 11.252 -1.235 661 H ALA 84 H ALA 84 -16.206 9.075 0.459 662 HA ALA 84 HA ALA 84 -17.262 10.362 2.718 663 HB1 ALA 84 HB1 ALA 84 -18.883 10.301 1.137 664 HB2 ALA 84 HB2 ALA 84 -19.335 8.810 1.963 665 HB3 ALA 84 HB3 ALA 84 -18.351 8.744 0.501 666 H TYR 85 H TYR 85 -16.611 6.988 2.011 667 HA TYR 85 HA TYR 85 -17.778 5.906 4.340 668 HB2 TYR 85 HB3 TYR 85 -17.213 4.004 3.296 669 HB3 TYR 85 HB2 TYR 85 -16.295 4.927 2.117 670 HD1 TYR 85 HD1 TYR 85 -15.939 3.523 5.564 671 HD2 TYR 85 HD2 TYR 85 -14.057 4.471 1.874 672 HE1 TYR 85 HE1 TYR 85 -13.866 2.466 6.358 673 HE2 TYR 85 HE2 TYR 85 -11.976 3.417 2.655 674 HH TYR 85 HH TYR 85 -10.892 2.872 4.824 675 H ALA 86 H ALA 86 -14.313 6.500 3.634 676 HA ALA 86 HA ALA 86 -13.215 6.104 6.070 677 HB1 ALA 86 HB1 ALA 86 -11.379 7.132 5.262 678 HB2 ALA 86 HB2 ALA 86 -12.269 8.577 4.781 679 HB3 ALA 86 HB3 ALA 86 -12.300 7.141 3.758 680 H LYS 87 H LYS 87 -15.217 8.839 5.148 681 HA LYS 87 HA LYS 87 -14.621 10.458 7.410 682 HB2 LYS 87 HB3 LYS 87 -16.010 10.860 5.109 683 HB3 LYS 87 HB2 LYS 87 -17.334 10.646 6.245 684 HG2 LYS 87 HG3 LYS 87 -17.057 12.894 6.401 685 HG3 LYS 87 HG2 LYS 87 -15.937 12.377 7.663 686 HD2 LYS 87 HD3 LYS 87 -14.239 13.333 6.591 687 HD3 LYS 87 HD2 LYS 87 -14.577 12.376 5.147 688 HE2 LYS 87 HE3 LYS 87 -16.098 14.880 5.827 689 HE3 LYS 87 HE2 LYS 87 -14.610 14.902 4.881 690 HZ1 LYS 87 HZ1 LYS 87 -15.627 14.009 3.094 691 HZ2 LYS 87 HZ2 LYS 87 -17.012 14.682 3.794 692 HZ3 LYS 87 HZ3 LYS 87 -16.670 13.040 4.010 693 H GLN 88 H GLN 88 -17.186 8.166 6.655 694 HA GLN 88 HA GLN 88 -18.647 8.360 9.026 695 HB2 GLN 88 HB3 GLN 88 -19.153 7.096 6.800 696 HB3 GLN 88 HB2 GLN 88 -18.358 5.743 7.593 697 HG2 GLN 88 HG3 GLN 88 -19.989 5.615 9.264 698 HG3 GLN 88 HG2 GLN 88 -20.617 7.219 8.892 699 HE21 GLN 88 HE21 GLN 88 -21.901 7.500 7.041 700 HE22 GLN 88 HE22 GLN 88 -22.699 6.166 6.287 701 H HIS 89 H HIS 89 -15.555 6.978 8.477 702 HA HIS 89 HA HIS 89 -15.696 5.505 11.017 703 HB2 HIS 89 HB3 HIS 89 -14.335 5.019 8.473 704 HB3 HIS 89 HB2 HIS 89 -13.275 4.839 9.867 705 HD1 HIS 89 HD1 HIS 89 -14.953 3.446 11.888 706 HD2 HIS 89 HD2 HIS 89 -15.165 2.537 7.840 707 HE1 HIS 89 HE1 HIS 89 -15.885 1.113 11.771 708 HE2 HIS 89 HE2 HIS 89 -15.920 0.551 9.315 709 HA PRO 90 HA PRO 90 -13.112 9.251 11.952 710 HB2 PRO 90 HB3 PRO 90 -14.324 9.925 14.254 711 HB3 PRO 90 HB2 PRO 90 -14.981 10.398 12.682 712 HG2 PRO 90 HG3 PRO 90 -15.788 8.128 14.464 713 HG3 PRO 90 HG2 PRO 90 -16.814 9.278 13.587 714 HD2 PRO 90 HD3 PRO 90 -16.290 6.766 12.681 715 HD3 PRO 90 HD2 PRO 90 -16.610 8.139 11.603 716 H ASP 91 H ASP 91 -13.605 6.200 13.245 717 HA ASP 91 HA ASP 91 -11.663 6.623 15.410 718 HB2 ASP 91 HB3 ASP 91 -13.902 4.714 14.999 719 HB3 ASP 91 HB2 ASP 91 -12.491 4.121 15.870 720 H GLN 92 H GLN 92 -11.530 5.898 12.281 721 HA GLN 92 HA GLN 92 -9.248 4.093 12.659 722 HB2 GLN 92 HB3 GLN 92 -11.628 3.692 10.910 723 HB3 GLN 92 HB2 GLN 92 -10.061 3.175 10.306 724 HG2 GLN 92 HG3 GLN 92 -10.756 1.256 11.306 725 HG3 GLN 92 HG2 GLN 92 -9.900 2.009 12.651 726 HE21 GLN 92 HE21 GLN 92 -12.972 1.088 11.362 727 HE22 GLN 92 HE22 GLN 92 -13.900 1.397 12.786 728 H GLU 93 H GLU 93 -7.968 3.949 10.507 729 HA GLU 93 HA GLU 93 -7.857 6.628 9.286 730 HB2 GLU 93 HB3 GLU 93 -5.936 5.514 10.943 731 HB3 GLU 93 HB2 GLU 93 -5.307 5.208 9.329 732 HG2 GLU 93 HG3 GLU 93 -5.376 7.545 8.797 733 HG3 GLU 93 HG2 GLU 93 -6.188 7.909 10.320 734 H LEU 94 H LEU 94 -6.806 6.682 7.152 735 HA LEU 94 HA LEU 94 -7.533 4.300 5.605 736 HB2 LEU 94 HB3 LEU 94 -8.224 6.890 5.218 737 HB3 LEU 94 HB2 LEU 94 -6.796 6.794 4.205 738 HG LEU 94 HG LEU 94 -7.827 4.859 3.018 739 HD11 LEU 94 HD11 LEU 94 -10.505 5.540 4.027 740 HD12 LEU 94 HD12 LEU 94 -9.468 4.659 5.150 741 HD13 LEU 94 HD13 LEU 94 -9.825 3.981 3.561 742 HD21 LEU 94 HD21 LEU 94 -8.125 6.691 1.723 743 HD22 LEU 94 HD22 LEU 94 -8.879 7.621 3.019 744 HD23 LEU 94 HD23 LEU 94 -9.818 6.416 2.136 745 H VAL 95 H VAL 95 -6.023 3.055 4.708 746 HA VAL 95 HA VAL 95 -3.371 4.185 4.162 747 HB VAL 95 HB VAL 95 -3.739 1.497 5.483 748 HG11 VAL 95 HG11 VAL 95 -1.669 2.342 3.974 749 HG12 VAL 95 HG12 VAL 95 -1.509 1.208 5.315 750 HG13 VAL 95 HG13 VAL 95 -1.162 2.919 5.562 751 HG21 VAL 95 HG21 VAL 95 -4.333 2.982 7.181 752 HG22 VAL 95 HG22 VAL 95 -3.168 4.197 6.655 753 HG23 VAL 95 HG23 VAL 95 -2.608 2.722 7.441 754 H ILE 96 H ILE 96 -2.663 3.685 2.189 755 HA ILE 96 HA ILE 96 -4.148 1.726 0.619 756 HB ILE 96 HB ILE 96 -1.915 3.462 -0.408 757 HG12 ILE 96 HG13 ILE 96 -3.446 4.997 0.648 758 HG13 ILE 96 HG12 ILE 96 -3.697 5.080 -1.092 759 HG21 ILE 96 HG21 ILE 96 -4.333 2.264 -1.752 760 HG22 ILE 96 HG22 ILE 96 -2.690 1.627 -1.833 761 HG23 ILE 96 HG23 ILE 96 -3.060 3.202 -2.536 762 HD11 ILE 96 HD11 ILE 96 -5.422 3.659 0.919 763 HD12 ILE 96 HD12 ILE 96 -5.645 3.577 -0.829 764 HD13 ILE 96 HD13 ILE 96 -5.817 5.118 0.011 765 H ALA 97 H ALA 97 -3.365 -0.201 -0.002 766 HA ALA 97 HA ALA 97 -0.572 -0.821 0.703 767 HB1 ALA 97 HB1 ALA 97 -1.198 -2.822 1.530 768 HB2 ALA 97 HB2 ALA 97 -2.448 -3.057 0.308 769 HB3 ALA 97 HB3 ALA 97 -2.762 -2.025 1.703 770 H GLY 98 H GLY 98 -2.960 -0.859 -1.826 771 HA2 GLY 98 HA3 GLY 98 -1.189 -0.948 -3.932 772 HA3 GLY 98 HA2 GLY 98 -1.557 -2.629 -3.578 773 H GLY 99 H GLY 99 -3.924 -1.641 -6.188 774 HA2 GLY 99 HA3 GLY 99 -1.156 -2.330 -5.630 775 HA3 GLY 99 HA2 GLY 99 -1.979 -2.447 -7.175 776 H ALA 100 H ALA 100 -0.200 -1.486 -8.216 777 HA ALA 100 HA ALA 100 0.861 1.034 -7.511 778 HB1 ALA 100 HB1 ALA 100 1.654 -0.894 -9.192 779 HB2 ALA 100 HB2 ALA 100 2.243 0.766 -9.281 780 HB3 ALA 100 HB3 ALA 100 0.949 0.231 -10.352 781 H GLN 101 H GLN 101 -1.931 0.078 -9.366 782 HA GLN 101 HA GLN 101 -2.292 2.606 -10.664 783 HB2 GLN 101 HB3 GLN 101 -3.475 0.021 -10.780 784 HB3 GLN 101 HB2 GLN 101 -4.760 1.179 -10.461 785 HG2 GLN 101 HG3 GLN 101 -2.803 1.254 -12.745 786 HG3 GLN 101 HG2 GLN 101 -4.513 0.831 -12.833 787 HE21 GLN 101 HE21 GLN 101 -5.892 2.638 -11.665 788 HE22 GLN 101 HE22 GLN 101 -5.567 4.237 -12.231 789 H ILE 102 H ILE 102 -3.328 1.143 -7.669 790 HA ILE 102 HA ILE 102 -5.338 3.054 -7.036 791 HB ILE 102 HB ILE 102 -3.772 1.356 -5.093 792 HG12 ILE 102 HG13 ILE 102 -4.753 -0.001 -6.924 793 HG13 ILE 102 HG12 ILE 102 -5.498 -0.336 -5.364 794 HG21 ILE 102 HG21 ILE 102 -5.646 1.613 -3.635 795 HG22 ILE 102 HG22 ILE 102 -6.576 2.431 -4.891 796 HG23 ILE 102 HG23 ILE 102 -5.166 3.219 -4.184 797 HD11 ILE 102 HD11 ILE 102 -6.747 1.675 -7.161 798 HD12 ILE 102 HD12 ILE 102 -7.489 0.622 -5.958 799 HD13 ILE 102 HD13 ILE 102 -6.956 -0.042 -7.503 800 H PHE 103 H PHE 103 -1.893 2.775 -6.348 801 HA PHE 103 HA PHE 103 -1.711 4.903 -4.510 802 HB2 PHE 103 HB3 PHE 103 0.367 3.791 -6.409 803 HB3 PHE 103 HB2 PHE 103 0.709 4.910 -5.094 804 HD1 PHE 103 HD1 PHE 103 -1.000 3.802 -2.956 805 HD2 PHE 103 HD2 PHE 103 1.484 1.851 -5.807 806 HE1 PHE 103 HE1 PHE 103 -0.728 1.905 -1.414 807 HE2 PHE 103 HE2 PHE 103 1.760 -0.051 -4.271 808 HZ PHE 103 HZ PHE 103 0.653 -0.026 -2.071 809 H THR 104 H THR 104 -1.561 4.754 -8.022 810 HA THR 104 HA THR 104 -0.664 7.340 -8.555 811 HB THR 104 HB THR 104 -2.585 5.635 -10.150 812 HG1 THR 104 HG1 THR 104 0.203 5.968 -10.495 813 HG21 THR 104 HG21 THR 104 -0.869 7.324 -11.712 814 HG22 THR 104 HG22 THR 104 -1.884 8.284 -10.635 815 HG23 THR 104 HG23 THR 104 -2.622 7.145 -11.762 816 H ALA 105 H ALA 105 -4.022 6.153 -8.303 817 HA ALA 105 HA ALA 105 -5.299 8.587 -8.766 818 HB1 ALA 105 HB1 ALA 105 -7.256 7.610 -7.807 819 HB2 ALA 105 HB2 ALA 105 -6.296 6.430 -6.915 820 HB3 ALA 105 HB3 ALA 105 -6.391 6.341 -8.674 821 H PHE 106 H PHE 106 -4.645 7.110 -5.558 822 HA PHE 106 HA PHE 106 -5.381 9.465 -4.176 823 HB2 PHE 106 HB3 PHE 106 -3.852 7.001 -3.338 824 HB3 PHE 106 HB2 PHE 106 -4.259 8.303 -2.226 825 HD1 PHE 106 HD2 PHE 106 -5.767 5.831 -4.549 826 HD2 PHE 106 HD1 PHE 106 -6.328 8.351 -1.166 827 HE1 PHE 106 HE2 PHE 106 -7.963 4.794 -4.147 828 HE2 PHE 106 HE1 PHE 106 -8.523 7.318 -0.757 829 HZ PHE 106 HZ PHE 106 -9.341 5.538 -2.249 830 H LYS 107 H LYS 107 -2.557 8.638 -5.897 831 HA LYS 107 HA LYS 107 -0.459 9.678 -4.503 832 HB2 LYS 107 HB3 LYS 107 0.680 9.763 -6.484 833 HB3 LYS 107 HB2 LYS 107 -0.693 8.796 -6.999 834 HG2 LYS 107 HG3 LYS 107 -1.765 10.937 -7.783 835 HG3 LYS 107 HG2 LYS 107 -0.214 11.723 -7.484 836 HD2 LYS 107 HD3 LYS 107 0.670 9.697 -8.951 837 HD3 LYS 107 HD2 LYS 107 -0.981 9.754 -9.574 838 HE2 LYS 107 HE3 LYS 107 -0.712 12.067 -10.199 839 HE3 LYS 107 HE2 LYS 107 0.883 12.121 -9.450 840 HZ1 LYS 107 HZ1 LYS 107 1.204 11.862 -11.763 841 HZ2 LYS 107 HZ2 LYS 107 0.073 10.609 -11.868 842 HZ3 LYS 107 HZ3 LYS 107 1.544 10.355 -11.073 843 H ASP 108 H ASP 108 -3.014 11.455 -6.112 844 HA ASP 108 HA ASP 108 -1.808 14.022 -5.477 845 HB2 ASP 108 HB3 ASP 108 -3.326 13.276 -7.567 846 HB3 ASP 108 HB2 ASP 108 -4.593 13.872 -6.498 847 H ASP 109 H ASP 109 -4.554 12.030 -4.503 848 HA ASP 109 HA ASP 109 -5.426 14.001 -2.551 849 HB2 ASP 109 HB3 ASP 109 -6.702 11.987 -3.998 850 HB3 ASP 109 HB2 ASP 109 -6.716 11.411 -2.334 851 H VAL 110 H VAL 110 -2.884 12.072 -2.454 852 HA VAL 110 HA VAL 110 -3.329 10.771 0.094 853 HB VAL 110 HB VAL 110 -1.970 9.673 -1.635 854 HG11 VAL 110 HG11 VAL 110 -0.141 10.561 -2.614 855 HG12 VAL 110 HG12 VAL 110 0.371 11.397 -1.147 856 HG13 VAL 110 HG13 VAL 110 -0.904 12.084 -2.155 857 HG21 VAL 110 HG21 VAL 110 -1.642 9.254 0.818 858 HG22 VAL 110 HG22 VAL 110 -0.261 10.349 0.749 859 HG23 VAL 110 HG23 VAL 110 -0.256 8.862 -0.199 860 H ASP 111 H ASP 111 -1.885 11.083 1.927 861 HA ASP 111 HA ASP 111 -0.884 13.845 2.137 862 HB2 ASP 111 HB3 ASP 111 -3.091 13.179 3.389 863 HB3 ASP 111 HB2 ASP 111 -1.986 12.411 4.525 864 H THR 112 H THR 112 -0.615 10.521 3.361 865 HA THR 112 HA THR 112 2.141 11.150 4.183 866 HB THR 112 HB THR 112 0.317 9.006 5.282 867 HG1 THR 112 HG1 THR 112 -0.256 10.443 6.675 868 HG21 THR 112 HG21 THR 112 3.154 9.728 5.922 869 HG22 THR 112 HG22 THR 112 2.454 8.141 5.601 870 HG23 THR 112 HG23 THR 112 2.097 8.972 7.114 871 H LEU 113 H LEU 113 3.731 9.433 3.938 872 HA LEU 113 HA LEU 113 3.051 7.396 1.953 873 HB2 LEU 113 HB3 LEU 113 4.026 9.520 0.918 874 HB3 LEU 113 HB2 LEU 113 5.529 9.076 1.702 875 HG LEU 113 HG LEU 113 5.207 6.810 0.447 876 HD11 LEU 113 HD11 LEU 113 4.122 8.024 -1.860 877 HD12 LEU 113 HD12 LEU 113 2.996 8.324 -0.536 878 HD13 LEU 113 HD13 LEU 113 3.474 6.673 -0.930 879 HD21 LEU 113 HD21 LEU 113 6.935 7.562 -0.732 880 HD22 LEU 113 HD22 LEU 113 6.641 9.141 -0.003 881 HD23 LEU 113 HD23 LEU 113 5.935 8.748 -1.573 882 H LEU 114 H LEU 114 3.968 5.480 2.343 883 HA LEU 114 HA LEU 114 6.307 5.327 4.110 884 HB2 LEU 114 HB3 LEU 114 3.674 3.918 4.448 885 HB3 LEU 114 HB2 LEU 114 5.154 3.235 5.094 886 HG LEU 114 HG LEU 114 4.536 6.052 5.810 887 HD11 LEU 114 HD11 LEU 114 2.381 5.225 6.195 888 HD12 LEU 114 HD12 LEU 114 3.185 5.114 7.761 889 HD13 LEU 114 HD13 LEU 114 2.984 3.670 6.770 890 HD21 LEU 114 HD21 LEU 114 5.538 3.751 7.473 891 HD22 LEU 114 HD22 LEU 114 5.634 5.473 7.840 892 HD23 LEU 114 HD23 LEU 114 6.589 4.798 6.520 893 H VAL 115 H VAL 115 7.833 4.417 2.884 894 HA VAL 115 HA VAL 115 7.057 2.101 1.228 895 HB VAL 115 HB VAL 115 8.760 2.756 -0.412 896 HG11 VAL 115 HG11 VAL 115 6.873 5.048 0.084 897 HG12 VAL 115 HG12 VAL 115 6.362 3.491 -0.568 898 HG13 VAL 115 HG13 VAL 115 7.513 4.486 -1.460 899 HG21 VAL 115 HG21 VAL 115 10.349 3.981 0.792 900 HG22 VAL 115 HG22 VAL 115 9.134 5.066 1.466 901 HG23 VAL 115 HG23 VAL 115 9.569 5.180 -0.239 902 H THR 116 H THR 116 8.553 0.452 0.956 903 HA THR 116 HA THR 116 10.818 0.455 2.843 904 HB THR 116 HB THR 116 8.944 -1.802 2.100 905 HG1 THR 116 HG1 THR 116 8.598 -1.811 4.364 906 HG21 THR 116 HG21 THR 116 10.256 -3.143 3.756 907 HG22 THR 116 HG22 THR 116 11.515 -1.913 3.647 908 HG23 THR 116 HG23 THR 116 11.063 -2.842 2.217 909 H ARG 117 H ARG 117 12.456 0.927 1.442 910 HA ARG 117 HA ARG 117 12.597 -0.386 -1.139 911 HB2 ARG 117 HB3 ARG 117 14.195 1.752 0.229 912 HB3 ARG 117 HB2 ARG 117 14.826 0.953 -1.204 913 HG2 ARG 117 HG3 ARG 117 13.098 1.770 -2.559 914 HG3 ARG 117 HG2 ARG 117 12.109 2.221 -1.169 915 HD2 ARG 117 HD3 ARG 117 13.256 4.121 -2.375 916 HD3 ARG 117 HD2 ARG 117 13.518 4.040 -0.633 917 HE ARG 117 HE ARG 117 15.546 2.708 -2.176 918 HH11 ARG 117 HH11 ARG 117 14.516 5.757 -0.827 919 HH12 ARG 117 HH12 ARG 117 16.113 6.423 -0.792 920 HH21 ARG 117 HH21 ARG 117 17.648 3.583 -2.131 921 HH22 ARG 117 HH22 ARG 117 17.892 5.190 -1.533 922 H LEU 118 H LEU 118 13.227 -2.446 -1.114 923 HA LEU 118 HA LEU 118 14.900 -3.624 0.821 924 HB2 LEU 118 HB3 LEU 118 13.738 -4.415 -1.782 925 HB3 LEU 118 HB2 LEU 118 15.161 -5.305 -1.277 926 HG LEU 118 HG LEU 118 13.891 -5.672 0.939 927 HD11 LEU 118 HD11 LEU 118 11.358 -5.816 0.340 928 HD12 LEU 118 HD12 LEU 118 11.765 -4.564 -0.833 929 HD13 LEU 118 HD13 LEU 118 12.054 -4.290 0.886 930 HD21 LEU 118 HD21 LEU 118 13.566 -7.740 0.175 931 HD22 LEU 118 HD22 LEU 118 14.141 -7.140 -1.380 932 HD23 LEU 118 HD23 LEU 118 12.411 -7.197 -1.042 933 H ALA 119 H ALA 119 17.000 -4.718 0.284 934 HA ALA 119 HA ALA 119 18.791 -2.757 -0.901 935 HB1 ALA 119 HB1 ALA 119 20.095 -3.419 0.770 936 HB2 ALA 119 HB2 ALA 119 20.264 -4.986 -0.023 937 HB3 ALA 119 HB3 ALA 119 18.986 -4.732 1.167 938 H GLY 120 H GLY 120 17.937 -6.176 -1.304 939 HA2 GLY 120 HA3 GLY 120 19.705 -6.756 -3.400 940 HA3 GLY 120 HA2 GLY 120 18.204 -7.609 -3.074 941 H SER 121 H SER 121 19.423 -6.907 -5.628 942 HA SER 121 HA SER 121 17.540 -4.947 -6.712 943 HB2 SER 121 HB3 SER 121 18.988 -4.672 -8.514 944 HB3 SER 121 HB2 SER 121 20.110 -5.019 -7.198 945 HG SER 121 HG SER 121 19.621 -6.427 -9.463 946 H PHE 122 H PHE 122 15.663 -5.705 -7.409 947 HA PHE 122 HA PHE 122 15.602 -8.365 -8.677 948 HB2 PHE 122 HB3 PHE 122 13.397 -6.962 -7.153 949 HB3 PHE 122 HB2 PHE 122 13.257 -8.532 -7.937 950 HD1 PHE 122 HD2 PHE 122 15.368 -6.770 -5.420 951 HD2 PHE 122 HD1 PHE 122 13.579 -10.422 -6.673 952 HE1 PHE 122 HE2 PHE 122 16.166 -7.861 -3.364 953 HE2 PHE 122 HE1 PHE 122 14.373 -11.520 -4.619 954 HZ PHE 122 HZ PHE 122 15.669 -10.239 -2.961 955 H GLU 123 H GLU 123 13.853 -8.643 -10.294 956 HA GLU 123 HA GLU 123 13.174 -6.149 -11.689 957 HB2 GLU 123 HB3 GLU 123 13.721 -7.186 -13.845 958 HB3 GLU 123 HB2 GLU 123 15.135 -7.081 -12.806 959 HG2 GLU 123 HG3 GLU 123 14.011 -9.573 -12.261 960 HG3 GLU 123 HG2 GLU 123 13.908 -9.385 -14.011 961 H GLY 124 H GLY 124 11.174 -6.097 -12.608 962 HA2 GLY 124 HA3 GLY 124 9.650 -8.568 -12.886 963 HA3 GLY 124 HA2 GLY 124 9.038 -7.400 -11.724 964 H ASP 125 H ASP 125 7.243 -6.611 -12.646 965 HA ASP 125 HA ASP 125 7.552 -5.125 -15.131 966 HB2 ASP 125 HB3 ASP 125 6.492 -7.659 -15.243 967 HB3 ASP 125 HB2 ASP 125 5.050 -6.658 -15.097 968 H THR 126 H THR 126 7.020 -4.641 -12.191 969 HA THR 126 HA THR 126 4.866 -2.733 -12.613 970 HB THR 126 HB THR 126 4.791 -4.748 -10.359 971 HG1 THR 126 HG1 THR 126 3.092 -4.417 -12.604 972 HG21 THR 126 HG21 THR 126 3.425 -3.391 -9.290 973 HG22 THR 126 HG22 THR 126 2.331 -3.415 -10.673 974 HG23 THR 126 HG23 THR 126 3.589 -2.183 -10.564 975 H LYS 127 H LYS 127 5.989 -0.938 -12.201 976 HA LYS 127 HA LYS 127 7.573 -0.812 -9.718 977 HB2 LYS 127 HB3 LYS 127 7.898 0.520 -12.388 978 HB3 LYS 127 HB2 LYS 127 8.575 1.260 -10.944 979 HG2 LYS 127 HG3 LYS 127 10.318 -0.105 -10.985 980 HG3 LYS 127 HG2 LYS 127 9.271 -1.524 -11.048 981 HD2 LYS 127 HD3 LYS 127 9.129 -1.387 -13.440 982 HD3 LYS 127 HD2 LYS 127 9.979 0.160 -13.447 983 HE2 LYS 127 HE3 LYS 127 11.769 -1.387 -12.140 984 HE3 LYS 127 HE2 LYS 127 11.027 -2.582 -13.203 985 HZ1 LYS 127 HZ1 LYS 127 11.909 -1.635 -15.028 986 HZ2 LYS 127 HZ2 LYS 127 13.050 -1.031 -13.936 987 HZ3 LYS 127 HZ3 LYS 127 11.763 -0.056 -14.438 988 H MET 128 H MET 128 7.646 1.412 -8.730 989 HA MET 128 HA MET 128 5.049 2.260 -8.083 990 HB2 MET 128 HB3 MET 128 7.104 2.519 -6.657 991 HB3 MET 128 HB2 MET 128 7.591 3.846 -7.702 992 HG2 MET 128 HG3 MET 128 6.510 4.588 -5.620 993 HG3 MET 128 HG2 MET 128 5.668 5.129 -7.070 994 HE1 MET 128 HE1 MET 128 4.193 5.834 -5.290 995 HE2 MET 128 HE2 MET 128 3.237 4.815 -4.213 996 HE3 MET 128 HE3 MET 128 2.659 5.162 -5.843 997 H ILE 129 H ILE 129 4.240 4.516 -8.297 998 HA ILE 129 HA ILE 129 4.636 5.448 -11.054 999 HB ILE 129 HB ILE 129 2.447 6.547 -10.834 1000 HG12 ILE 129 HG13 ILE 129 1.097 5.584 -8.761 1001 HG13 ILE 129 HG12 ILE 129 2.698 5.535 -8.033 1002 HG21 ILE 129 HG21 ILE 129 1.918 4.599 -11.799 1003 HG22 ILE 129 HG22 ILE 129 1.259 4.162 -10.223 1004 HG23 ILE 129 HG23 ILE 129 2.893 3.664 -10.665 1005 HD11 ILE 129 HD11 ILE 129 1.143 7.629 -7.786 1006 HD12 ILE 129 HD12 ILE 129 1.827 8.044 -9.358 1007 HD13 ILE 129 HD13 ILE 129 2.888 7.803 -7.970 1008 HA PRO 130 HA PRO 130 6.401 9.345 -10.022 1009 HB2 PRO 130 HB3 PRO 130 4.154 10.664 -11.460 1010 HB3 PRO 130 HB2 PRO 130 5.897 10.827 -11.703 1011 HG2 PRO 130 HG3 PRO 130 4.412 9.427 -13.413 1012 HG3 PRO 130 HG2 PRO 130 6.037 8.880 -12.958 1013 HD2 PRO 130 HD3 PRO 130 3.373 7.871 -12.056 1014 HD3 PRO 130 HD2 PRO 130 4.867 6.972 -12.391 1015 H LEU 131 H LEU 131 6.244 10.966 -8.499 1016 HA LEU 131 HA LEU 131 3.625 11.529 -7.322 1017 HB2 LEU 131 HB3 LEU 131 5.782 11.177 -5.346 1018 HB3 LEU 131 HB2 LEU 131 4.081 10.772 -5.237 1019 HG LEU 131 HG LEU 131 5.672 9.049 -7.036 1020 HD11 LEU 131 HD11 LEU 131 5.945 8.423 -4.155 1021 HD12 LEU 131 HD12 LEU 131 7.009 9.660 -4.824 1022 HD13 LEU 131 HD13 LEU 131 7.006 8.035 -5.509 1023 HD21 LEU 131 HD21 LEU 131 3.982 8.076 -4.797 1024 HD22 LEU 131 HD22 LEU 131 4.140 7.468 -6.446 1025 HD23 LEU 131 HD23 LEU 131 3.186 8.918 -6.128 1026 H ASN 132 H ASN 132 3.501 13.497 -6.175 1027 HA ASN 132 HA ASN 132 5.364 15.499 -7.087 1028 HB2 ASN 132 HB3 ASN 132 2.680 15.510 -6.360 1029 HB3 ASN 132 HB2 ASN 132 3.467 16.372 -5.042 1030 HD21 ASN 132 HD21 ASN 132 4.190 18.398 -5.365 1031 HD22 ASN 132 HD22 ASN 132 4.055 19.255 -6.859 1032 H TRP 133 H TRP 133 7.216 14.535 -6.023 1033 HA TRP 133 HA TRP 133 7.514 14.151 -3.302 1034 HB2 TRP 133 HB3 TRP 133 9.600 15.025 -5.305 1035 HB3 TRP 133 HB2 TRP 133 9.941 14.366 -3.706 1036 HD1 TRP 133 HD1 TRP 133 8.592 13.318 -7.145 1037 HE1 TRP 133 HE1 TRP 133 8.721 10.754 -7.328 1038 HE3 TRP 133 HE3 TRP 133 10.011 12.227 -2.353 1039 HZ2 TRP 133 HZ2 TRP 133 9.348 8.562 -5.668 1040 HZ3 TRP 133 HZ3 TRP 133 10.355 9.871 -1.734 1041 HH2 TRP 133 HH2 TRP 133 10.029 8.078 -3.358 1042 H ASP 134 H ASP 134 7.927 17.178 -5.148 1043 HA ASP 134 HA ASP 134 9.078 18.705 -3.128 1044 HB2 ASP 134 HB3 ASP 134 7.139 19.601 -5.271 1045 HB3 ASP 134 HB2 ASP 134 8.202 20.655 -4.344 1046 H ASP 135 H ASP 135 5.667 18.060 -3.828 1047 HA ASP 135 HA ASP 135 4.678 19.761 -1.766 1048 HB2 ASP 135 HB3 ASP 135 3.505 17.740 -3.615 1049 HB3 ASP 135 HB2 ASP 135 2.574 18.197 -2.192 1050 H PHE 136 H PHE 136 6.347 16.923 -1.519 1051 HA PHE 136 HA PHE 136 5.043 16.276 1.042 1052 HB2 PHE 136 HB3 PHE 136 6.353 14.370 -0.910 1053 HB3 PHE 136 HB2 PHE 136 5.796 13.926 0.701 1054 HD1 PHE 136 HD1 PHE 136 3.255 14.713 1.145 1055 HD2 PHE 136 HD2 PHE 136 4.973 13.828 -2.646 1056 HE1 PHE 136 HE1 PHE 136 1.014 14.246 0.241 1057 HE2 PHE 136 HE2 PHE 136 2.736 13.360 -3.557 1058 HZ PHE 136 HZ PHE 136 0.752 13.570 -2.112 1059 H THR 137 H THR 137 6.301 16.257 2.786 1060 HA THR 137 HA THR 137 9.206 16.564 2.382 1061 HB THR 137 HB THR 137 7.375 17.704 4.493 1062 HG1 THR 137 HG1 THR 137 7.773 19.560 3.532 1063 HG21 THR 137 HG21 THR 137 10.344 17.462 4.513 1064 HG22 THR 137 HG22 THR 137 9.189 17.289 5.835 1065 HG23 THR 137 HG23 THR 137 9.571 18.890 5.201 1066 H LYS 138 H LYS 138 10.525 15.103 3.257 1067 HA LYS 138 HA LYS 138 9.577 12.739 4.415 1068 HB2 LYS 138 HB3 LYS 138 11.811 13.135 3.263 1069 HB3 LYS 138 HB2 LYS 138 12.365 13.791 4.800 1070 HG2 LYS 138 HG3 LYS 138 12.777 11.757 5.542 1071 HG3 LYS 138 HG2 LYS 138 11.096 11.300 5.298 1072 HD2 LYS 138 HD3 LYS 138 12.262 9.764 4.000 1073 HD3 LYS 138 HD2 LYS 138 11.759 10.988 2.835 1074 HE2 LYS 138 HE3 LYS 138 14.350 11.518 4.094 1075 HE3 LYS 138 HE2 LYS 138 14.305 10.044 3.127 1076 HZ1 LYS 138 HZ1 LYS 138 14.086 11.195 1.224 1077 HZ2 LYS 138 HZ2 LYS 138 14.783 12.453 2.114 1078 HZ3 LYS 138 HZ3 LYS 138 13.105 12.391 1.911 1079 H VAL 139 H VAL 139 8.575 12.601 6.285 1080 HA VAL 139 HA VAL 139 9.256 14.418 8.449 1081 HB VAL 139 HB VAL 139 7.384 13.080 9.647 1082 HG11 VAL 139 HG11 VAL 139 5.779 14.599 8.862 1083 HG12 VAL 139 HG12 VAL 139 6.514 14.679 7.260 1084 HG13 VAL 139 HG13 VAL 139 7.324 15.420 8.640 1085 HG21 VAL 139 HG21 VAL 139 6.432 12.483 6.882 1086 HG22 VAL 139 HG22 VAL 139 5.957 11.758 8.418 1087 HG23 VAL 139 HG23 VAL 139 7.509 11.345 7.690 1088 H SER 140 H SER 140 9.616 11.036 7.582 1089 HA SER 140 HA SER 140 11.439 10.740 9.842 1090 HB2 SER 140 HB3 SER 140 8.807 9.533 9.754 1091 HB3 SER 140 HB2 SER 140 10.066 8.300 9.834 1092 HG SER 140 HG SER 140 9.340 10.234 11.693 1093 H SER 141 H SER 141 12.944 9.038 9.620 1094 HA SER 141 HA SER 141 12.932 7.413 7.235 1095 HB2 SER 141 HB3 SER 141 13.855 9.618 6.471 1096 HB3 SER 141 HB2 SER 141 15.179 9.403 7.617 1097 HG SER 141 HG SER 141 15.525 7.334 6.470 1098 H ARG 142 H ARG 142 13.722 5.495 7.771 1099 HA ARG 142 HA ARG 142 15.938 5.315 9.671 1100 HB2 ARG 142 HB3 ARG 142 13.584 5.014 10.758 1101 HB3 ARG 142 HB2 ARG 142 13.617 3.439 9.976 1102 HG2 ARG 142 HG3 ARG 142 14.908 2.608 11.571 1103 HG3 ARG 142 HG2 ARG 142 16.089 3.902 11.359 1104 HD2 ARG 142 HD3 ARG 142 15.325 3.975 13.620 1105 HD3 ARG 142 HD2 ARG 142 14.634 5.358 12.772 1106 HE ARG 142 HE ARG 142 12.543 4.475 13.093 1107 HH11 ARG 142 HH11 ARG 142 14.932 2.034 13.804 1108 HH12 ARG 142 HH12 ARG 142 13.781 0.923 14.467 1109 HH21 ARG 142 HH21 ARG 142 11.028 3.016 13.964 1110 HH22 ARG 142 HH22 ARG 142 11.565 1.480 14.558 1111 H THR 143 H THR 143 17.310 3.604 9.313 1112 HA THR 143 HA THR 143 16.715 1.991 6.925 1113 HB THR 143 HB THR 143 19.425 2.629 8.099 1114 HG1 THR 143 HG1 THR 143 18.450 4.498 7.274 1115 HG21 THR 143 HG21 THR 143 19.862 0.804 6.801 1116 HG22 THR 143 HG22 THR 143 20.015 2.096 5.610 1117 HG23 THR 143 HG23 THR 143 18.536 1.138 5.688 1118 H VAL 144 H VAL 144 15.913 0.095 7.572 1119 HA VAL 144 HA VAL 144 17.109 -1.264 9.879 1120 HB VAL 144 HB VAL 144 14.649 -2.081 8.331 1121 HG11 VAL 144 HG11 VAL 144 15.947 -3.745 9.792 1122 HG12 VAL 144 HG12 VAL 144 14.209 -3.593 10.053 1123 HG13 VAL 144 HG13 VAL 144 15.338 -2.808 11.157 1124 HG21 VAL 144 HG21 VAL 144 14.628 -0.669 10.980 1125 HG22 VAL 144 HG22 VAL 144 13.295 -0.928 9.855 1126 HG23 VAL 144 HG23 VAL 144 14.575 0.218 9.456 1127 H GLU 145 H GLU 145 18.406 -2.989 9.641 1128 HA GLU 145 HA GLU 145 18.460 -4.324 7.019 1129 HB2 GLU 145 HB3 GLU 145 20.877 -4.495 7.139 1130 HB3 GLU 145 HB2 GLU 145 20.390 -2.808 7.243 1131 HG2 GLU 145 HG3 GLU 145 21.827 -2.749 8.951 1132 HG3 GLU 145 HG2 GLU 145 20.491 -3.454 9.861 1133 H ASP 146 H ASP 146 18.841 -6.513 7.001 1134 HA ASP 146 HA ASP 146 18.632 -7.843 9.617 1135 HB2 ASP 146 HB3 ASP 146 17.530 -8.436 6.913 1136 HB3 ASP 146 HB2 ASP 146 17.953 -9.806 7.936 1137 H THR 147 H THR 147 19.421 -10.339 9.151 1138 HA THR 147 HA THR 147 22.220 -10.203 9.130 1139 HB THR 147 HB THR 147 21.085 -12.030 10.232 1140 HG1 THR 147 HG1 THR 147 22.488 -13.538 9.654 1141 HG21 THR 147 HG21 THR 147 20.378 -13.417 7.720 1142 HG22 THR 147 HG22 THR 147 19.307 -12.128 8.269 1143 HG23 THR 147 HG23 THR 147 19.639 -13.506 9.318 1144 H ASN 148 H ASN 148 19.924 -11.174 6.622 1145 HA ASN 148 HA ASN 148 21.991 -11.678 4.685 1146 HB2 ASN 148 HB3 ASN 148 19.408 -12.519 4.928 1147 HB3 ASN 148 HB2 ASN 148 19.241 -11.264 3.704 1148 HD21 ASN 148 HD21 ASN 148 18.809 -12.614 2.021 1149 HD22 ASN 148 HD22 ASN 148 19.965 -13.717 1.363 1150 HA PRO 149 HA PRO 149 22.547 -7.508 3.293 1151 HB2 PRO 149 HB3 PRO 149 23.304 -8.042 0.705 1152 HB3 PRO 149 HB2 PRO 149 24.384 -8.153 2.099 1153 HG2 PRO 149 HG3 PRO 149 22.896 -10.324 0.675 1154 HG3 PRO 149 HG2 PRO 149 24.558 -10.325 1.296 1155 HD2 PRO 149 HD3 PRO 149 22.560 -11.539 2.618 1156 HD3 PRO 149 HD2 PRO 149 23.875 -10.710 3.477 1157 H ALA 150 H ALA 150 20.707 -9.764 1.279 1158 HA ALA 150 HA ALA 150 19.397 -7.704 -0.217 1159 HB1 ALA 150 HB1 ALA 150 17.869 -9.711 -0.831 1160 HB2 ALA 150 HB2 ALA 150 19.097 -10.669 -0.004 1161 HB3 ALA 150 HB3 ALA 150 19.538 -9.684 -1.399 1162 H LEU 151 H LEU 151 18.910 -9.066 2.879 1163 HA LEU 151 HA LEU 151 16.070 -8.467 2.946 1164 HB2 LEU 151 HB3 LEU 151 17.983 -9.602 4.971 1165 HB3 LEU 151 HB2 LEU 151 16.324 -9.198 5.368 1166 HG LEU 151 HG LEU 151 17.285 -11.302 3.437 1167 HD11 LEU 151 HD11 LEU 151 16.678 -12.827 4.979 1168 HD12 LEU 151 HD12 LEU 151 15.316 -11.866 5.554 1169 HD13 LEU 151 HD13 LEU 151 16.951 -11.490 6.096 1170 HD21 LEU 151 HD21 LEU 151 14.853 -11.767 3.088 1171 HD22 LEU 151 HD22 LEU 151 15.424 -10.262 2.367 1172 HD23 LEU 151 HD23 LEU 151 14.506 -10.226 3.872 1173 H THR 152 H THR 152 18.457 -6.440 2.833 1174 HA THR 152 HA THR 152 17.892 -4.864 5.213 1175 HB THR 152 HB THR 152 19.653 -4.026 2.918 1176 HG1 THR 152 HG1 THR 152 21.356 -5.058 4.062 1177 HG21 THR 152 HG21 THR 152 20.016 -2.282 4.230 1178 HG22 THR 152 HG22 THR 152 20.841 -3.382 5.334 1179 HG23 THR 152 HG23 THR 152 19.131 -3.016 5.567 1180 H HIS 153 H HIS 153 16.430 -3.271 5.269 1181 HA HIS 153 HA HIS 153 15.566 -2.076 2.724 1182 HB2 HIS 153 HB3 HIS 153 13.496 -2.386 4.822 1183 HB3 HIS 153 HB2 HIS 153 13.351 -2.488 3.072 1184 HD1 HIS 153 HD1 HIS 153 12.648 -4.538 5.698 1185 HD2 HIS 153 HD2 HIS 153 15.114 -5.072 2.397 1186 HE1 HIS 153 HE1 HIS 153 12.890 -7.027 5.433 1187 HE2 HIS 153 HE2 HIS 153 14.314 -7.326 3.378 1188 H THR 154 H THR 154 14.311 -0.033 3.061 1189 HA THR 154 HA THR 154 15.259 1.426 5.436 1190 HB THR 154 HB THR 154 15.022 2.691 2.712 1191 HG1 THR 154 HG1 THR 154 17.396 1.671 3.873 1192 HG21 THR 154 HG21 THR 154 15.547 3.738 5.257 1193 HG22 THR 154 HG22 THR 154 15.669 4.555 3.699 1194 HG23 THR 154 HG23 THR 154 17.079 3.747 4.385 1195 H TYR 155 H TYR 155 13.654 2.280 6.572 1196 HA TYR 155 HA TYR 155 11.000 2.468 5.379 1197 HB2 TYR 155 HB3 TYR 155 12.079 2.151 8.090 1198 HB3 TYR 155 HB2 TYR 155 10.728 3.275 7.997 1199 HD1 TYR 155 HD1 TYR 155 8.841 2.240 6.213 1200 HD2 TYR 155 HD2 TYR 155 11.439 0.054 8.777 1201 HE1 TYR 155 HE1 TYR 155 7.267 0.351 6.189 1202 HE2 TYR 155 HE2 TYR 155 9.873 -1.841 8.759 1203 HH TYR 155 HH TYR 155 8.087 -2.743 7.422 1204 H GLU 156 H GLU 156 10.557 4.300 4.342 1205 HA GLU 156 HA GLU 156 11.549 6.828 5.480 1206 HB2 GLU 156 HB3 GLU 156 10.955 6.005 2.648 1207 HB3 GLU 156 HB2 GLU 156 11.064 7.698 3.109 1208 HG2 GLU 156 HG3 GLU 156 13.358 7.072 4.078 1209 HG3 GLU 156 HG2 GLU 156 13.205 5.610 3.105 1210 H VAL 157 H VAL 157 10.154 8.347 6.097 1211 HA VAL 157 HA VAL 157 7.294 7.884 5.577 1212 HB VAL 157 HB VAL 157 8.315 9.568 7.847 1213 HG11 VAL 157 HG11 VAL 157 5.921 8.044 8.327 1214 HG12 VAL 157 HG12 VAL 157 5.765 8.974 6.838 1215 HG13 VAL 157 HG13 VAL 157 6.158 9.789 8.351 1216 HG21 VAL 157 HG21 VAL 157 7.802 6.595 7.926 1217 HG22 VAL 157 HG22 VAL 157 8.152 7.623 9.316 1218 HG23 VAL 157 HG23 VAL 157 9.377 7.376 8.072 1219 H TRP 158 H TRP 158 5.993 9.607 5.092 1220 HA TRP 158 HA TRP 158 7.204 12.213 4.566 1221 HB2 TRP 158 HB3 TRP 158 5.648 10.868 2.366 1222 HB3 TRP 158 HB2 TRP 158 6.595 12.346 2.277 1223 HD1 TRP 158 HD1 TRP 158 7.229 8.561 2.879 1224 HE1 TRP 158 HE1 TRP 158 9.497 7.967 1.816 1225 HE3 TRP 158 HE3 TRP 158 8.631 13.218 1.308 1226 HZ2 TRP 158 HZ2 TRP 158 11.600 9.297 0.485 1227 HZ3 TRP 158 HZ3 TRP 158 10.786 13.472 0.146 1228 HH2 TRP 158 HH2 TRP 158 12.239 11.551 -0.255 1229 H GLN 159 H GLN 159 5.848 13.900 4.782 1230 HA GLN 159 HA GLN 159 2.965 13.371 4.950 1231 HB2 GLN 159 HB3 GLN 159 4.575 14.923 6.985 1232 HB3 GLN 159 HB2 GLN 159 2.821 14.828 6.950 1233 HG2 GLN 159 HG3 GLN 159 4.128 12.222 6.949 1234 HG3 GLN 159 HG2 GLN 159 4.481 13.194 8.376 1235 HE21 GLN 159 HE21 GLN 159 3.180 10.974 8.867 1236 HE22 GLN 159 HE22 GLN 159 1.505 11.253 9.186 1237 H LYS 160 H LYS 160 1.883 14.720 3.666 1238 HA LYS 160 HA LYS 160 3.076 16.752 2.187 1239 HB2 LYS 160 HB3 LYS 160 0.911 15.528 1.697 1240 HB3 LYS 160 HB2 LYS 160 0.137 16.606 2.849 1241 HG2 LYS 160 HG3 LYS 160 1.725 17.951 0.782 1242 HG3 LYS 160 HG2 LYS 160 0.320 17.064 0.188 1243 HD2 LYS 160 HD3 LYS 160 -0.445 18.504 2.524 1244 HD3 LYS 160 HD2 LYS 160 0.405 19.609 1.443 1245 HE2 LYS 160 HE3 LYS 160 -1.095 19.107 -0.354 1246 HE3 LYS 160 HE2 LYS 160 -1.851 17.811 0.573 1247 HZ1 LYS 160 HZ1 LYS 160 -2.178 20.710 0.821 1248 HZ2 LYS 160 HZ2 LYS 160 -2.308 19.777 2.226 1249 HZ3 LYS 160 HZ3 LYS 160 -3.337 19.480 0.917 1250 H LYS 161 H LYS 161 3.191 18.942 2.369 1251 HA LYS 161 HA LYS 161 3.330 20.077 4.931 1252 HB2 LYS 161 HB3 LYS 161 3.419 21.137 2.143 1253 HB3 LYS 161 HB2 LYS 161 3.210 22.282 3.461 1254 HG2 LYS 161 HG3 LYS 161 5.329 22.056 4.170 1255 HG3 LYS 161 HG2 LYS 161 5.365 20.322 3.841 1256 HD2 LYS 161 HD3 LYS 161 6.064 20.608 1.682 1257 HD3 LYS 161 HD2 LYS 161 5.280 22.181 1.523 1258 HE2 LYS 161 HE3 LYS 161 7.742 21.647 3.180 1259 HE3 LYS 161 HE2 LYS 161 7.759 22.301 1.543 1260 HZ1 LYS 161 HZ1 LYS 161 7.056 23.590 4.047 1261 HZ2 LYS 161 HZ2 LYS 161 6.069 23.977 2.729 1262 HZ3 LYS 161 HZ3 LYS 161 7.737 24.246 2.643 1263 H ALA 162 H ALA 162 1.940 21.285 6.132 1264 HA ALA 162 HA ALA 162 -0.030 22.115 6.910 1265 HB1 ALA 162 HB1 ALA 162 -1.410 23.380 5.410 1266 HB2 ALA 162 HB2 ALA 162 -0.727 22.553 4.010 1267 HB3 ALA 162 HB3 ALA 162 0.277 23.641 4.969 1268 H51A NDP 170 H51A NDP 170 -4.596 -1.688 -11.411 1269 H52A NDP 170 H52A NDP 170 -5.109 -0.635 -10.076 1270 H4B NDP 170 H4B NDP 170 -7.003 -2.315 -11.781 1271 H3B NDP 170 H3B NDP 170 -6.330 0.634 -11.934 1272 HO3A NDP 170 HO3A NDP 170 -6.641 0.047 -14.180 1273 H2B NDP 170 H2B NDP 170 -8.627 0.998 -12.520 1274 H1B NDP 170 H1B NDP 170 -9.675 -0.668 -10.570 1275 H8A NDP 170 H8A NDP 170 -6.532 1.298 -9.607 1276 H61A NDP 170 H61A NDP 170 -10.521 5.466 -7.324 1277 H62A NDP 170 H62A NDP 170 -8.837 5.005 -7.442 1278 H2A NDP 170 H2A NDP 170 -12.884 2.304 -9.458 1279 H51N NDP 170 H51N NDP 170 0.255 -2.962 -9.520 1280 H52N NDP 170 H52N NDP 170 -0.626 -4.295 -10.287 1281 H4D NDP 170 H4D NDP 170 1.684 -4.986 -10.044 1282 H3D NDP 170 H3D NDP 170 -0.111 -6.340 -8.016 1283 HO3N NDP 170 HO3N NDP 170 -0.445 -7.487 -9.772 1284 H2D NDP 170 H2D NDP 170 1.832 -7.542 -7.277 1285 HO2N NDP 170 HO2N NDP 170 2.680 -7.205 -9.805 1286 H1D NDP 170 H1D NDP 170 3.540 -5.361 -7.321 1287 H2N NDP 170 H2N NDP 170 3.836 -5.095 -4.974 1288 H71N NDP 170 H71N NDP 170 5.388 -4.603 -2.190 1289 H72N NDP 170 H72N NDP 170 5.123 -5.173 -3.818 1290 H41N NDP 170 H41N NDP 170 0.521 -4.186 -2.951 1291 H42N NDP 170 H42N NDP 170 0.658 -5.965 -2.740 1292 H5N NDP 170 H5N NDP 170 -1.093 -5.377 -4.416 1293 H6N NDP 170 H6N NDP 170 -0.138 -5.597 -6.718 Start of MODEL 20 1 H1 THR 1 HT1 THR 1 -4.259 9.780 6.482 2 H2 THR 1 HT2 THR 1 -3.977 8.106 6.730 3 H3 THR 1 HT3 THR 1 -5.542 8.659 6.297 4 HA THR 1 HA THR 1 -4.680 7.783 4.378 5 HB THR 1 HB THR 1 -4.366 9.815 2.969 6 HG1 THR 1 HG1 THR 1 -3.167 10.934 4.708 7 HG21 THR 1 HG21 THR 1 -6.578 9.842 3.054 8 HG22 THR 1 HG22 THR 1 -6.423 11.064 4.316 9 HG23 THR 1 HG23 THR 1 -6.594 9.364 4.752 10 H ALA 2 H ALA 2 -2.844 6.504 4.720 11 HA ALA 2 HA ALA 2 -0.311 7.842 4.054 12 HB1 ALA 2 HB1 ALA 2 0.901 6.697 5.694 13 HB2 ALA 2 HB2 ALA 2 -0.405 5.548 5.986 14 HB3 ALA 2 HB3 ALA 2 -0.564 7.220 6.524 15 H PHE 3 H PHE 3 1.202 6.577 2.911 16 HA PHE 3 HA PHE 3 -0.011 4.315 1.476 17 HB2 PHE 3 HB3 PHE 3 2.058 6.358 0.769 18 HB3 PHE 3 HB2 PHE 3 2.099 4.793 -0.030 19 HD1 PHE 3 HD1 PHE 3 -0.997 6.518 0.992 20 HD2 PHE 3 HD2 PHE 3 1.628 5.547 -2.213 21 HE1 PHE 3 HE1 PHE 3 -2.682 7.303 -0.622 22 HE2 PHE 3 HE2 PHE 3 -0.051 6.327 -3.832 23 HZ PHE 3 HZ PHE 3 -2.207 7.208 -3.038 24 H LEU 4 H LEU 4 0.692 2.312 1.930 25 HA LEU 4 HA LEU 4 3.416 2.020 3.011 26 HB2 LEU 4 HB3 LEU 4 1.763 1.719 4.786 27 HB3 LEU 4 HB2 LEU 4 0.947 0.494 3.833 28 HG LEU 4 HG LEU 4 2.854 -0.991 4.024 29 HD11 LEU 4 HD11 LEU 4 4.794 0.211 4.068 30 HD12 LEU 4 HD12 LEU 4 4.624 -0.145 5.787 31 HD13 LEU 4 HD13 LEU 4 4.144 1.433 5.161 32 HD21 LEU 4 HD21 LEU 4 1.095 -0.434 5.981 33 HD22 LEU 4 HD22 LEU 4 2.609 -0.126 6.830 34 HD23 LEU 4 HD23 LEU 4 2.315 -1.702 6.095 35 H TRP 5 H TRP 5 4.635 0.978 1.567 36 HA TRP 5 HA TRP 5 3.767 -1.556 0.533 37 HB2 TRP 5 HB3 TRP 5 3.583 -1.100 -1.732 38 HB3 TRP 5 HB2 TRP 5 2.817 0.309 -1.011 39 HD1 TRP 5 HD1 TRP 5 5.898 -0.740 -2.999 40 HE1 TRP 5 HE1 TRP 5 7.064 1.372 -3.897 41 HE3 TRP 5 HE3 TRP 5 3.194 2.799 -0.499 42 HZ2 TRP 5 HZ2 TRP 5 6.862 4.171 -3.586 43 HZ3 TRP 5 HZ3 TRP 5 3.743 5.175 -0.857 44 HH2 TRP 5 HH2 TRP 5 5.538 5.843 -2.368 45 H ALA 6 H ALA 6 5.444 -2.730 -0.567 46 HA ALA 6 HA ALA 6 8.111 -1.840 0.272 47 HB1 ALA 6 HB1 ALA 6 7.226 -4.588 -0.602 48 HB2 ALA 6 HB2 ALA 6 7.312 -4.039 1.072 49 HB3 ALA 6 HB3 ALA 6 8.782 -4.155 0.105 50 H GLN 7 H GLN 7 9.877 -1.862 -1.160 51 HA GLN 7 HA GLN 7 9.371 -2.426 -3.968 52 HB2 GLN 7 HB3 GLN 7 10.325 -0.154 -4.593 53 HB3 GLN 7 HB2 GLN 7 8.682 -0.168 -3.968 54 HG2 GLN 7 HG3 GLN 7 10.440 0.141 -1.769 55 HG3 GLN 7 HG2 GLN 7 10.932 1.277 -3.024 56 HE21 GLN 7 HE21 GLN 7 8.337 0.286 -0.907 57 HE22 GLN 7 HE22 GLN 7 7.417 1.742 -1.033 58 H ASP 8 H ASP 8 11.319 -2.427 -5.283 59 HA ASP 8 HA ASP 8 13.614 -3.280 -3.710 60 HB2 ASP 8 HB3 ASP 8 14.473 -4.229 -5.762 61 HB3 ASP 8 HB2 ASP 8 12.784 -4.688 -5.581 62 H ARG 9 H ARG 9 15.726 -2.788 -5.331 63 HA ARG 9 HA ARG 9 16.463 -0.192 -4.634 64 HB2 ARG 9 HB3 ARG 9 17.650 -2.440 -6.014 65 HB3 ARG 9 HB2 ARG 9 18.144 -0.919 -6.744 66 HG2 ARG 9 HG3 ARG 9 18.814 -0.129 -4.480 67 HG3 ARG 9 HG2 ARG 9 18.473 -1.751 -3.872 68 HD2 ARG 9 HD3 ARG 9 20.336 -2.628 -4.793 69 HD3 ARG 9 HD2 ARG 9 20.210 -1.634 -6.244 70 HE ARG 9 HE ARG 9 20.940 0.138 -4.330 71 HH11 ARG 9 HH11 ARG 9 22.239 -2.925 -5.383 72 HH12 ARG 9 HH12 ARG 9 23.872 -2.514 -4.976 73 HH21 ARG 9 HH21 ARG 9 23.086 0.679 -3.793 74 HH22 ARG 9 HH22 ARG 9 24.353 -0.469 -4.072 75 H ASP 10 H ASP 10 14.917 -1.353 -7.552 76 HA ASP 10 HA ASP 10 15.460 1.128 -8.967 77 HB2 ASP 10 HB3 ASP 10 13.679 -1.163 -9.817 78 HB3 ASP 10 HB2 ASP 10 14.324 0.115 -10.841 79 H GLY 11 H GLY 11 12.842 -0.466 -7.311 80 HA2 GLY 11 HA3 GLY 11 11.334 1.268 -6.204 81 HA3 GLY 11 HA2 GLY 11 11.101 1.859 -7.842 82 H LEU 12 H LEU 12 11.426 -1.456 -7.957 83 HA LEU 12 HA LEU 12 8.919 -2.031 -8.917 84 HB2 LEU 12 HB3 LEU 12 11.157 -3.451 -8.622 85 HB3 LEU 12 HB2 LEU 12 10.275 -4.099 -7.256 86 HG LEU 12 HG LEU 12 8.487 -4.872 -8.746 87 HD11 LEU 12 HD11 LEU 12 9.892 -4.508 -11.248 88 HD12 LEU 12 HD12 LEU 12 9.483 -2.963 -10.506 89 HD13 LEU 12 HD13 LEU 12 8.218 -4.147 -10.831 90 HD21 LEU 12 HD21 LEU 12 9.757 -6.696 -8.707 91 HD22 LEU 12 HD22 LEU 12 11.246 -5.761 -8.837 92 HD23 LEU 12 HD23 LEU 12 10.353 -6.205 -10.292 93 H ILE 13 H ILE 13 7.494 -3.810 -7.727 94 HA ILE 13 HA ILE 13 7.115 -3.321 -4.924 95 HB ILE 13 HB ILE 13 4.803 -2.606 -5.040 96 HG12 ILE 13 HG13 ILE 13 4.920 -1.920 -7.925 97 HG13 ILE 13 HG12 ILE 13 4.682 -3.617 -7.538 98 HG21 ILE 13 HG21 ILE 13 6.726 -0.966 -5.058 99 HG22 ILE 13 HG22 ILE 13 5.159 -0.341 -5.575 100 HG23 ILE 13 HG23 ILE 13 6.390 -0.736 -6.774 101 HD11 ILE 13 HD11 ILE 13 2.967 -1.349 -6.566 102 HD12 ILE 13 HD12 ILE 13 2.723 -3.061 -6.216 103 HD13 ILE 13 HD13 ILE 13 2.568 -2.467 -7.870 104 H GLY 14 H GLY 14 6.093 -4.836 -7.917 105 HA2 GLY 14 HA3 GLY 14 5.690 -7.329 -6.479 106 HA3 GLY 14 HA2 GLY 14 4.295 -6.693 -7.336 107 H LYS 15 H LYS 15 4.906 -9.037 -8.154 108 HA LYS 15 HA LYS 15 6.335 -8.650 -10.692 109 HB2 LYS 15 HB3 LYS 15 7.153 -10.968 -10.546 110 HB3 LYS 15 HB2 LYS 15 7.757 -9.982 -9.221 111 HG2 LYS 15 HG3 LYS 15 6.681 -11.185 -7.659 112 HG3 LYS 15 HG2 LYS 15 5.255 -11.418 -8.669 113 HD2 LYS 15 HD3 LYS 15 7.094 -12.901 -10.007 114 HD3 LYS 15 HD2 LYS 15 7.637 -13.107 -8.340 115 HE2 LYS 15 HE3 LYS 15 4.756 -13.457 -9.092 116 HE3 LYS 15 HE2 LYS 15 5.914 -14.771 -9.293 117 HZ1 LYS 15 HZ1 LYS 15 5.222 -15.202 -7.194 118 HZ2 LYS 15 HZ2 LYS 15 4.848 -13.590 -6.845 119 HZ3 LYS 15 HZ3 LYS 15 6.457 -14.111 -6.809 120 H ASP 16 H ASP 16 3.896 -8.136 -11.009 121 HA ASP 16 HA ASP 16 2.024 -8.674 -12.192 122 HB2 ASP 16 HB3 ASP 16 3.132 -11.478 -12.441 123 HB3 ASP 16 HB2 ASP 16 1.903 -10.723 -13.448 124 H GLY 17 H GLY 17 2.294 -8.965 -9.308 125 HA2 GLY 17 HA3 GLY 17 -0.224 -10.068 -8.711 126 HA3 GLY 17 HA2 GLY 17 1.018 -11.242 -8.298 127 H HIS 18 H HIS 18 2.989 -9.987 -7.159 128 HA HIS 18 HA HIS 18 2.397 -7.808 -5.476 129 HB2 HIS 18 HB3 HIS 18 2.137 -8.925 -3.328 130 HB3 HIS 18 HB2 HIS 18 0.866 -9.451 -4.426 131 HD1 HIS 18 HD1 HIS 18 2.025 -11.041 -1.892 132 HD2 HIS 18 HD2 HIS 18 2.845 -11.785 -5.897 133 HE1 HIS 18 HE1 HIS 18 2.738 -13.451 -1.996 134 HE2 HIS 18 HE2 HIS 18 3.140 -13.903 -4.442 135 H LEU 19 H LEU 19 3.981 -8.280 -3.297 136 HA LEU 19 HA LEU 19 6.573 -8.059 -4.391 137 HB2 LEU 19 HB3 LEU 19 7.327 -8.119 -2.015 138 HB3 LEU 19 HB2 LEU 19 6.100 -6.917 -2.362 139 HG LEU 19 HG LEU 19 4.549 -8.993 -1.541 140 HD11 LEU 19 HD11 LEU 19 5.914 -10.556 -0.681 141 HD12 LEU 19 HD12 LEU 19 5.967 -9.474 0.710 142 HD13 LEU 19 HD13 LEU 19 7.257 -9.431 -0.491 143 HD21 LEU 19 HD21 LEU 19 5.773 -7.145 0.473 144 HD22 LEU 19 HD22 LEU 19 4.105 -7.704 0.339 145 HD23 LEU 19 HD23 LEU 19 4.735 -6.523 -0.810 146 HA PRO 20 HA PRO 20 7.350 -12.480 -4.582 147 HB2 PRO 20 HB3 PRO 20 9.670 -12.370 -5.920 148 HB3 PRO 20 HB2 PRO 20 8.127 -12.028 -6.708 149 HG2 PRO 20 HG3 PRO 20 10.199 -10.125 -5.691 150 HG3 PRO 20 HG2 PRO 20 9.257 -10.057 -7.190 151 HD2 PRO 20 HD3 PRO 20 8.658 -8.624 -4.922 152 HD3 PRO 20 HD2 PRO 20 7.469 -9.075 -6.158 153 H TRP 21 H TRP 21 9.071 -10.145 -2.810 154 HA TRP 21 HA TRP 21 11.102 -12.015 -1.883 155 HB2 TRP 21 HB3 TRP 21 11.788 -10.024 -0.441 156 HB3 TRP 21 HB2 TRP 21 11.955 -9.830 -2.183 157 HD1 TRP 21 HD1 TRP 21 9.266 -8.997 0.499 158 HE1 TRP 21 HE1 TRP 21 8.242 -6.714 -0.099 159 HE3 TRP 21 HE3 TRP 21 11.839 -8.065 -3.816 160 HZ2 TRP 21 HZ2 TRP 21 8.489 -4.775 -2.139 161 HZ3 TRP 21 HZ3 TRP 21 11.387 -5.975 -5.031 162 HH2 TRP 21 HH2 TRP 21 9.746 -4.365 -4.209 163 H HIS 22 H HIS 22 11.166 -12.951 0.102 164 HA HIS 22 HA HIS 22 8.684 -12.984 1.599 165 HB2 HIS 22 HB3 HIS 22 10.358 -14.973 1.007 166 HB3 HIS 22 HB2 HIS 22 11.089 -14.479 2.531 167 HD1 HIS 22 HD1 HIS 22 8.081 -13.726 3.655 168 HD2 HIS 22 HD2 HIS 22 9.503 -17.370 2.255 169 HE1 HIS 22 HE1 HIS 22 6.593 -15.470 4.689 170 HE2 HIS 22 HE2 HIS 22 7.420 -17.661 3.761 171 H LEU 23 H LEU 23 8.726 -10.851 2.444 172 HA LEU 23 HA LEU 23 10.812 -10.303 4.432 173 HB2 LEU 23 HB3 LEU 23 9.122 -8.649 2.689 174 HB3 LEU 23 HB2 LEU 23 9.267 -8.046 4.329 175 HG LEU 23 HG LEU 23 11.780 -8.218 4.043 176 HD11 LEU 23 HD11 LEU 23 12.736 -8.774 2.083 177 HD12 LEU 23 HD12 LEU 23 11.452 -8.037 1.125 178 HD13 LEU 23 HD13 LEU 23 11.222 -9.640 1.824 179 HD21 LEU 23 HD21 LEU 23 10.987 -6.052 4.027 180 HD22 LEU 23 HD22 LEU 23 10.009 -6.308 2.582 181 HD23 LEU 23 HD23 LEU 23 11.761 -6.162 2.446 182 HA PRO 24 HA PRO 24 7.481 -11.697 7.235 183 HB2 PRO 24 HB3 PRO 24 9.139 -12.034 9.377 184 HB3 PRO 24 HB2 PRO 24 8.896 -13.260 8.129 185 HG2 PRO 24 HG3 PRO 24 11.120 -11.281 8.435 186 HG3 PRO 24 HG2 PRO 24 11.201 -12.996 7.990 187 HD2 PRO 24 HD3 PRO 24 11.374 -11.032 6.154 188 HD3 PRO 24 HD2 PRO 24 10.592 -12.586 5.798 189 H ASP 25 H ASP 25 9.820 -9.133 7.519 190 HA ASP 25 HA ASP 25 8.718 -7.948 9.865 191 HB2 ASP 25 HB3 ASP 25 10.141 -5.985 9.106 192 HB3 ASP 25 HB2 ASP 25 10.998 -7.483 9.430 193 H ASP 26 H ASP 26 8.251 -7.563 6.403 194 HA ASP 26 HA ASP 26 6.698 -5.170 6.618 195 HB2 ASP 26 HB3 ASP 26 7.824 -6.732 4.520 196 HB3 ASP 26 HB2 ASP 26 6.104 -6.554 4.192 197 H LEU 27 H LEU 27 5.826 -8.542 5.807 198 HA LEU 27 HA LEU 27 3.084 -8.201 5.715 199 HB2 LEU 27 HB3 LEU 27 3.019 -10.651 6.267 200 HB3 LEU 27 HB2 LEU 27 3.991 -10.207 4.885 201 HG LEU 27 HG LEU 27 5.899 -10.197 6.779 202 HD11 LEU 27 HD11 LEU 27 3.808 -11.133 8.241 203 HD12 LEU 27 HD12 LEU 27 5.506 -11.458 8.586 204 HD13 LEU 27 HD13 LEU 27 4.549 -12.633 7.684 205 HD21 LEU 27 HD21 LEU 27 6.355 -11.442 4.905 206 HD22 LEU 27 HD22 LEU 27 4.834 -12.330 4.991 207 HD23 LEU 27 HD23 LEU 27 6.145 -12.718 6.104 208 H HIS 28 H HIS 28 5.102 -9.192 8.478 209 HA HIS 28 HA HIS 28 3.005 -9.439 10.331 210 HB2 HIS 28 HB3 HIS 28 5.523 -10.150 10.479 211 HB3 HIS 28 HB2 HIS 28 5.740 -8.549 11.179 212 HD1 HIS 28 HD1 HIS 28 5.210 -8.302 13.608 213 HD2 HIS 28 HD2 HIS 28 3.694 -11.825 12.008 214 HE1 HIS 28 HE1 HIS 28 4.326 -9.604 15.569 215 HE2 HIS 28 HE2 HIS 28 3.483 -11.765 14.586 216 H TYR 29 H TYR 29 5.186 -6.719 9.642 217 HA TYR 29 HA TYR 29 4.060 -4.961 11.547 218 HB2 TYR 29 HB3 TYR 29 6.311 -4.713 10.446 219 HB3 TYR 29 HB2 TYR 29 5.474 -4.190 8.989 220 HD1 TYR 29 HD1 TYR 29 5.390 -3.376 12.643 221 HD2 TYR 29 HD2 TYR 29 5.435 -1.915 8.646 222 HE1 TYR 29 HE1 TYR 29 5.375 -1.068 13.492 223 HE2 TYR 29 HE2 TYR 29 5.420 0.395 9.486 224 HH TYR 29 HH TYR 29 4.824 1.637 11.455 225 H PHE 30 H PHE 30 3.132 -5.886 8.338 226 HA PHE 30 HA PHE 30 1.576 -3.691 7.587 227 HB2 PHE 30 HB3 PHE 30 2.147 -6.221 6.547 228 HB3 PHE 30 HB2 PHE 30 0.398 -6.208 6.743 229 HD1 PHE 30 HD1 PHE 30 3.170 -4.131 5.375 230 HD2 PHE 30 HD2 PHE 30 -0.912 -5.295 5.083 231 HE1 PHE 30 HE1 PHE 30 2.955 -2.841 3.291 232 HE2 PHE 30 HE2 PHE 30 -1.135 -4.008 2.998 233 HZ PHE 30 HZ PHE 30 0.801 -2.779 2.099 234 H ARG 31 H ARG 31 0.583 -6.686 9.241 235 HA ARG 31 HA ARG 31 -2.056 -5.621 9.756 236 HB2 ARG 31 HB3 ARG 31 -1.649 -8.028 9.236 237 HB3 ARG 31 HB2 ARG 31 -0.807 -8.177 10.772 238 HG2 ARG 31 HG3 ARG 31 -3.312 -7.011 11.326 239 HG3 ARG 31 HG2 ARG 31 -3.600 -8.357 10.222 240 HD2 ARG 31 HD3 ARG 31 -2.166 -8.436 12.872 241 HD3 ARG 31 HD2 ARG 31 -3.716 -9.176 12.474 242 HE ARG 31 HE ARG 31 -2.023 -10.334 10.718 243 HH11 ARG 31 HH11 ARG 31 -1.934 -9.924 14.183 244 HH12 ARG 31 HH12 ARG 31 -1.036 -11.379 14.457 245 HH21 ARG 31 HH21 ARG 31 -0.843 -12.248 11.077 246 HH22 ARG 31 HH22 ARG 31 -0.416 -12.698 12.694 247 H ALA 32 H ALA 32 0.971 -5.950 11.434 248 HA ALA 32 HA ALA 32 0.085 -5.752 14.084 249 HB1 ALA 32 HB1 ALA 32 2.403 -6.334 13.316 250 HB2 ALA 32 HB2 ALA 32 2.324 -5.189 14.656 251 HB3 ALA 32 HB3 ALA 32 2.663 -4.614 13.024 252 H GLN 33 H GLN 33 0.546 -3.318 11.613 253 HA GLN 33 HA GLN 33 0.011 -1.182 13.542 254 HB2 GLN 33 HB3 GLN 33 1.254 -1.321 10.853 255 HB3 GLN 33 HB2 GLN 33 0.360 0.145 11.231 256 HG2 GLN 33 HG3 GLN 33 2.002 -0.461 13.456 257 HG3 GLN 33 HG2 GLN 33 2.989 -0.590 12.002 258 HE21 GLN 33 HE21 GLN 33 2.658 1.268 10.430 259 HE22 GLN 33 HE22 GLN 33 2.592 2.850 11.120 260 H THR 34 H THR 34 -1.421 -2.891 10.871 261 HA THR 34 HA THR 34 -3.643 -1.002 10.722 262 HB THR 34 HB THR 34 -4.338 -2.197 8.758 263 HG1 THR 34 HG1 THR 34 -2.989 -4.064 8.125 264 HG21 THR 34 HG21 THR 34 -1.417 -1.637 8.920 265 HG22 THR 34 HG22 THR 34 -2.678 -0.789 8.025 266 HG23 THR 34 HG23 THR 34 -2.099 -2.357 7.462 267 H VAL 35 H VAL 35 -3.510 -2.283 13.162 268 HA VAL 35 HA VAL 35 -5.414 -4.488 13.083 269 HB VAL 35 HB VAL 35 -3.486 -4.684 14.586 270 HG11 VAL 35 HG11 VAL 35 -3.852 -2.031 15.106 271 HG12 VAL 35 HG12 VAL 35 -2.832 -3.118 16.048 272 HG13 VAL 35 HG13 VAL 35 -4.481 -2.780 16.573 273 HG21 VAL 35 HG21 VAL 35 -6.190 -4.503 15.899 274 HG22 VAL 35 HG22 VAL 35 -4.772 -5.197 16.685 275 HG23 VAL 35 HG23 VAL 35 -5.412 -5.929 15.214 276 H GLY 36 H GLY 36 -7.469 -3.870 12.817 277 HA2 GLY 36 HA3 GLY 36 -9.514 -3.087 13.632 278 HA3 GLY 36 HA2 GLY 36 -8.648 -2.125 14.818 279 H LYS 37 H LYS 37 -7.460 -1.795 11.641 280 HA LYS 37 HA LYS 37 -8.867 0.780 11.388 281 HB2 LYS 37 HB3 LYS 37 -6.140 -0.067 10.397 282 HB3 LYS 37 HB2 LYS 37 -6.906 1.459 9.978 283 HG2 LYS 37 HG3 LYS 37 -7.064 1.475 12.704 284 HG3 LYS 37 HG2 LYS 37 -5.527 0.657 12.422 285 HD2 LYS 37 HD3 LYS 37 -4.533 2.530 11.680 286 HD3 LYS 37 HD2 LYS 37 -5.947 3.023 10.747 287 HE2 LYS 37 HE3 LYS 37 -6.755 4.312 12.410 288 HE3 LYS 37 HE2 LYS 37 -6.254 3.182 13.667 289 HZ1 LYS 37 HZ1 LYS 37 -4.288 4.214 13.935 290 HZ2 LYS 37 HZ2 LYS 37 -5.102 5.541 13.273 291 HZ3 LYS 37 HZ3 LYS 37 -4.113 4.582 12.292 292 H ILE 38 H ILE 38 -8.440 1.441 8.817 293 HA ILE 38 HA ILE 38 -9.651 -0.773 7.296 294 HB ILE 38 HB ILE 38 -10.326 1.677 6.032 295 HG12 ILE 38 HG13 ILE 38 -11.317 1.659 8.880 296 HG13 ILE 38 HG12 ILE 38 -9.910 2.597 8.388 297 HG21 ILE 38 HG21 ILE 38 -12.343 0.190 7.608 298 HG22 ILE 38 HG22 ILE 38 -11.466 -0.697 6.362 299 HG23 ILE 38 HG23 ILE 38 -12.392 0.741 5.935 300 HD11 ILE 38 HD11 ILE 38 -12.776 3.019 7.798 301 HD12 ILE 38 HD12 ILE 38 -11.609 3.470 6.555 302 HD13 ILE 38 HD13 ILE 38 -11.505 4.186 8.164 303 H MET 39 H MET 39 -8.492 -1.458 5.638 304 HA MET 39 HA MET 39 -6.463 0.348 4.495 305 HB2 MET 39 HB3 MET 39 -5.513 -1.643 5.539 306 HB3 MET 39 HB2 MET 39 -6.546 -2.674 4.560 307 HG2 MET 39 HG3 MET 39 -5.407 -1.658 2.541 308 HG3 MET 39 HG2 MET 39 -4.239 -0.975 3.671 309 HE1 MET 39 HE1 MET 39 -5.880 -4.582 4.304 310 HE2 MET 39 HE2 MET 39 -4.963 -5.488 3.100 311 HE3 MET 39 HE3 MET 39 -6.049 -4.194 2.592 312 H VAL 40 H VAL 40 -6.529 0.850 2.382 313 HA VAL 40 HA VAL 40 -8.779 -0.153 0.815 314 HB VAL 40 HB VAL 40 -6.824 2.016 0.052 315 HG11 VAL 40 HG11 VAL 40 -9.640 1.537 -0.903 316 HG12 VAL 40 HG12 VAL 40 -8.205 0.950 -1.743 317 HG13 VAL 40 HG13 VAL 40 -8.464 2.683 -1.546 318 HG21 VAL 40 HG21 VAL 40 -7.702 3.093 1.833 319 HG22 VAL 40 HG22 VAL 40 -9.117 2.042 1.906 320 HG23 VAL 40 HG23 VAL 40 -9.057 3.360 0.736 321 H VAL 41 H VAL 41 -8.540 -1.737 -0.604 322 HA VAL 41 HA VAL 41 -5.859 -2.218 -1.725 323 HB VAL 41 HB VAL 41 -7.202 -3.955 -0.155 324 HG11 VAL 41 HG11 VAL 41 -8.953 -4.060 -2.060 325 HG12 VAL 41 HG12 VAL 41 -8.430 -5.553 -1.283 326 HG13 VAL 41 HG13 VAL 41 -7.773 -5.099 -2.856 327 HG21 VAL 41 HG21 VAL 41 -5.818 -5.597 -1.960 328 HG22 VAL 41 HG22 VAL 41 -5.223 -4.901 -0.453 329 HG23 VAL 41 HG23 VAL 41 -4.993 -4.038 -1.973 330 H GLY 42 H GLY 42 -5.732 -2.949 -3.917 331 HA2 GLY 42 HA3 GLY 42 -7.860 -1.813 -5.563 332 HA3 GLY 42 HA2 GLY 42 -6.251 -2.261 -6.109 333 H ARG 43 H ARG 43 -8.291 -2.946 -7.688 334 HA ARG 43 HA ARG 43 -9.649 -5.297 -7.267 335 HB2 ARG 43 HB3 ARG 43 -10.086 -3.933 -9.201 336 HB3 ARG 43 HB2 ARG 43 -8.466 -4.216 -9.820 337 HG2 ARG 43 HG3 ARG 43 -9.076 -6.660 -9.960 338 HG3 ARG 43 HG2 ARG 43 -10.739 -6.170 -9.631 339 HD2 ARG 43 HD3 ARG 43 -9.057 -5.139 -11.911 340 HD3 ARG 43 HD2 ARG 43 -10.245 -6.436 -12.042 341 HE ARG 43 HE ARG 43 -11.190 -3.887 -11.004 342 HH11 ARG 43 HH11 ARG 43 -10.889 -6.018 -13.759 343 HH12 ARG 43 HH12 ARG 43 -12.197 -5.285 -14.623 344 HH21 ARG 43 HH21 ARG 43 -12.912 -2.936 -12.140 345 HH22 ARG 43 HH22 ARG 43 -13.344 -3.534 -13.706 346 H ARG 44 H ARG 44 -6.588 -5.053 -9.081 347 HA ARG 44 HA ARG 44 -6.111 -7.809 -9.213 348 HB2 ARG 44 HB3 ARG 44 -4.859 -5.484 -10.135 349 HB3 ARG 44 HB2 ARG 44 -3.652 -6.278 -9.135 350 HG2 ARG 44 HG3 ARG 44 -3.185 -7.314 -11.084 351 HG3 ARG 44 HG2 ARG 44 -4.469 -8.393 -10.533 352 HD2 ARG 44 HD3 ARG 44 -5.138 -5.987 -12.177 353 HD3 ARG 44 HD2 ARG 44 -4.518 -7.440 -12.958 354 HE ARG 44 HE ARG 44 -7.133 -7.053 -11.866 355 HH11 ARG 44 HH11 ARG 44 -4.686 -9.445 -12.553 356 HH12 ARG 44 HH12 ARG 44 -5.816 -10.753 -12.659 357 HH21 ARG 44 HH21 ARG 44 -8.621 -8.772 -12.007 358 HH22 ARG 44 HH22 ARG 44 -8.050 -10.371 -12.350 359 H THR 45 H THR 45 -5.726 -5.598 -6.618 360 HA THR 45 HA THR 45 -3.720 -7.106 -5.232 361 HB THR 45 HB THR 45 -5.484 -5.138 -3.841 362 HG1 THR 45 HG1 THR 45 -5.083 -3.999 -5.659 363 HG21 THR 45 HG21 THR 45 -3.790 -5.949 -2.449 364 HG22 THR 45 HG22 THR 45 -3.211 -4.380 -3.008 365 HG23 THR 45 HG23 THR 45 -2.579 -5.861 -3.728 366 H TYR 46 H TYR 46 -7.234 -6.590 -4.707 367 HA TYR 46 HA TYR 46 -7.508 -8.185 -2.473 368 HB2 TYR 46 HB3 TYR 46 -9.844 -8.339 -2.934 369 HB3 TYR 46 HB2 TYR 46 -9.314 -6.762 -3.495 370 HD1 TYR 46 HD2 TYR 46 -9.712 -10.228 -4.870 371 HD2 TYR 46 HD1 TYR 46 -10.184 -6.044 -5.508 372 HE1 TYR 46 HE2 TYR 46 -10.696 -10.678 -7.065 373 HE2 TYR 46 HE1 TYR 46 -11.185 -6.497 -7.705 374 HH TYR 46 HH TYR 46 -10.912 -8.711 -9.437 375 H GLU 47 H GLU 47 -7.486 -9.190 -5.873 376 HA GLU 47 HA GLU 47 -7.880 -11.962 -5.206 377 HB2 GLU 47 HB3 GLU 47 -7.933 -10.353 -7.573 378 HB3 GLU 47 HB2 GLU 47 -6.837 -11.704 -7.832 379 HG2 GLU 47 HG3 GLU 47 -8.510 -13.283 -7.486 380 HG3 GLU 47 HG2 GLU 47 -9.568 -12.115 -6.699 381 H SER 48 H SER 48 -5.217 -9.822 -5.511 382 HA SER 48 HA SER 48 -3.343 -12.096 -5.546 383 HB2 SER 48 HB3 SER 48 -2.727 -9.202 -6.171 384 HB3 SER 48 HB2 SER 48 -1.651 -10.583 -6.382 385 HG SER 48 HG SER 48 -3.307 -11.398 -7.867 386 H PHE 49 H PHE 49 -4.788 -11.041 -3.178 387 HA PHE 49 HA PHE 49 -2.560 -9.946 -1.620 388 HB2 PHE 49 HB3 PHE 49 -5.186 -9.200 -1.662 389 HB3 PHE 49 HB2 PHE 49 -5.154 -10.280 -0.272 390 HD1 PHE 49 HD1 PHE 49 -2.979 -7.590 -1.691 391 HD2 PHE 49 HD2 PHE 49 -4.860 -9.256 1.744 392 HE1 PHE 49 HE1 PHE 49 -2.039 -5.786 -0.306 393 HE2 PHE 49 HE2 PHE 49 -3.922 -7.455 3.133 394 HZ PHE 49 HZ PHE 49 -2.511 -5.717 2.108 395 HA PRO 50 HA PRO 50 -1.747 -14.018 0.021 396 HB2 PRO 50 HB3 PRO 50 -0.486 -12.519 2.241 397 HB3 PRO 50 HB2 PRO 50 0.208 -13.741 1.171 398 HG2 PRO 50 HG3 PRO 50 0.849 -11.160 0.919 399 HG3 PRO 50 HG2 PRO 50 0.668 -12.208 -0.500 400 HD2 PRO 50 HD3 PRO 50 -1.220 -10.167 0.604 401 HD3 PRO 50 HD2 PRO 50 -0.825 -10.543 -1.086 402 H LYS 51 H LYS 51 -3.221 -11.421 1.851 403 HA LYS 51 HA LYS 51 -4.688 -13.426 3.411 404 HB2 LYS 51 HB3 LYS 51 -2.677 -11.925 4.529 405 HB3 LYS 51 HB2 LYS 51 -4.102 -10.964 4.898 406 HG2 LYS 51 HG3 LYS 51 -3.889 -12.352 6.740 407 HG3 LYS 51 HG2 LYS 51 -5.111 -13.163 5.759 408 HD2 LYS 51 HD3 LYS 51 -3.494 -14.729 4.929 409 HD3 LYS 51 HD2 LYS 51 -2.175 -13.844 5.698 410 HE2 LYS 51 HE3 LYS 51 -2.678 -15.773 7.032 411 HE3 LYS 51 HE2 LYS 51 -3.207 -14.335 7.903 412 HZ1 LYS 51 HZ1 LYS 51 -5.072 -15.548 8.139 413 HZ2 LYS 51 HZ2 LYS 51 -4.779 -16.501 6.773 414 HZ3 LYS 51 HZ3 LYS 51 -5.433 -14.951 6.597 415 H ARG 52 H ARG 52 -6.387 -13.008 1.913 416 HA ARG 52 HA ARG 52 -7.745 -10.437 2.376 417 HB2 ARG 52 HB3 ARG 52 -8.807 -10.861 0.100 418 HB3 ARG 52 HB2 ARG 52 -7.112 -10.396 0.111 419 HG2 ARG 52 HG3 ARG 52 -6.589 -12.213 -1.033 420 HG3 ARG 52 HG2 ARG 52 -7.251 -13.229 0.246 421 HD2 ARG 52 HD3 ARG 52 -9.450 -13.120 -0.743 422 HD3 ARG 52 HD2 ARG 52 -8.879 -11.986 -1.966 423 HE ARG 52 HE ARG 52 -8.111 -13.762 -3.168 424 HH11 ARG 52 HH11 ARG 52 -8.482 -14.769 0.154 425 HH12 ARG 52 HH12 ARG 52 -8.097 -16.425 -0.174 426 HH21 ARG 52 HH21 ARG 52 -7.606 -15.941 -3.601 427 HH22 ARG 52 HH22 ARG 52 -7.600 -17.090 -2.305 428 HA PRO 53 HA PRO 53 -9.036 -9.672 3.336 429 HB2 PRO 53 HB3 PRO 53 -10.756 -9.412 5.405 430 HB3 PRO 53 HB2 PRO 53 -11.254 -9.254 3.720 431 HG2 PRO 53 HG3 PRO 53 -11.794 -11.412 5.635 432 HG3 PRO 53 HG2 PRO 53 -12.651 -10.988 4.146 433 HD2 PRO 53 HD3 PRO 53 -10.719 -13.075 4.557 434 HD3 PRO 53 HD2 PRO 53 -11.592 -12.665 3.069 435 H LEU 54 H LEU 54 -8.360 -8.609 5.424 436 HA LEU 54 HA LEU 54 -6.570 -10.394 6.834 437 HB2 LEU 54 HB3 LEU 54 -6.953 -7.415 6.829 438 HB3 LEU 54 HB2 LEU 54 -5.868 -8.207 7.956 439 HG LEU 54 HG LEU 54 -5.349 -9.057 5.235 440 HD11 LEU 54 HD11 LEU 54 -5.628 -7.140 4.144 441 HD12 LEU 54 HD12 LEU 54 -4.255 -6.527 5.066 442 HD13 LEU 54 HD13 LEU 54 -5.899 -6.238 5.634 443 HD21 LEU 54 HD21 LEU 54 -3.967 -8.912 7.541 444 HD22 LEU 54 HD22 LEU 54 -3.384 -7.456 6.736 445 HD23 LEU 54 HD23 LEU 54 -3.213 -9.026 5.951 446 HA PRO 55 HA PRO 55 -9.248 -10.900 10.323 447 HB2 PRO 55 HB3 PRO 55 -7.483 -11.895 12.097 448 HB3 PRO 55 HB2 PRO 55 -8.044 -12.824 10.701 449 HG2 PRO 55 HG3 PRO 55 -5.494 -11.296 11.058 450 HG3 PRO 55 HG2 PRO 55 -5.746 -12.903 10.350 451 HD2 PRO 55 HD3 PRO 55 -5.433 -10.648 8.856 452 HD3 PRO 55 HD2 PRO 55 -6.388 -12.044 8.319 453 H GLU 56 H GLU 56 -9.854 -9.912 12.183 454 HA GLU 56 HA GLU 56 -10.051 -8.270 13.731 455 HB2 GLU 56 HB3 GLU 56 -7.327 -9.275 13.937 456 HB3 GLU 56 HB2 GLU 56 -7.471 -7.619 14.510 457 HG2 GLU 56 HG3 GLU 56 -9.268 -9.845 15.429 458 HG3 GLU 56 HG2 GLU 56 -7.767 -9.406 16.242 459 H ARG 57 H ARG 57 -9.677 -7.469 10.901 460 HA ARG 57 HA ARG 57 -9.231 -4.662 11.450 461 HB2 ARG 57 HB3 ARG 57 -7.511 -4.260 9.910 462 HB3 ARG 57 HB2 ARG 57 -6.994 -5.693 10.781 463 HG2 ARG 57 HG3 ARG 57 -6.502 -6.273 8.623 464 HG3 ARG 57 HG2 ARG 57 -8.112 -6.968 8.807 465 HD2 ARG 57 HD3 ARG 57 -7.529 -5.573 6.685 466 HD3 ARG 57 HD2 ARG 57 -9.098 -5.381 7.460 467 HE ARG 57 HE ARG 57 -8.535 -3.228 7.987 468 HH11 ARG 57 HH11 ARG 57 -5.633 -4.955 7.111 469 HH12 ARG 57 HH12 ARG 57 -4.652 -3.529 7.058 470 HH21 ARG 57 HH21 ARG 57 -7.252 -1.354 7.913 471 HH22 ARG 57 HH22 ARG 57 -5.573 -1.481 7.509 472 H THR 58 H THR 58 -9.793 -3.287 9.542 473 HA THR 58 HA THR 58 -12.101 -4.468 8.181 474 HB THR 58 HB THR 58 -11.345 -1.549 8.306 475 HG1 THR 58 HG1 THR 58 -11.608 -2.206 10.410 476 HG21 THR 58 HG21 THR 58 -13.728 -1.161 7.990 477 HG22 THR 58 HG22 THR 58 -13.995 -2.900 7.859 478 HG23 THR 58 HG23 THR 58 -13.032 -2.061 6.642 479 H ASN 59 H ASN 59 -11.918 -5.069 6.127 480 HA ASN 59 HA ASN 59 -9.674 -4.034 4.555 481 HB2 ASN 59 HB3 ASN 59 -11.090 -6.050 3.116 482 HB3 ASN 59 HB2 ASN 59 -9.469 -6.123 3.794 483 HD21 ASN 59 HD21 ASN 59 -9.294 -6.765 6.057 484 HD22 ASN 59 HD22 ASN 59 -10.426 -7.910 6.685 485 H VAL 60 H VAL 60 -9.924 -3.211 2.474 486 HA VAL 60 HA VAL 60 -12.658 -2.515 1.655 487 HB VAL 60 HB VAL 60 -10.321 -0.610 1.840 488 HG11 VAL 60 HG11 VAL 60 -11.164 0.375 0.022 489 HG12 VAL 60 HG12 VAL 60 -12.493 0.883 1.065 490 HG13 VAL 60 HG13 VAL 60 -12.648 -0.577 0.087 491 HG21 VAL 60 HG21 VAL 60 -12.352 -1.247 3.657 492 HG22 VAL 60 HG22 VAL 60 -12.802 0.311 2.963 493 HG23 VAL 60 HG23 VAL 60 -11.229 0.111 3.734 494 H VAL 61 H VAL 61 -13.043 -2.950 -0.418 495 HA VAL 61 HA VAL 61 -10.755 -3.552 -2.160 496 HB VAL 61 HB VAL 61 -13.611 -4.516 -2.227 497 HG11 VAL 61 HG11 VAL 61 -12.218 -5.947 -4.145 498 HG12 VAL 61 HG12 VAL 61 -11.720 -4.277 -4.413 499 HG13 VAL 61 HG13 VAL 61 -13.432 -4.702 -4.440 500 HG21 VAL 61 HG21 VAL 61 -12.481 -6.738 -2.052 501 HG22 VAL 61 HG22 VAL 61 -12.271 -5.697 -0.644 502 HG23 VAL 61 HG23 VAL 61 -10.959 -5.880 -1.809 503 H LEU 62 H LEU 62 -10.381 -2.405 -3.950 504 HA LEU 62 HA LEU 62 -12.431 -0.467 -4.799 505 HB2 LEU 62 HB3 LEU 62 -10.345 0.478 -3.710 506 HB3 LEU 62 HB2 LEU 62 -9.457 -0.102 -5.106 507 HG LEU 62 HG LEU 62 -11.275 1.312 -6.419 508 HD11 LEU 62 HD11 LEU 62 -11.855 1.961 -3.731 509 HD12 LEU 62 HD12 LEU 62 -12.548 2.653 -5.198 510 HD13 LEU 62 HD13 LEU 62 -11.117 3.384 -4.469 511 HD21 LEU 62 HD21 LEU 62 -8.807 2.338 -5.039 512 HD22 LEU 62 HD22 LEU 62 -9.704 3.277 -6.233 513 HD23 LEU 62 HD23 LEU 62 -8.965 1.742 -6.691 514 H THR 63 H THR 63 -13.339 -1.566 -6.451 515 HA THR 63 HA THR 63 -11.602 -2.190 -8.739 516 HB THR 63 HB THR 63 -12.385 -4.259 -7.585 517 HG1 THR 63 HG1 THR 63 -13.608 -3.977 -10.119 518 HG21 THR 63 HG21 THR 63 -14.994 -4.511 -8.513 519 HG22 THR 63 HG22 THR 63 -14.938 -2.944 -7.706 520 HG23 THR 63 HG23 THR 63 -14.458 -4.402 -6.837 521 H HIS 64 H HIS 64 -12.391 -1.612 -10.756 522 HA HIS 64 HA HIS 64 -14.181 0.541 -10.882 523 HB2 HIS 64 HB3 HIS 64 -12.923 -1.239 -12.935 524 HB3 HIS 64 HB2 HIS 64 -14.181 -0.112 -13.424 525 HD1 HIS 64 HD1 HIS 64 -13.581 2.467 -12.319 526 HD2 HIS 64 HD2 HIS 64 -10.496 -0.142 -13.287 527 HE1 HIS 64 HE1 HIS 64 -11.539 3.909 -12.587 528 HE2 HIS 64 HE2 HIS 64 -9.704 2.319 -13.257 529 H GLN 65 H GLN 65 -14.671 -2.901 -11.316 530 HA GLN 65 HA GLN 65 -17.103 -3.021 -12.571 531 HB2 GLN 65 HB3 GLN 65 -15.706 -4.720 -10.586 532 HB3 GLN 65 HB2 GLN 65 -17.429 -5.010 -10.782 533 HG2 GLN 65 HG3 GLN 65 -17.199 -5.819 -12.889 534 HG3 GLN 65 HG2 GLN 65 -15.793 -4.814 -13.242 535 HE21 GLN 65 HE21 GLN 65 -13.973 -5.411 -11.460 536 HE22 GLN 65 HE22 GLN 65 -13.571 -7.091 -11.469 537 H GLU 66 H GLU 66 -19.157 -2.530 -12.099 538 HA GLU 66 HA GLU 66 -19.694 -1.100 -9.643 539 HB2 GLU 66 HB3 GLU 66 -21.945 -0.731 -10.657 540 HB3 GLU 66 HB2 GLU 66 -20.613 -0.162 -11.652 541 HG2 GLU 66 HG3 GLU 66 -21.556 -2.910 -12.167 542 HG3 GLU 66 HG2 GLU 66 -22.655 -1.601 -12.597 543 H ASP 67 H ASP 67 -20.530 -4.166 -11.125 544 HA ASP 67 HA ASP 67 -22.298 -4.832 -8.901 545 HB2 ASP 67 HB3 ASP 67 -22.462 -5.388 -11.574 546 HB3 ASP 67 HB2 ASP 67 -21.813 -6.896 -10.936 547 H TYR 68 H TYR 68 -19.226 -4.699 -8.794 548 HA TYR 68 HA TYR 68 -18.293 -7.349 -8.434 549 HB2 TYR 68 HB3 TYR 68 -16.804 -5.385 -8.780 550 HB3 TYR 68 HB2 TYR 68 -17.226 -4.816 -7.167 551 HD1 TYR 68 HD1 TYR 68 -15.592 -7.583 -9.015 552 HD2 TYR 68 HD2 TYR 68 -16.123 -5.659 -5.257 553 HE1 TYR 68 HE1 TYR 68 -13.780 -8.948 -8.066 554 HE2 TYR 68 HE2 TYR 68 -14.311 -7.018 -4.300 555 HH TYR 68 HH TYR 68 -12.977 -9.720 -5.939 556 H GLN 69 H GLN 69 -17.915 -8.520 -6.505 557 HA GLN 69 HA GLN 69 -19.397 -7.559 -4.152 558 HB2 GLN 69 HB3 GLN 69 -19.442 -10.387 -5.213 559 HB3 GLN 69 HB2 GLN 69 -20.263 -9.809 -3.769 560 HG2 GLN 69 HG3 GLN 69 -20.843 -9.046 -6.619 561 HG3 GLN 69 HG2 GLN 69 -21.854 -10.005 -5.540 562 HE21 GLN 69 HE21 GLN 69 -22.214 -7.390 -6.996 563 HE22 GLN 69 HE22 GLN 69 -22.776 -6.299 -5.780 564 H ALA 70 H ALA 70 -17.793 -7.133 -2.772 565 HA ALA 70 HA ALA 70 -15.606 -9.058 -2.453 566 HB1 ALA 70 HB1 ALA 70 -14.314 -7.361 -1.579 567 HB2 ALA 70 HB2 ALA 70 -15.709 -6.449 -1.004 568 HB3 ALA 70 HB3 ALA 70 -15.323 -6.478 -2.724 569 H GLN 71 H GLN 71 -16.342 -10.675 -1.172 570 HA GLN 71 HA GLN 71 -18.051 -10.242 1.072 571 HB2 GLN 71 HB3 GLN 71 -16.386 -12.702 0.564 572 HB3 GLN 71 HB2 GLN 71 -17.902 -12.585 1.446 573 HG2 GLN 71 HG3 GLN 71 -18.768 -13.376 -0.462 574 HG3 GLN 71 HG2 GLN 71 -18.694 -11.687 -0.960 575 HE21 GLN 71 HE21 GLN 71 -16.272 -14.265 -0.670 576 HE22 GLN 71 HE22 GLN 71 -15.691 -14.136 -2.292 577 H GLY 72 H GLY 72 -17.419 -9.332 2.910 578 HA2 GLY 72 HA3 GLY 72 -16.206 -9.536 4.965 579 HA3 GLY 72 HA2 GLY 72 -14.844 -10.168 4.057 580 H ALA 73 H ALA 73 -15.375 -7.887 2.042 581 HA ALA 73 HA ALA 73 -14.136 -5.749 3.649 582 HB1 ALA 73 HB1 ALA 73 -12.552 -6.982 2.140 583 HB2 ALA 73 HB2 ALA 73 -12.642 -5.241 1.873 584 HB3 ALA 73 HB3 ALA 73 -13.471 -6.346 0.776 585 H VAL 74 H VAL 74 -14.227 -3.588 2.465 586 HA VAL 74 HA VAL 74 -16.987 -3.085 1.760 587 HB VAL 74 HB VAL 74 -14.788 -1.030 1.690 588 HG11 VAL 74 HG11 VAL 74 -16.755 0.375 2.543 589 HG12 VAL 74 HG12 VAL 74 -17.766 -0.984 2.052 590 HG13 VAL 74 HG13 VAL 74 -16.782 -0.141 0.856 591 HG21 VAL 74 HG21 VAL 74 -15.837 -0.698 4.159 592 HG22 VAL 74 HG22 VAL 74 -14.358 -1.601 3.831 593 HG23 VAL 74 HG23 VAL 74 -15.889 -2.456 4.023 594 H VAL 75 H VAL 75 -17.756 -2.391 -0.211 595 HA VAL 75 HA VAL 75 -15.875 -2.689 -2.456 596 HB VAL 75 HB VAL 75 -18.869 -3.049 -2.526 597 HG11 VAL 75 HG11 VAL 75 -16.681 -3.372 -4.549 598 HG12 VAL 75 HG12 VAL 75 -18.215 -2.514 -4.697 599 HG13 VAL 75 HG13 VAL 75 -18.187 -4.278 -4.687 600 HG21 VAL 75 HG21 VAL 75 -18.578 -5.354 -2.358 601 HG22 VAL 75 HG22 VAL 75 -17.467 -4.712 -1.148 602 HG23 VAL 75 HG23 VAL 75 -16.852 -5.258 -2.708 603 H VAL 76 H VAL 76 -15.561 -1.106 -3.836 604 HA VAL 76 HA VAL 76 -17.503 1.010 -4.221 605 HB VAL 76 HB VAL 76 -15.949 2.834 -3.795 606 HG11 VAL 76 HG11 VAL 76 -15.871 1.163 -1.312 607 HG12 VAL 76 HG12 VAL 76 -17.403 1.748 -1.961 608 HG13 VAL 76 HG13 VAL 76 -16.152 2.895 -1.482 609 HG21 VAL 76 HG21 VAL 76 -14.037 0.786 -2.687 610 HG22 VAL 76 HG22 VAL 76 -13.780 2.524 -2.842 611 HG23 VAL 76 HG23 VAL 76 -13.888 1.518 -4.285 612 H HIS 77 H HIS 77 -16.490 2.628 -5.938 613 HA HIS 77 HA HIS 77 -14.719 1.157 -7.747 614 HB2 HIS 77 HB3 HIS 77 -17.095 2.470 -8.979 615 HB3 HIS 77 HB2 HIS 77 -16.156 1.089 -9.539 616 HD1 HIS 77 HD1 HIS 77 -16.432 -0.970 -7.474 617 HD2 HIS 77 HD2 HIS 77 -19.574 1.592 -8.383 618 HE1 HIS 77 HE1 HIS 77 -18.506 -2.146 -6.680 619 HE2 HIS 77 HE2 HIS 77 -20.404 -0.614 -7.317 620 H ASP 78 H ASP 78 -15.660 4.140 -6.393 621 HA ASP 78 HA ASP 78 -13.880 5.520 -8.288 622 HB2 ASP 78 HB3 ASP 78 -16.614 6.244 -7.387 623 HB3 ASP 78 HB2 ASP 78 -15.452 7.559 -7.538 624 H VAL 79 H VAL 79 -12.856 7.471 -7.427 625 HA VAL 79 HA VAL 79 -11.701 7.008 -4.898 626 HB VAL 79 HB VAL 79 -10.837 9.415 -5.258 627 HG11 VAL 79 HG11 VAL 79 -9.353 7.620 -5.557 628 HG12 VAL 79 HG12 VAL 79 -9.241 8.569 -7.039 629 HG13 VAL 79 HG13 VAL 79 -10.182 7.078 -7.016 630 HG21 VAL 79 HG21 VAL 79 -11.021 10.382 -7.384 631 HG22 VAL 79 HG22 VAL 79 -12.659 9.876 -6.977 632 HG23 VAL 79 HG23 VAL 79 -11.688 8.909 -8.087 633 H ALA 80 H ALA 80 -14.207 9.192 -6.048 634 HA ALA 80 HA ALA 80 -14.469 10.683 -3.657 635 HB1 ALA 80 HB1 ALA 80 -16.163 11.782 -4.703 636 HB2 ALA 80 HB2 ALA 80 -16.847 10.306 -5.386 637 HB3 ALA 80 HB3 ALA 80 -15.421 11.039 -6.121 638 H ALA 81 H ALA 81 -16.126 7.821 -4.915 639 HA ALA 81 HA ALA 81 -18.081 7.503 -2.983 640 HB1 ALA 81 HB1 ALA 81 -16.640 5.099 -4.009 641 HB2 ALA 81 HB2 ALA 81 -17.531 6.124 -5.135 642 HB3 ALA 81 HB3 ALA 81 -18.369 5.363 -3.783 643 H VAL 82 H VAL 82 -14.937 5.794 -2.999 644 HA VAL 82 HA VAL 82 -15.082 4.733 -0.459 645 HB VAL 82 HB VAL 82 -13.323 4.375 -2.338 646 HG11 VAL 82 HG11 VAL 82 -11.424 5.641 -2.401 647 HG12 VAL 82 HG12 VAL 82 -11.576 6.150 -0.719 648 HG13 VAL 82 HG13 VAL 82 -12.598 6.878 -1.956 649 HG21 VAL 82 HG21 VAL 82 -11.837 3.325 -0.799 650 HG22 VAL 82 HG22 VAL 82 -13.468 3.196 -0.138 651 HG23 VAL 82 HG23 VAL 82 -12.347 4.395 0.507 652 H PHE 83 H PHE 83 -14.169 7.985 -1.437 653 HA PHE 83 HA PHE 83 -12.967 8.800 0.962 654 HB2 PHE 83 HB3 PHE 83 -14.225 10.190 -1.354 655 HB3 PHE 83 HB2 PHE 83 -13.970 11.124 0.114 656 HD1 PHE 83 HD2 PHE 83 -11.438 10.066 1.105 657 HD2 PHE 83 HD1 PHE 83 -12.663 10.950 -2.873 658 HE1 PHE 83 HE2 PHE 83 -9.089 10.422 0.465 659 HE2 PHE 83 HE1 PHE 83 -10.316 11.307 -3.521 660 HZ PHE 83 HZ PHE 83 -8.527 11.043 -1.851 661 H ALA 84 H ALA 84 -16.354 8.933 -0.100 662 HA ALA 84 HA ALA 84 -17.367 10.259 2.160 663 HB1 ALA 84 HB1 ALA 84 -18.566 8.451 0.099 664 HB2 ALA 84 HB2 ALA 84 -18.893 10.154 0.423 665 HB3 ALA 84 HB3 ALA 84 -19.514 8.914 1.513 666 H TYR 85 H TYR 85 -16.744 6.878 1.481 667 HA TYR 85 HA TYR 85 -17.885 5.828 3.842 668 HB2 TYR 85 HB3 TYR 85 -17.354 3.903 2.823 669 HB3 TYR 85 HB2 TYR 85 -16.457 4.801 1.607 670 HD1 TYR 85 HD1 TYR 85 -16.022 3.461 5.075 671 HD2 TYR 85 HD2 TYR 85 -14.237 4.315 1.315 672 HE1 TYR 85 HE1 TYR 85 -13.935 2.405 5.836 673 HE2 TYR 85 HE2 TYR 85 -12.141 3.261 2.062 674 HH TYR 85 HH TYR 85 -11.056 2.851 4.489 675 H ALA 86 H ALA 86 -14.428 6.386 3.074 676 HA ALA 86 HA ALA 86 -13.317 6.004 5.515 677 HB1 ALA 86 HB1 ALA 86 -11.534 7.509 4.872 678 HB2 ALA 86 HB2 ALA 86 -12.569 8.253 3.653 679 HB3 ALA 86 HB3 ALA 86 -12.061 6.574 3.473 680 H LYS 87 H LYS 87 -15.221 8.783 4.526 681 HA LYS 87 HA LYS 87 -14.591 10.363 6.828 682 HB2 LYS 87 HB3 LYS 87 -15.841 10.863 4.437 683 HB3 LYS 87 HB2 LYS 87 -17.203 10.825 5.548 684 HG2 LYS 87 HG3 LYS 87 -16.658 13.035 5.641 685 HG3 LYS 87 HG2 LYS 87 -15.675 12.417 6.970 686 HD2 LYS 87 HD3 LYS 87 -13.996 13.493 5.933 687 HD3 LYS 87 HD2 LYS 87 -13.988 12.090 4.863 688 HE2 LYS 87 HE3 LYS 87 -14.516 13.383 3.138 689 HE3 LYS 87 HE2 LYS 87 -15.988 13.903 3.957 690 HZ1 LYS 87 HZ1 LYS 87 -14.997 15.902 3.815 691 HZ2 LYS 87 HZ2 LYS 87 -13.436 15.262 3.690 692 HZ3 LYS 87 HZ3 LYS 87 -14.175 15.395 5.205 693 H GLN 88 H GLN 88 -17.230 8.251 5.870 694 HA GLN 88 HA GLN 88 -18.854 8.529 8.129 695 HB2 GLN 88 HB3 GLN 88 -19.035 7.143 5.791 696 HB3 GLN 88 HB2 GLN 88 -18.778 5.834 6.937 697 HG2 GLN 88 HG3 GLN 88 -21.014 5.912 7.102 698 HG3 GLN 88 HG2 GLN 88 -20.670 7.210 8.245 699 HE21 GLN 88 HE21 GLN 88 -20.074 9.311 6.718 700 HE22 GLN 88 HE22 GLN 88 -21.400 9.740 5.697 701 H HIS 89 H HIS 89 -15.843 6.926 7.746 702 HA HIS 89 HA HIS 89 -16.204 5.541 10.318 703 HB2 HIS 89 HB3 HIS 89 -14.721 4.879 7.837 704 HB3 HIS 89 HB2 HIS 89 -13.938 4.448 9.355 705 HD1 HIS 89 HD1 HIS 89 -16.349 3.492 10.974 706 HD2 HIS 89 HD2 HIS 89 -15.692 2.489 6.996 707 HE1 HIS 89 HE1 HIS 89 -17.629 1.360 10.598 708 HE2 HIS 89 HE2 HIS 89 -17.145 0.726 8.208 709 HA PRO 90 HA PRO 90 -13.192 8.995 11.096 710 HB2 PRO 90 HB3 PRO 90 -14.378 10.010 13.283 711 HB3 PRO 90 HB2 PRO 90 -14.913 10.433 11.651 712 HG2 PRO 90 HG3 PRO 90 -16.081 8.455 13.574 713 HG3 PRO 90 HG2 PRO 90 -16.910 9.643 12.552 714 HD2 PRO 90 HD3 PRO 90 -16.680 7.003 11.900 715 HD3 PRO 90 HD2 PRO 90 -16.811 8.300 10.696 716 H ASP 91 H ASP 91 -14.216 6.184 12.662 717 HA ASP 91 HA ASP 91 -12.550 6.500 15.009 718 HB2 ASP 91 HB3 ASP 91 -14.764 4.884 14.307 719 HB3 ASP 91 HB2 ASP 91 -13.419 3.790 14.613 720 H GLN 92 H GLN 92 -12.233 5.286 11.809 721 HA GLN 92 HA GLN 92 -9.646 4.077 12.536 722 HB2 GLN 92 HB3 GLN 92 -11.706 3.197 10.532 723 HB3 GLN 92 HB2 GLN 92 -10.021 2.720 10.371 724 HG2 GLN 92 HG3 GLN 92 -11.154 0.958 11.471 725 HG3 GLN 92 HG2 GLN 92 -10.153 1.769 12.674 726 HE21 GLN 92 HE21 GLN 92 -13.364 2.407 11.303 727 HE22 GLN 92 HE22 GLN 92 -14.183 2.496 12.821 728 H GLU 93 H GLU 93 -8.154 3.960 10.560 729 HA GLU 93 HA GLU 93 -8.305 6.527 9.119 730 HB2 GLU 93 HB3 GLU 93 -6.060 5.124 10.471 731 HB3 GLU 93 HB2 GLU 93 -5.688 5.989 8.986 732 HG2 GLU 93 HG3 GLU 93 -6.776 8.006 10.009 733 HG3 GLU 93 HG2 GLU 93 -6.841 7.107 11.525 734 H LEU 94 H LEU 94 -7.218 6.560 7.002 735 HA LEU 94 HA LEU 94 -7.704 4.039 5.584 736 HB2 LEU 94 HB3 LEU 94 -8.178 6.823 4.989 737 HB3 LEU 94 HB2 LEU 94 -7.217 6.084 3.723 738 HG LEU 94 HG LEU 94 -8.964 4.287 3.553 739 HD11 LEU 94 HD11 LEU 94 -10.308 6.086 5.539 740 HD12 LEU 94 HD12 LEU 94 -10.089 4.337 5.597 741 HD13 LEU 94 HD13 LEU 94 -11.235 5.046 4.458 742 HD21 LEU 94 HD21 LEU 94 -10.444 5.601 2.210 743 HD22 LEU 94 HD22 LEU 94 -8.819 6.265 2.041 744 HD23 LEU 94 HD23 LEU 94 -9.999 7.075 3.070 745 H VAL 95 H VAL 95 -6.086 2.897 4.741 746 HA VAL 95 HA VAL 95 -3.512 4.219 4.237 747 HB VAL 95 HB VAL 95 -3.727 1.526 5.584 748 HG11 VAL 95 HG11 VAL 95 -1.680 2.499 4.119 749 HG12 VAL 95 HG12 VAL 95 -1.480 1.390 5.475 750 HG13 VAL 95 HG13 VAL 95 -1.256 3.123 5.713 751 HG21 VAL 95 HG21 VAL 95 -3.237 2.520 7.655 752 HG22 VAL 95 HG22 VAL 95 -4.511 3.524 6.962 753 HG23 VAL 95 HG23 VAL 95 -2.834 4.068 6.914 754 H ILE 96 H ILE 96 -3.052 3.942 2.161 755 HA ILE 96 HA ILE 96 -4.256 1.850 0.603 756 HB ILE 96 HB ILE 96 -2.051 3.695 -0.299 757 HG12 ILE 96 HG13 ILE 96 -3.799 5.079 0.669 758 HG13 ILE 96 HG12 ILE 96 -3.855 5.208 -1.086 759 HG21 ILE 96 HG21 ILE 96 -2.707 3.203 -2.467 760 HG22 ILE 96 HG22 ILE 96 -4.300 2.637 -1.964 761 HG23 ILE 96 HG23 ILE 96 -2.873 1.650 -1.649 762 HD11 ILE 96 HD11 ILE 96 -5.765 3.889 0.779 763 HD12 ILE 96 HD12 ILE 96 -5.641 3.329 -0.889 764 HD13 ILE 96 HD13 ILE 96 -6.075 5.005 -0.551 765 H ALA 97 H ALA 97 -3.425 -0.068 0.054 766 HA ALA 97 HA ALA 97 -0.608 -0.596 0.746 767 HB1 ALA 97 HB1 ALA 97 -2.815 -2.642 0.682 768 HB2 ALA 97 HB2 ALA 97 -2.332 -1.770 2.137 769 HB3 ALA 97 HB3 ALA 97 -1.183 -2.831 1.322 770 H GLY 98 H GLY 98 -3.098 -0.875 -1.678 771 HA2 GLY 98 HA3 GLY 98 -1.401 -1.024 -3.848 772 HA3 GLY 98 HA2 GLY 98 -1.697 -2.691 -3.379 773 H GLY 99 H GLY 99 -4.195 -1.982 -5.939 774 HA2 GLY 99 HA3 GLY 99 -1.410 -2.571 -5.480 775 HA3 GLY 99 HA2 GLY 99 -2.267 -2.667 -7.009 776 H ALA 100 H ALA 100 -0.406 -1.715 -7.988 777 HA ALA 100 HA ALA 100 0.683 0.765 -7.306 778 HB1 ALA 100 HB1 ALA 100 0.701 -0.965 -9.702 779 HB2 ALA 100 HB2 ALA 100 2.042 -0.273 -8.789 780 HB3 ALA 100 HB3 ALA 100 1.149 0.725 -9.937 781 H GLN 101 H GLN 101 -2.078 -0.049 -9.350 782 HA GLN 101 HA GLN 101 -2.463 2.554 -10.403 783 HB2 GLN 101 HB3 GLN 101 -3.683 0.008 -10.664 784 HB3 GLN 101 HB2 GLN 101 -4.951 1.140 -10.217 785 HG2 GLN 101 HG3 GLN 101 -3.404 2.414 -12.188 786 HG3 GLN 101 HG2 GLN 101 -3.667 0.761 -12.741 787 HE21 GLN 101 HE21 GLN 101 -5.732 2.885 -10.811 788 HE22 GLN 101 HE22 GLN 101 -7.063 2.885 -11.912 789 H ILE 102 H ILE 102 -3.638 0.902 -7.531 790 HA ILE 102 HA ILE 102 -5.558 2.819 -6.755 791 HB ILE 102 HB ILE 102 -3.963 1.075 -4.881 792 HG12 ILE 102 HG13 ILE 102 -4.884 -0.288 -6.715 793 HG13 ILE 102 HG12 ILE 102 -5.684 -0.629 -5.186 794 HG21 ILE 102 HG21 ILE 102 -5.737 3.007 -4.271 795 HG22 ILE 102 HG22 ILE 102 -5.482 1.563 -3.290 796 HG23 ILE 102 HG23 ILE 102 -6.820 1.625 -4.437 797 HD11 ILE 102 HD11 ILE 102 -7.671 0.123 -5.908 798 HD12 ILE 102 HD12 ILE 102 -6.981 -0.217 -7.495 799 HD13 ILE 102 HD13 ILE 102 -6.957 1.426 -6.856 800 H PHE 103 H PHE 103 -2.123 2.439 -6.028 801 HA PHE 103 HA PHE 103 -1.852 4.440 -4.114 802 HB2 PHE 103 HB3 PHE 103 0.058 3.316 -6.153 803 HB3 PHE 103 HB2 PHE 103 0.550 4.577 -5.026 804 HD1 PHE 103 HD2 PHE 103 -0.794 3.781 -2.562 805 HD2 PHE 103 HD1 PHE 103 1.172 1.405 -5.494 806 HE1 PHE 103 HE2 PHE 103 -0.323 2.072 -0.856 807 HE2 PHE 103 HE1 PHE 103 1.645 -0.309 -3.794 808 HZ PHE 103 HZ PHE 103 0.898 0.024 -1.471 809 H THR 104 H THR 104 -1.578 4.647 -7.649 810 HA THR 104 HA THR 104 -0.821 7.291 -7.900 811 HB THR 104 HB THR 104 -2.702 5.758 -9.700 812 HG1 THR 104 HG1 THR 104 0.106 6.046 -9.896 813 HG21 THR 104 HG21 THR 104 -1.933 8.421 -9.902 814 HG22 THR 104 HG22 THR 104 -2.642 7.413 -11.163 815 HG23 THR 104 HG23 THR 104 -0.889 7.551 -11.026 816 H ALA 105 H ALA 105 -4.145 6.006 -7.729 817 HA ALA 105 HA ALA 105 -5.527 8.372 -8.091 818 HB1 ALA 105 HB1 ALA 105 -7.364 7.197 -7.538 819 HB2 ALA 105 HB2 ALA 105 -6.658 6.601 -6.036 820 HB3 ALA 105 HB3 ALA 105 -6.255 5.826 -7.568 821 H PHE 106 H PHE 106 -4.685 6.985 -4.886 822 HA PHE 106 HA PHE 106 -5.402 9.442 -3.611 823 HB2 PHE 106 HB3 PHE 106 -4.011 7.010 -2.476 824 HB3 PHE 106 HB2 PHE 106 -4.739 8.317 -1.547 825 HD1 PHE 106 HD2 PHE 106 -5.399 5.402 -3.669 826 HD2 PHE 106 HD1 PHE 106 -7.121 8.468 -1.273 827 HE1 PHE 106 HE2 PHE 106 -7.549 4.207 -3.695 828 HE2 PHE 106 HE1 PHE 106 -9.275 7.277 -1.291 829 HZ PHE 106 HZ PHE 106 -9.492 5.144 -2.506 830 H LYS 107 H LYS 107 -2.559 8.356 -5.154 831 HA LYS 107 HA LYS 107 -0.512 9.337 -3.600 832 HB2 LYS 107 HB3 LYS 107 0.843 9.319 -5.480 833 HB3 LYS 107 HB2 LYS 107 -0.429 8.204 -5.938 834 HG2 LYS 107 HG3 LYS 107 -0.735 9.377 -7.784 835 HG3 LYS 107 HG2 LYS 107 -1.267 10.744 -6.810 836 HD2 LYS 107 HD3 LYS 107 1.650 10.349 -6.998 837 HD3 LYS 107 HD2 LYS 107 0.839 10.816 -8.494 838 HE2 LYS 107 HE3 LYS 107 0.510 12.279 -5.881 839 HE3 LYS 107 HE2 LYS 107 1.696 12.722 -7.107 840 HZ1 LYS 107 HZ1 LYS 107 -0.473 13.962 -7.163 841 HZ2 LYS 107 HZ2 LYS 107 -1.200 12.529 -7.692 842 HZ3 LYS 107 HZ3 LYS 107 0.004 13.260 -8.627 843 H ASP 108 H ASP 108 -2.858 11.105 -5.468 844 HA ASP 108 HA ASP 108 -1.532 13.651 -5.022 845 HB2 ASP 108 HB3 ASP 108 -3.063 12.817 -7.067 846 HB3 ASP 108 HB2 ASP 108 -4.314 13.544 -6.064 847 H ASP 109 H ASP 109 -4.389 11.877 -3.954 848 HA ASP 109 HA ASP 109 -5.181 14.015 -2.150 849 HB2 ASP 109 HB3 ASP 109 -6.389 11.554 -3.199 850 HB3 ASP 109 HB2 ASP 109 -6.777 11.881 -1.513 851 H VAL 110 H VAL 110 -2.728 11.973 -1.916 852 HA VAL 110 HA VAL 110 -3.220 10.901 0.730 853 HB VAL 110 HB VAL 110 -1.940 9.592 -0.918 854 HG11 VAL 110 HG11 VAL 110 -0.754 11.871 -1.654 855 HG12 VAL 110 HG12 VAL 110 -0.039 10.284 -1.937 856 HG13 VAL 110 HG13 VAL 110 0.481 11.252 -0.558 857 HG21 VAL 110 HG21 VAL 110 -0.232 8.823 0.571 858 HG22 VAL 110 HG22 VAL 110 -1.622 9.310 1.541 859 HG23 VAL 110 HG23 VAL 110 -0.213 10.365 1.427 860 H ASP 111 H ASP 111 -1.740 11.278 2.522 861 HA ASP 111 HA ASP 111 -0.636 14.010 2.513 862 HB2 ASP 111 HB3 ASP 111 -2.595 12.780 4.266 863 HB3 ASP 111 HB2 ASP 111 -1.211 13.381 5.173 864 H THR 112 H THR 112 -0.321 10.718 3.766 865 HA THR 112 HA THR 112 2.452 11.355 4.529 866 HB THR 112 HB THR 112 0.692 9.158 5.632 867 HG1 THR 112 HG1 THR 112 0.000 11.130 6.408 868 HG21 THR 112 HG21 THR 112 2.899 8.412 5.895 869 HG22 THR 112 HG22 THR 112 2.462 9.137 7.441 870 HG23 THR 112 HG23 THR 112 3.484 10.023 6.310 871 H LEU 113 H LEU 113 4.042 9.652 4.215 872 HA LEU 113 HA LEU 113 3.326 7.643 2.210 873 HB2 LEU 113 HB3 LEU 113 4.650 9.997 1.585 874 HB3 LEU 113 HB2 LEU 113 5.941 8.822 1.734 875 HG LEU 113 HG LEU 113 4.961 7.438 0.019 876 HD11 LEU 113 HD11 LEU 113 2.563 8.617 0.739 877 HD12 LEU 113 HD12 LEU 113 2.827 7.521 -0.616 878 HD13 LEU 113 HD13 LEU 113 2.890 9.265 -0.867 879 HD21 LEU 113 HD21 LEU 113 4.764 9.440 -1.768 880 HD22 LEU 113 HD22 LEU 113 6.296 8.846 -1.126 881 HD23 LEU 113 HD23 LEU 113 5.548 10.286 -0.434 882 H LEU 114 H LEU 114 3.926 5.737 2.946 883 HA LEU 114 HA LEU 114 6.393 5.524 4.548 884 HB2 LEU 114 HB3 LEU 114 3.700 4.295 4.908 885 HB3 LEU 114 HB2 LEU 114 5.104 3.340 5.347 886 HG LEU 114 HG LEU 114 4.915 6.107 6.430 887 HD11 LEU 114 HD11 LEU 114 3.691 4.779 8.401 888 HD12 LEU 114 HD12 LEU 114 3.022 3.916 7.016 889 HD13 LEU 114 HD13 LEU 114 2.817 5.662 7.148 890 HD21 LEU 114 HD21 LEU 114 6.862 4.575 6.792 891 HD22 LEU 114 HD22 LEU 114 5.782 3.519 7.703 892 HD23 LEU 114 HD23 LEU 114 6.097 5.159 8.269 893 H VAL 115 H VAL 115 7.908 4.673 3.247 894 HA VAL 115 HA VAL 115 7.104 2.401 1.543 895 HB VAL 115 HB VAL 115 8.747 3.085 -0.113 896 HG11 VAL 115 HG11 VAL 115 7.090 5.507 0.514 897 HG12 VAL 115 HG12 VAL 115 6.363 3.999 -0.041 898 HG13 VAL 115 HG13 VAL 115 7.527 4.845 -1.061 899 HG21 VAL 115 HG21 VAL 115 10.424 4.150 1.183 900 HG22 VAL 115 HG22 VAL 115 9.284 5.344 1.803 901 HG23 VAL 115 HG23 VAL 115 9.766 5.382 0.107 902 H THR 116 H THR 116 8.595 0.766 1.169 903 HA THR 116 HA THR 116 10.873 0.656 3.034 904 HB THR 116 HB THR 116 8.901 -1.507 2.281 905 HG1 THR 116 HG1 THR 116 8.710 -1.623 4.569 906 HG21 THR 116 HG21 THR 116 10.198 -3.063 3.633 907 HG22 THR 116 HG22 THR 116 11.470 -1.855 3.807 908 HG23 THR 116 HG23 THR 116 11.101 -2.524 2.217 909 H ARG 117 H ARG 117 12.499 1.136 1.620 910 HA ARG 117 HA ARG 117 12.567 -0.118 -0.997 911 HB2 ARG 117 HB3 ARG 117 13.738 2.220 0.232 912 HB3 ARG 117 HB2 ARG 117 14.969 1.269 -0.588 913 HG2 ARG 117 HG3 ARG 117 14.351 2.353 -2.428 914 HG3 ARG 117 HG2 ARG 117 12.928 1.310 -2.419 915 HD2 ARG 117 HD3 ARG 117 11.812 3.041 -0.967 916 HD3 ARG 117 HD2 ARG 117 13.185 4.094 -1.302 917 HE ARG 117 HE ARG 117 11.006 3.496 -3.053 918 HH11 ARG 117 HH11 ARG 117 14.384 4.366 -2.953 919 HH12 ARG 117 HH12 ARG 117 14.371 5.098 -4.522 920 HH21 ARG 117 HH21 ARG 117 10.986 4.459 -5.117 921 HH22 ARG 117 HH22 ARG 117 12.442 5.151 -5.751 922 H LEU 118 H LEU 118 13.189 -2.182 -1.025 923 HA LEU 118 HA LEU 118 14.940 -3.367 0.856 924 HB2 LEU 118 HB3 LEU 118 13.645 -4.184 -1.685 925 HB3 LEU 118 HB2 LEU 118 15.057 -5.099 -1.191 926 HG LEU 118 HG LEU 118 13.929 -5.527 1.002 927 HD11 LEU 118 HD11 LEU 118 11.856 -3.873 -0.310 928 HD12 LEU 118 HD12 LEU 118 12.287 -4.016 1.395 929 HD13 LEU 118 HD13 LEU 118 11.305 -5.263 0.626 930 HD21 LEU 118 HD21 LEU 118 13.223 -6.597 -1.615 931 HD22 LEU 118 HD22 LEU 118 11.983 -6.871 -0.392 932 HD23 LEU 118 HD23 LEU 118 13.631 -7.434 -0.118 933 H ALA 119 H ALA 119 16.963 -4.565 0.115 934 HA ALA 119 HA ALA 119 18.729 -2.617 -1.132 935 HB1 ALA 119 HB1 ALA 119 19.033 -4.840 0.741 936 HB2 ALA 119 HB2 ALA 119 19.970 -3.355 0.580 937 HB3 ALA 119 HB3 ALA 119 20.319 -4.736 -0.461 938 H GLY 120 H GLY 120 17.676 -5.966 -1.601 939 HA2 GLY 120 HA3 GLY 120 19.308 -6.524 -3.830 940 HA3 GLY 120 HA2 GLY 120 17.825 -7.367 -3.412 941 H SER 121 H SER 121 18.903 -6.536 -6.025 942 HA SER 121 HA SER 121 16.916 -4.571 -6.899 943 HB2 SER 121 HB3 SER 121 19.589 -5.274 -7.745 944 HB3 SER 121 HB2 SER 121 18.471 -5.363 -9.106 945 HG SER 121 HG SER 121 19.325 -3.175 -7.646 946 H PHE 122 H PHE 122 15.074 -5.213 -7.791 947 HA PHE 122 HA PHE 122 14.963 -7.898 -9.003 948 HB2 PHE 122 HB3 PHE 122 12.818 -6.433 -7.455 949 HB3 PHE 122 HB2 PHE 122 12.566 -7.948 -8.316 950 HD1 PHE 122 HD2 PHE 122 14.671 -6.422 -5.655 951 HD2 PHE 122 HD1 PHE 122 12.899 -9.959 -7.224 952 HE1 PHE 122 HE2 PHE 122 15.401 -7.667 -3.663 953 HE2 PHE 122 HE1 PHE 122 13.625 -11.210 -5.234 954 HZ PHE 122 HZ PHE 122 14.878 -10.065 -3.451 955 H GLU 123 H GLU 123 13.231 -8.153 -10.640 956 HA GLU 123 HA GLU 123 12.519 -5.675 -12.024 957 HB2 GLU 123 HB3 GLU 123 13.238 -6.592 -14.184 958 HB3 GLU 123 HB2 GLU 123 14.591 -6.425 -13.075 959 HG2 GLU 123 HG3 GLU 123 13.568 -9.018 -12.705 960 HG3 GLU 123 HG2 GLU 123 13.651 -8.746 -14.445 961 H GLY 124 H GLY 124 10.593 -5.754 -13.132 962 HA2 GLY 124 HA3 GLY 124 9.273 -8.248 -13.692 963 HA3 GLY 124 HA2 GLY 124 8.570 -7.393 -12.328 964 H ASP 125 H ASP 125 6.689 -6.615 -13.057 965 HA ASP 125 HA ASP 125 6.786 -4.795 -15.352 966 HB2 ASP 125 HB3 ASP 125 5.723 -7.296 -15.618 967 HB3 ASP 125 HB2 ASP 125 4.301 -6.363 -15.160 968 H THR 126 H THR 126 6.680 -4.423 -12.430 969 HA THR 126 HA THR 126 4.405 -2.611 -12.399 970 HB THR 126 HB THR 126 4.742 -4.267 -9.945 971 HG1 THR 126 HG1 THR 126 3.220 -5.144 -12.168 972 HG21 THR 126 HG21 THR 126 2.608 -3.686 -9.452 973 HG22 THR 126 HG22 THR 126 2.116 -3.610 -11.144 974 HG23 THR 126 HG23 THR 126 3.057 -2.295 -10.440 975 H LYS 127 H LYS 127 5.504 -0.774 -12.132 976 HA LYS 127 HA LYS 127 7.456 -0.630 -9.925 977 HB2 LYS 127 HB3 LYS 127 8.352 1.378 -11.235 978 HB3 LYS 127 HB2 LYS 127 8.683 -0.220 -11.889 979 HG2 LYS 127 HG3 LYS 127 6.928 0.031 -13.518 980 HG3 LYS 127 HG2 LYS 127 6.448 1.574 -12.811 981 HD2 LYS 127 HD3 LYS 127 9.273 1.272 -13.673 982 HD3 LYS 127 HD2 LYS 127 8.045 1.419 -14.932 983 HE2 LYS 127 HE3 LYS 127 7.348 3.388 -13.133 984 HE3 LYS 127 HE2 LYS 127 9.110 3.428 -13.111 985 HZ1 LYS 127 HZ1 LYS 127 7.652 4.737 -14.890 986 HZ2 LYS 127 HZ2 LYS 127 7.857 3.285 -15.732 987 HZ3 LYS 127 HZ3 LYS 127 9.209 4.165 -15.224 988 H MET 128 H MET 128 7.639 1.598 -8.965 989 HA MET 128 HA MET 128 5.108 2.434 -8.035 990 HB2 MET 128 HB3 MET 128 7.303 2.625 -6.801 991 HB3 MET 128 HB2 MET 128 7.684 3.995 -7.835 992 HG2 MET 128 HG3 MET 128 6.802 4.635 -5.621 993 HG3 MET 128 HG2 MET 128 5.842 5.248 -6.966 994 HE1 MET 128 HE1 MET 128 2.670 4.790 -5.206 995 HE2 MET 128 HE2 MET 128 3.864 5.820 -5.996 996 HE3 MET 128 HE3 MET 128 4.050 5.401 -4.293 997 H ILE 129 H ILE 129 4.333 4.715 -8.116 998 HA ILE 129 HA ILE 129 4.537 5.724 -10.871 999 HB ILE 129 HB ILE 129 2.359 6.812 -10.464 1000 HG12 ILE 129 HG13 ILE 129 1.264 5.512 -8.305 1001 HG13 ILE 129 HG12 ILE 129 2.893 5.856 -7.736 1002 HG21 ILE 129 HG21 ILE 129 1.226 4.380 -9.933 1003 HG22 ILE 129 HG22 ILE 129 2.835 3.929 -10.498 1004 HG23 ILE 129 HG23 ILE 129 1.790 4.920 -11.515 1005 HD11 ILE 129 HD11 ILE 129 2.589 8.142 -7.867 1006 HD12 ILE 129 HD12 ILE 129 1.030 7.561 -7.288 1007 HD13 ILE 129 HD13 ILE 129 1.233 8.001 -8.984 1008 HA PRO 130 HA PRO 130 6.379 9.569 -9.781 1009 HB2 PRO 130 HB3 PRO 130 4.114 10.936 -11.141 1010 HB3 PRO 130 HB2 PRO 130 5.852 11.086 -11.421 1011 HG2 PRO 130 HG3 PRO 130 4.316 9.735 -13.124 1012 HG3 PRO 130 HG2 PRO 130 5.945 9.164 -12.716 1013 HD2 PRO 130 HD3 PRO 130 3.291 8.164 -11.772 1014 HD3 PRO 130 HD2 PRO 130 4.766 7.256 -12.163 1015 H LEU 131 H LEU 131 6.293 11.091 -8.179 1016 HA LEU 131 HA LEU 131 3.703 11.688 -6.944 1017 HB2 LEU 131 HB3 LEU 131 5.978 11.177 -5.103 1018 HB3 LEU 131 HB2 LEU 131 4.258 10.972 -4.839 1019 HG LEU 131 HG LEU 131 5.693 9.115 -6.699 1020 HD11 LEU 131 HD11 LEU 131 6.736 9.454 -4.258 1021 HD12 LEU 131 HD12 LEU 131 6.675 7.892 -5.074 1022 HD13 LEU 131 HD13 LEU 131 5.455 8.305 -3.870 1023 HD21 LEU 131 HD21 LEU 131 3.884 7.756 -6.410 1024 HD22 LEU 131 HD22 LEU 131 3.112 9.321 -6.156 1025 HD23 LEU 131 HD23 LEU 131 3.573 8.330 -4.772 1026 H ASN 132 H ASN 132 3.616 13.649 -5.802 1027 HA ASN 132 HA ASN 132 5.428 15.659 -6.732 1028 HB2 ASN 132 HB3 ASN 132 2.838 15.720 -5.935 1029 HB3 ASN 132 HB2 ASN 132 3.624 16.304 -4.472 1030 HD21 ASN 132 HD21 ASN 132 5.774 17.649 -5.649 1031 HD22 ASN 132 HD22 ASN 132 5.161 19.032 -6.483 1032 H TRP 133 H TRP 133 7.329 14.520 -5.825 1033 HA TRP 133 HA TRP 133 7.861 14.139 -3.152 1034 HB2 TRP 133 HB3 TRP 133 9.760 14.935 -5.361 1035 HB3 TRP 133 HB2 TRP 133 10.263 14.342 -3.780 1036 HD1 TRP 133 HD1 TRP 133 8.845 13.169 -7.102 1037 HE1 TRP 133 HE1 TRP 133 8.836 10.595 -7.152 1038 HE3 TRP 133 HE3 TRP 133 10.066 12.255 -2.221 1039 HZ2 TRP 133 HZ2 TRP 133 9.291 8.461 -5.362 1040 HZ3 TRP 133 HZ3 TRP 133 10.260 9.920 -1.471 1041 HH2 TRP 133 HH2 TRP 133 9.879 8.063 -3.010 1042 H ASP 134 H ASP 134 8.379 17.144 -5.041 1043 HA ASP 134 HA ASP 134 9.652 18.607 -3.052 1044 HB2 ASP 134 HB3 ASP 134 8.830 19.108 -5.613 1045 HB3 ASP 134 HB2 ASP 134 7.738 20.134 -4.688 1046 H ASP 135 H ASP 135 6.198 18.164 -3.685 1047 HA ASP 135 HA ASP 135 5.355 19.907 -1.586 1048 HB2 ASP 135 HB3 ASP 135 4.023 18.002 -3.451 1049 HB3 ASP 135 HB2 ASP 135 3.148 18.481 -1.999 1050 H PHE 136 H PHE 136 6.879 17.005 -1.399 1051 HA PHE 136 HA PHE 136 5.556 16.343 1.147 1052 HB2 PHE 136 HB3 PHE 136 6.497 14.573 -1.071 1053 HB3 PHE 136 HB2 PHE 136 6.592 13.977 0.582 1054 HD1 PHE 136 HD1 PHE 136 4.084 15.896 -1.414 1055 HD2 PHE 136 HD2 PHE 136 4.872 12.577 1.130 1056 HE1 PHE 136 HE1 PHE 136 1.709 15.262 -1.512 1057 HE2 PHE 136 HE2 PHE 136 2.498 11.937 1.036 1058 HZ PHE 136 HZ PHE 136 0.913 13.280 -0.286 1059 H THR 137 H THR 137 6.813 16.223 2.892 1060 HA THR 137 HA THR 137 9.724 16.467 2.499 1061 HB THR 137 HB THR 137 7.974 17.520 4.728 1062 HG1 THR 137 HG1 THR 137 8.154 19.382 3.754 1063 HG21 THR 137 HG21 THR 137 10.938 17.909 4.412 1064 HG22 THR 137 HG22 THR 137 10.190 16.807 5.568 1065 HG23 THR 137 HG23 THR 137 9.904 18.543 5.692 1066 H LYS 138 H LYS 138 11.063 15.062 3.461 1067 HA LYS 138 HA LYS 138 10.114 12.611 4.431 1068 HB2 LYS 138 HB3 LYS 138 12.356 12.979 3.414 1069 HB3 LYS 138 HB2 LYS 138 12.847 13.821 4.878 1070 HG2 LYS 138 HG3 LYS 138 13.158 11.919 6.020 1071 HG3 LYS 138 HG2 LYS 138 11.733 11.147 5.324 1072 HD2 LYS 138 HD3 LYS 138 13.494 9.884 4.476 1073 HD3 LYS 138 HD2 LYS 138 13.135 11.008 3.165 1074 HE2 LYS 138 HE3 LYS 138 15.032 12.197 4.948 1075 HE3 LYS 138 HE2 LYS 138 15.596 10.594 4.479 1076 HZ1 LYS 138 HZ1 LYS 138 14.986 11.379 2.119 1077 HZ2 LYS 138 HZ2 LYS 138 16.420 11.940 2.818 1078 HZ3 LYS 138 HZ3 LYS 138 15.054 12.936 2.777 1079 H VAL 139 H VAL 139 9.335 12.053 6.339 1080 HA VAL 139 HA VAL 139 9.597 13.901 8.582 1081 HB VAL 139 HB VAL 139 7.979 11.385 8.710 1082 HG11 VAL 139 HG11 VAL 139 8.222 12.728 10.721 1083 HG12 VAL 139 HG12 VAL 139 6.556 12.767 10.146 1084 HG13 VAL 139 HG13 VAL 139 7.617 14.146 9.865 1085 HG21 VAL 139 HG21 VAL 139 7.076 13.939 7.379 1086 HG22 VAL 139 HG22 VAL 139 6.068 12.532 7.721 1087 HG23 VAL 139 HG23 VAL 139 7.393 12.407 6.564 1088 H SER 140 H SER 140 10.474 10.644 7.609 1089 HA SER 140 HA SER 140 12.450 10.535 9.710 1090 HB2 SER 140 HB3 SER 140 10.108 9.659 10.577 1091 HB3 SER 140 HB2 SER 140 10.586 8.199 9.712 1092 HG SER 140 HG SER 140 12.215 7.893 11.083 1093 H SER 141 H SER 141 13.836 8.621 9.544 1094 HA SER 141 HA SER 141 13.633 6.968 7.196 1095 HB2 SER 141 HB3 SER 141 16.151 8.579 7.306 1096 HB3 SER 141 HB2 SER 141 15.373 7.808 5.924 1097 HG SER 141 HG SER 141 14.664 10.215 7.227 1098 H ARG 142 H ARG 142 14.376 5.029 7.738 1099 HA ARG 142 HA ARG 142 16.703 4.799 9.487 1100 HB2 ARG 142 HB3 ARG 142 14.765 4.706 10.992 1101 HB3 ARG 142 HB2 ARG 142 14.076 3.403 10.033 1102 HG2 ARG 142 HG3 ARG 142 16.365 2.232 10.575 1103 HG3 ARG 142 HG2 ARG 142 16.363 3.360 11.931 1104 HD2 ARG 142 HD3 ARG 142 14.031 2.536 12.447 1105 HD3 ARG 142 HD2 ARG 142 14.312 1.260 11.264 1106 HE ARG 142 HE ARG 142 16.440 1.041 12.914 1107 HH11 ARG 142 HH11 ARG 142 12.998 1.168 13.476 1108 HH12 ARG 142 HH12 ARG 142 13.068 0.188 14.902 1109 HH21 ARG 142 HH21 ARG 142 16.535 -0.247 14.789 1110 HH22 ARG 142 HH22 ARG 142 15.076 -0.615 15.648 1111 H THR 143 H THR 143 18.088 3.391 8.650 1112 HA THR 143 HA THR 143 17.171 1.575 6.560 1113 HB THR 143 HB THR 143 20.040 1.747 7.342 1114 HG1 THR 143 HG1 THR 143 18.537 3.855 6.233 1115 HG21 THR 143 HG21 THR 143 19.133 2.123 4.565 1116 HG22 THR 143 HG22 THR 143 18.847 0.537 5.283 1117 HG23 THR 143 HG23 THR 143 20.484 1.190 5.209 1118 H VAL 144 H VAL 144 16.536 -0.382 7.146 1119 HA VAL 144 HA VAL 144 17.786 -1.662 9.476 1120 HB VAL 144 HB VAL 144 15.281 -2.535 8.035 1121 HG11 VAL 144 HG11 VAL 144 15.736 -3.178 10.872 1122 HG12 VAL 144 HG12 VAL 144 16.815 -3.971 9.725 1123 HG13 VAL 144 HG13 VAL 144 15.069 -4.168 9.574 1124 HG21 VAL 144 HG21 VAL 144 14.445 -0.606 8.867 1125 HG22 VAL 144 HG22 VAL 144 15.719 -0.449 10.077 1126 HG23 VAL 144 HG23 VAL 144 14.365 -1.544 10.359 1127 H GLU 145 H GLU 145 19.014 -3.445 9.263 1128 HA GLU 145 HA GLU 145 19.081 -4.755 6.626 1129 HB2 GLU 145 HB3 GLU 145 21.551 -5.201 7.210 1130 HB3 GLU 145 HB2 GLU 145 21.104 -3.593 6.657 1131 HG2 GLU 145 HG3 GLU 145 21.547 -2.631 8.646 1132 HG3 GLU 145 HG2 GLU 145 21.040 -4.045 9.570 1133 H ASP 146 H ASP 146 19.361 -6.959 6.572 1134 HA ASP 146 HA ASP 146 19.107 -8.341 9.163 1135 HB2 ASP 146 HB3 ASP 146 17.668 -8.640 6.593 1136 HB3 ASP 146 HB2 ASP 146 18.115 -10.143 7.394 1137 H THR 147 H THR 147 19.557 -10.902 8.502 1138 HA THR 147 HA THR 147 22.341 -11.076 8.304 1139 HB THR 147 HB THR 147 21.654 -13.573 7.641 1140 HG1 THR 147 HG1 THR 147 19.339 -12.763 9.017 1141 HG21 THR 147 HG21 THR 147 22.540 -12.569 9.880 1142 HG22 THR 147 HG22 THR 147 21.797 -14.168 9.841 1143 HG23 THR 147 HG23 THR 147 20.865 -12.776 10.393 1144 H ASN 148 H ASN 148 19.815 -11.594 5.881 1145 HA ASN 148 HA ASN 148 21.715 -12.189 3.800 1146 HB2 ASN 148 HB3 ASN 148 18.880 -12.417 4.162 1147 HB3 ASN 148 HB2 ASN 148 19.191 -11.520 2.679 1148 HD21 ASN 148 HD21 ASN 148 17.983 -13.873 2.434 1149 HD22 ASN 148 HD22 ASN 148 19.054 -15.065 1.790 1150 HA PRO 149 HA PRO 149 22.632 -8.009 2.651 1151 HB2 PRO 149 HB3 PRO 149 23.239 -8.435 0.009 1152 HB3 PRO 149 HB2 PRO 149 24.348 -8.762 1.344 1153 HG2 PRO 149 HG3 PRO 149 22.582 -10.652 -0.160 1154 HG3 PRO 149 HG2 PRO 149 24.257 -10.873 0.381 1155 HD2 PRO 149 HD3 PRO 149 22.189 -11.963 1.707 1156 HD3 PRO 149 HD2 PRO 149 23.622 -11.349 2.558 1157 H ALA 150 H ALA 150 20.411 -9.946 0.723 1158 HA ALA 150 HA ALA 150 19.275 -7.645 -0.600 1159 HB1 ALA 150 HB1 ALA 150 19.454 -10.233 -1.315 1160 HB2 ALA 150 HB2 ALA 150 18.266 -9.112 -1.982 1161 HB3 ALA 150 HB3 ALA 150 17.812 -10.201 -0.672 1162 H LEU 151 H LEU 151 18.813 -9.211 2.389 1163 HA LEU 151 HA LEU 151 16.014 -8.522 2.634 1164 HB2 LEU 151 HB3 LEU 151 18.014 -9.753 4.512 1165 HB3 LEU 151 HB2 LEU 151 16.402 -9.304 5.034 1166 HG LEU 151 HG LEU 151 17.183 -11.426 3.048 1167 HD11 LEU 151 HD11 LEU 151 16.527 -12.915 4.605 1168 HD12 LEU 151 HD12 LEU 151 15.215 -11.890 5.189 1169 HD13 LEU 151 HD13 LEU 151 16.872 -11.589 5.716 1170 HD21 LEU 151 HD21 LEU 151 14.466 -10.214 3.525 1171 HD22 LEU 151 HD22 LEU 151 14.727 -11.769 2.735 1172 HD23 LEU 151 HD23 LEU 151 15.358 -10.293 2.006 1173 H THR 152 H THR 152 18.513 -6.565 2.521 1174 HA THR 152 HA THR 152 18.092 -5.047 4.948 1175 HB THR 152 HB THR 152 19.659 -4.152 2.533 1176 HG1 THR 152 HG1 THR 152 20.397 -5.969 4.565 1177 HG21 THR 152 HG21 THR 152 21.100 -3.410 4.676 1178 HG22 THR 152 HG22 THR 152 19.468 -3.296 5.335 1179 HG23 THR 152 HG23 THR 152 19.901 -2.384 3.889 1180 H HIS 153 H HIS 153 16.518 -3.603 5.181 1181 HA HIS 153 HA HIS 153 15.430 -2.317 2.762 1182 HB2 HIS 153 HB3 HIS 153 13.691 -2.612 5.157 1183 HB3 HIS 153 HB2 HIS 153 13.266 -2.626 3.450 1184 HD1 HIS 153 HD1 HIS 153 12.634 -4.763 5.890 1185 HD2 HIS 153 HD2 HIS 153 15.088 -5.237 2.570 1186 HE1 HIS 153 HE1 HIS 153 12.801 -7.246 5.525 1187 HE2 HIS 153 HE2 HIS 153 14.221 -7.505 3.462 1188 H THR 154 H THR 154 14.270 -0.247 3.245 1189 HA THR 154 HA THR 154 15.486 1.202 5.494 1190 HB THR 154 HB THR 154 15.181 2.381 2.732 1191 HG1 THR 154 HG1 THR 154 17.402 1.116 3.938 1192 HG21 THR 154 HG21 THR 154 16.532 4.153 3.462 1193 HG22 THR 154 HG22 THR 154 16.972 3.311 4.948 1194 HG23 THR 154 HG23 THR 154 15.330 3.916 4.731 1195 H TYR 155 H TYR 155 13.943 2.017 6.734 1196 HA TYR 155 HA TYR 155 11.270 2.422 5.642 1197 HB2 TYR 155 HB3 TYR 155 12.424 2.106 8.371 1198 HB3 TYR 155 HB2 TYR 155 10.932 3.029 8.217 1199 HD1 TYR 155 HD1 TYR 155 9.128 1.806 6.624 1200 HD2 TYR 155 HD2 TYR 155 12.205 -0.138 8.827 1201 HE1 TYR 155 HE1 TYR 155 7.834 -0.286 6.573 1202 HE2 TYR 155 HE2 TYR 155 10.921 -2.235 8.780 1203 HH TYR 155 HH TYR 155 9.176 -3.299 7.513 1204 H GLU 156 H GLU 156 10.775 4.337 4.818 1205 HA GLU 156 HA GLU 156 11.888 6.744 6.102 1206 HB2 GLU 156 HB3 GLU 156 11.382 6.257 3.164 1207 HB3 GLU 156 HB2 GLU 156 11.800 7.821 3.850 1208 HG2 GLU 156 HG3 GLU 156 13.865 6.583 4.794 1209 HG3 GLU 156 HG2 GLU 156 13.482 5.370 3.573 1210 H VAL 157 H VAL 157 10.535 8.436 6.472 1211 HA VAL 157 HA VAL 157 7.689 7.984 5.882 1212 HB VAL 157 HB VAL 157 8.791 9.713 8.095 1213 HG11 VAL 157 HG11 VAL 157 6.616 10.424 7.627 1214 HG12 VAL 157 HG12 VAL 157 6.406 9.285 8.956 1215 HG13 VAL 157 HG13 VAL 157 6.048 8.787 7.302 1216 HG21 VAL 157 HG21 VAL 157 9.378 7.281 8.332 1217 HG22 VAL 157 HG22 VAL 157 7.648 6.942 8.387 1218 HG23 VAL 157 HG23 VAL 157 8.391 7.943 9.635 1219 H TRP 158 H TRP 158 6.432 9.696 5.234 1220 HA TRP 158 HA TRP 158 7.705 12.243 4.603 1221 HB2 TRP 158 HB3 TRP 158 6.408 10.554 2.462 1222 HB3 TRP 158 HB2 TRP 158 6.958 12.211 2.253 1223 HD1 TRP 158 HD1 TRP 158 8.428 8.717 3.050 1224 HE1 TRP 158 HE1 TRP 158 10.837 8.647 2.146 1225 HE3 TRP 158 HE3 TRP 158 8.837 13.555 1.449 1226 HZ2 TRP 158 HZ2 TRP 158 12.668 10.409 0.915 1227 HZ3 TRP 158 HZ3 TRP 158 10.950 14.283 0.419 1228 HH2 TRP 158 HH2 TRP 158 12.825 12.741 0.159 1229 H GLN 159 H GLN 159 6.357 13.950 4.672 1230 HA GLN 159 HA GLN 159 3.467 13.465 4.685 1231 HB2 GLN 159 HB3 GLN 159 5.107 14.390 6.939 1232 HB3 GLN 159 HB2 GLN 159 3.723 15.419 6.595 1233 HG2 GLN 159 HG3 GLN 159 2.262 13.922 7.371 1234 HG3 GLN 159 HG2 GLN 159 3.095 12.568 6.610 1235 HE21 GLN 159 HE21 GLN 159 4.164 14.938 9.016 1236 HE22 GLN 159 HE22 GLN 159 4.588 13.779 10.225 1237 H LYS 160 H LYS 160 2.438 14.850 3.386 1238 HA LYS 160 HA LYS 160 3.753 16.784 1.877 1239 HB2 LYS 160 HB3 LYS 160 1.474 15.615 1.490 1240 HB3 LYS 160 HB2 LYS 160 0.807 16.931 2.446 1241 HG2 LYS 160 HG3 LYS 160 2.000 18.484 0.799 1242 HG3 LYS 160 HG2 LYS 160 2.167 17.053 -0.220 1243 HD2 LYS 160 HD3 LYS 160 -0.301 16.744 -0.075 1244 HD3 LYS 160 HD2 LYS 160 -0.397 18.279 0.790 1245 HE2 LYS 160 HE3 LYS 160 1.001 18.175 -1.842 1246 HE3 LYS 160 HE2 LYS 160 -0.761 18.171 -1.807 1247 HZ1 LYS 160 HZ1 LYS 160 0.693 20.389 -1.824 1248 HZ2 LYS 160 HZ2 LYS 160 0.544 20.173 -0.154 1249 HZ3 LYS 160 HZ3 LYS 160 -0.841 20.298 -1.116 1250 H LYS 161 H LYS 161 3.857 19.009 1.954 1251 HA LYS 161 HA LYS 161 3.983 20.176 4.538 1252 HB2 LYS 161 HB3 LYS 161 4.371 21.140 1.741 1253 HB3 LYS 161 HB2 LYS 161 4.154 22.337 3.010 1254 HG2 LYS 161 HG3 LYS 161 6.095 21.645 4.143 1255 HG3 LYS 161 HG2 LYS 161 6.204 20.154 3.204 1256 HD2 LYS 161 HD3 LYS 161 7.141 21.192 1.411 1257 HD3 LYS 161 HD2 LYS 161 6.270 22.701 1.693 1258 HE2 LYS 161 HE3 LYS 161 8.544 21.724 3.411 1259 HE3 LYS 161 HE2 LYS 161 8.745 22.830 2.053 1260 HZ1 LYS 161 HZ1 LYS 161 6.831 24.072 3.409 1261 HZ2 LYS 161 HZ2 LYS 161 8.478 24.360 3.663 1262 HZ3 LYS 161 HZ3 LYS 161 7.635 23.317 4.692 1263 H ALA 162 H ALA 162 2.692 21.738 5.496 1264 HA ALA 162 HA ALA 162 0.762 22.794 6.074 1265 HB1 ALA 162 HB1 ALA 162 1.272 23.623 3.561 1266 HB2 ALA 162 HB2 ALA 162 -0.097 24.185 4.520 1267 HB3 ALA 162 HB3 ALA 162 -0.320 22.898 3.335 1268 H51A NDP 170 H51A NDP 170 -5.151 -0.597 -9.763 1269 H52A NDP 170 H52A NDP 170 -5.374 -2.197 -9.047 1270 H4B NDP 170 H4B NDP 170 -7.052 -2.705 -10.884 1271 H3B NDP 170 H3B NDP 170 -6.503 0.157 -11.681 1272 HO3A NDP 170 HO3A NDP 170 -6.885 -0.907 -13.735 1273 H2B NDP 170 H2B NDP 170 -8.834 0.329 -12.226 1274 H1B NDP 170 H1B NDP 170 -9.748 -0.875 -9.924 1275 H8A NDP 170 H8A NDP 170 -6.602 1.085 -9.183 1276 H61A NDP 170 H61A NDP 170 -10.374 5.932 -8.284 1277 H62A NDP 170 H62A NDP 170 -8.732 5.347 -8.138 1278 H2A NDP 170 H2A NDP 170 -12.803 2.575 -10.005 1279 H51N NDP 170 H51N NDP 170 -1.376 -3.901 -7.831 1280 H52N NDP 170 H52N NDP 170 -0.577 -3.007 -9.134 1281 H4D NDP 170 H4D NDP 170 0.829 -5.032 -9.608 1282 H3D NDP 170 H3D NDP 170 -0.627 -6.220 -7.229 1283 HO3N NDP 170 HO3N NDP 170 -1.121 -7.586 -8.774 1284 H2D NDP 170 H2D NDP 170 1.419 -7.298 -6.650 1285 HO2N NDP 170 HO2N NDP 170 2.944 -7.764 -8.035 1286 H1D NDP 170 H1D NDP 170 3.032 -5.091 -7.070 1287 H2N NDP 170 H2N NDP 170 3.545 -4.918 -4.731 1288 H71N NDP 170 H71N NDP 170 5.348 -4.425 -2.100 1289 H72N NDP 170 H72N NDP 170 4.896 -5.064 -3.660 1290 H41N NDP 170 H41N NDP 170 0.552 -3.400 -2.583 1291 H42N NDP 170 H42N NDP 170 0.446 -5.162 -2.243 1292 H5N NDP 170 H5N NDP 170 -1.320 -4.439 -3.846 1293 H6N NDP 170 H6N NDP 170 -0.576 -4.945 -6.179 Start of MODEL 21 1 H1 THR 1 HT1 THR 1 -5.762 9.534 5.170 2 H2 THR 1 HT2 THR 1 -4.394 10.571 5.189 3 H3 THR 1 HT3 THR 1 -4.289 8.995 5.861 4 HA THR 1 HA THR 1 -4.838 8.134 3.617 5 HB THR 1 HB THR 1 -3.843 10.777 2.625 6 HG1 THR 1 HG1 THR 1 -5.693 11.728 2.902 7 HG21 THR 1 HG21 THR 1 -5.688 8.713 1.449 8 HG22 THR 1 HG22 THR 1 -3.998 8.979 1.021 9 HG23 THR 1 HG23 THR 1 -5.202 10.219 0.670 10 H ALA 2 H ALA 2 -3.142 6.812 4.048 11 HA ALA 2 HA ALA 2 -0.458 7.914 3.563 12 HB1 ALA 2 HB1 ALA 2 -0.639 5.700 5.508 13 HB2 ALA 2 HB2 ALA 2 -1.230 7.270 6.053 14 HB3 ALA 2 HB3 ALA 2 0.429 7.103 5.478 15 H PHE 3 H PHE 3 0.945 6.603 2.435 16 HA PHE 3 HA PHE 3 -0.271 4.201 1.250 17 HB2 PHE 3 HB3 PHE 3 2.022 5.923 0.293 18 HB3 PHE 3 HB2 PHE 3 1.472 4.461 -0.514 19 HD1 PHE 3 HD1 PHE 3 -1.547 5.288 0.287 20 HD2 PHE 3 HD2 PHE 3 1.666 7.104 -1.833 21 HE1 PHE 3 HE1 PHE 3 -3.158 6.613 -1.014 22 HE2 PHE 3 HE2 PHE 3 0.059 8.433 -3.136 23 HZ PHE 3 HZ PHE 3 -2.354 8.188 -2.727 24 H LEU 4 H LEU 4 0.511 2.241 1.695 25 HA LEU 4 HA LEU 4 3.222 2.037 2.817 26 HB2 LEU 4 HB3 LEU 4 1.593 1.839 4.628 27 HB3 LEU 4 HB2 LEU 4 0.766 0.559 3.760 28 HG LEU 4 HG LEU 4 2.789 -0.853 3.960 29 HD11 LEU 4 HD11 LEU 4 4.634 0.484 4.164 30 HD12 LEU 4 HD12 LEU 4 4.374 0.043 5.852 31 HD13 LEU 4 HD13 LEU 4 3.833 1.613 5.257 32 HD21 LEU 4 HD21 LEU 4 2.268 -0.053 6.750 33 HD22 LEU 4 HD22 LEU 4 2.142 -1.633 5.977 34 HD23 LEU 4 HD23 LEU 4 0.851 -0.448 5.777 35 H TRP 5 H TRP 5 4.428 0.912 1.430 36 HA TRP 5 HA TRP 5 3.527 -1.674 0.527 37 HB2 TRP 5 HB3 TRP 5 3.461 -1.309 -1.784 38 HB3 TRP 5 HB2 TRP 5 2.613 0.081 -1.121 39 HD1 TRP 5 HD1 TRP 5 5.834 -0.879 -2.933 40 HE1 TRP 5 HE1 TRP 5 6.942 1.257 -3.842 41 HE3 TRP 5 HE3 TRP 5 2.831 2.603 -0.702 42 HZ2 TRP 5 HZ2 TRP 5 6.590 4.050 -3.642 43 HZ3 TRP 5 HZ3 TRP 5 3.284 4.987 -1.116 44 HH2 TRP 5 HH2 TRP 5 5.124 5.693 -2.554 45 H ALA 6 H ALA 6 5.208 -2.872 -0.641 46 HA ALA 6 HA ALA 6 7.872 -2.050 0.286 47 HB1 ALA 6 HB1 ALA 6 7.095 -4.219 1.083 48 HB2 ALA 6 HB2 ALA 6 8.498 -4.402 0.030 49 HB3 ALA 6 HB3 ALA 6 6.884 -4.765 -0.581 50 H GLN 7 H GLN 7 9.659 -2.030 -1.100 51 HA GLN 7 HA GLN 7 9.242 -2.608 -3.919 52 HB2 GLN 7 HB3 GLN 7 10.158 -0.342 -4.553 53 HB3 GLN 7 HB2 GLN 7 8.519 -0.348 -3.917 54 HG2 GLN 7 HG3 GLN 7 10.320 -0.011 -1.746 55 HG3 GLN 7 HG2 GLN 7 10.759 1.126 -3.020 56 HE21 GLN 7 HE21 GLN 7 8.166 0.042 -0.924 57 HE22 GLN 7 HE22 GLN 7 7.243 1.500 -0.996 58 H ASP 8 H ASP 8 11.228 -2.478 -5.191 59 HA ASP 8 HA ASP 8 13.552 -3.215 -3.561 60 HB2 ASP 8 HB3 ASP 8 14.396 -4.328 -5.553 61 HB3 ASP 8 HB2 ASP 8 12.741 -4.844 -5.248 62 H ARG 9 H ARG 9 15.587 -2.807 -5.403 63 HA ARG 9 HA ARG 9 16.172 -0.073 -5.023 64 HB2 ARG 9 HB3 ARG 9 17.447 -2.348 -6.453 65 HB3 ARG 9 HB2 ARG 9 17.964 -0.726 -6.894 66 HG2 ARG 9 HG3 ARG 9 18.028 -1.912 -4.127 67 HG3 ARG 9 HG2 ARG 9 19.413 -1.674 -5.195 68 HD2 ARG 9 HD3 ARG 9 18.575 0.812 -5.204 69 HD3 ARG 9 HD2 ARG 9 17.798 0.336 -3.695 70 HE ARG 9 HE ARG 9 20.332 -0.512 -3.352 71 HH11 ARG 9 HH11 ARG 9 18.983 2.551 -4.339 72 HH12 ARG 9 HH12 ARG 9 20.282 3.480 -3.671 73 HH21 ARG 9 HH21 ARG 9 22.042 0.709 -2.473 74 HH22 ARG 9 HH22 ARG 9 22.020 2.435 -2.613 75 H ASP 10 H ASP 10 14.801 -1.859 -7.703 76 HA ASP 10 HA ASP 10 14.953 0.370 -9.536 77 HB2 ASP 10 HB3 ASP 10 14.907 -2.278 -9.960 78 HB3 ASP 10 HB2 ASP 10 13.186 -1.943 -10.122 79 H GLY 11 H GLY 11 13.084 -0.116 -6.931 80 HA2 GLY 11 HA3 GLY 11 11.238 1.138 -6.255 81 HA3 GLY 11 HA2 GLY 11 11.031 1.675 -7.915 82 H LEU 12 H LEU 12 11.354 -1.622 -7.968 83 HA LEU 12 HA LEU 12 8.868 -2.236 -8.933 84 HB2 LEU 12 HB3 LEU 12 11.079 -3.644 -8.608 85 HB3 LEU 12 HB2 LEU 12 10.247 -4.221 -7.179 86 HG LEU 12 HG LEU 12 8.405 -5.060 -8.582 87 HD11 LEU 12 HD11 LEU 12 9.813 -3.501 -10.616 88 HD12 LEU 12 HD12 LEU 12 8.129 -4.020 -10.545 89 HD13 LEU 12 HD13 LEU 12 9.367 -5.125 -11.142 90 HD21 LEU 12 HD21 LEU 12 11.069 -6.038 -8.458 91 HD22 LEU 12 HD22 LEU 12 10.417 -6.412 -10.054 92 HD23 LEU 12 HD23 LEU 12 9.564 -6.946 -8.606 93 H ILE 13 H ILE 13 7.328 -3.868 -7.786 94 HA ILE 13 HA ILE 13 6.950 -3.445 -4.980 95 HB ILE 13 HB ILE 13 4.724 -2.533 -5.052 96 HG12 ILE 13 HG13 ILE 13 4.793 -1.784 -7.914 97 HG13 ILE 13 HG12 ILE 13 4.497 -3.485 -7.585 98 HG21 ILE 13 HG21 ILE 13 6.695 -1.009 -5.038 99 HG22 ILE 13 HG22 ILE 13 5.215 -0.281 -5.661 100 HG23 ILE 13 HG23 ILE 13 6.479 -0.799 -6.776 101 HD11 ILE 13 HD11 ILE 13 2.576 -2.955 -6.258 102 HD12 ILE 13 HD12 ILE 13 2.442 -2.142 -7.819 103 HD13 ILE 13 HD13 ILE 13 2.917 -1.229 -6.387 104 H GLY 14 H GLY 14 5.864 -4.755 -8.038 105 HA2 GLY 14 HA3 GLY 14 5.214 -7.262 -6.700 106 HA3 GLY 14 HA2 GLY 14 3.932 -6.491 -7.621 107 H LYS 15 H LYS 15 4.387 -8.846 -8.494 108 HA LYS 15 HA LYS 15 5.971 -8.491 -10.939 109 HB2 LYS 15 HB3 LYS 15 6.747 -10.794 -10.818 110 HB3 LYS 15 HB2 LYS 15 7.241 -9.919 -9.375 111 HG2 LYS 15 HG3 LYS 15 6.070 -11.253 -8.024 112 HG3 LYS 15 HG2 LYS 15 4.667 -11.261 -9.091 113 HD2 LYS 15 HD3 LYS 15 6.651 -12.726 -10.427 114 HD3 LYS 15 HD2 LYS 15 6.711 -13.258 -8.746 115 HE2 LYS 15 HE3 LYS 15 4.018 -12.983 -9.913 116 HE3 LYS 15 HE2 LYS 15 5.019 -14.266 -10.592 117 HZ1 LYS 15 HZ1 LYS 15 5.429 -14.775 -8.073 118 HZ2 LYS 15 HZ2 LYS 15 4.049 -15.356 -8.859 119 HZ3 LYS 15 HZ3 LYS 15 3.948 -13.981 -7.880 120 H ASP 16 H ASP 16 3.466 -7.882 -11.147 121 HA ASP 16 HA ASP 16 1.639 -8.307 -12.455 122 HB2 ASP 16 HB3 ASP 16 3.431 -10.294 -13.302 123 HB3 ASP 16 HB2 ASP 16 1.933 -11.149 -12.945 124 H GLY 17 H GLY 17 1.855 -8.706 -9.581 125 HA2 GLY 17 HA3 GLY 17 -0.722 -9.699 -9.050 126 HA3 GLY 17 HA2 GLY 17 0.453 -10.947 -8.658 127 H HIS 18 H HIS 18 2.468 -9.824 -7.459 128 HA HIS 18 HA HIS 18 1.962 -7.676 -5.711 129 HB2 HIS 18 HB3 HIS 18 1.630 -8.847 -3.604 130 HB3 HIS 18 HB2 HIS 18 0.344 -9.272 -4.728 131 HD1 HIS 18 HD1 HIS 18 3.305 -10.706 -2.955 132 HD2 HIS 18 HD2 HIS 18 0.302 -11.949 -5.544 133 HE1 HIS 18 HE1 HIS 18 3.413 -13.218 -2.953 134 HE2 HIS 18 HE2 HIS 18 1.527 -13.950 -4.455 135 H LEU 19 H LEU 19 3.511 -8.214 -3.561 136 HA LEU 19 HA LEU 19 6.117 -8.162 -4.649 137 HB2 LEU 19 HB3 LEU 19 6.859 -8.242 -2.265 138 HB3 LEU 19 HB2 LEU 19 5.735 -6.954 -2.647 139 HG LEU 19 HG LEU 19 3.992 -8.814 -1.783 140 HD11 LEU 19 HD11 LEU 19 6.404 -10.015 -1.186 141 HD12 LEU 19 HD12 LEU 19 4.837 -10.408 -0.479 142 HD13 LEU 19 HD13 LEU 19 5.915 -9.279 0.341 143 HD21 LEU 19 HD21 LEU 19 5.588 -6.843 -0.158 144 HD22 LEU 19 HD22 LEU 19 4.144 -7.664 0.435 145 HD23 LEU 19 HD23 LEU 19 4.035 -6.579 -0.951 146 HA PRO 20 HA PRO 20 6.529 -12.647 -4.735 147 HB2 PRO 20 HB3 PRO 20 8.725 -12.757 -6.270 148 HB3 PRO 20 HB2 PRO 20 7.140 -12.356 -6.939 149 HG2 PRO 20 HG3 PRO 20 9.413 -10.550 -6.229 150 HG3 PRO 20 HG2 PRO 20 8.326 -10.486 -7.628 151 HD2 PRO 20 HD3 PRO 20 8.063 -8.919 -5.376 152 HD3 PRO 20 HD2 PRO 20 6.734 -9.319 -6.481 153 H TRP 21 H TRP 21 8.884 -10.326 -3.616 154 HA TRP 21 HA TRP 21 10.796 -12.227 -2.696 155 HB2 TRP 21 HB3 TRP 21 11.615 -10.240 -1.306 156 HB3 TRP 21 HB2 TRP 21 11.645 -10.062 -3.057 157 HD1 TRP 21 HD1 TRP 21 9.040 -9.260 -0.278 158 HE1 TRP 21 HE1 TRP 21 8.061 -6.933 -0.771 159 HE3 TRP 21 HE3 TRP 21 11.624 -8.186 -4.554 160 HZ2 TRP 21 HZ2 TRP 21 8.345 -4.908 -2.719 161 HZ3 TRP 21 HZ3 TRP 21 11.211 -6.034 -5.672 162 HH2 TRP 21 HH2 TRP 21 9.605 -4.430 -4.773 163 H HIS 22 H HIS 22 11.159 -13.029 -0.650 164 HA HIS 22 HA HIS 22 8.803 -13.249 1.015 165 HB2 HIS 22 HB3 HIS 22 11.103 -14.848 0.495 166 HB3 HIS 22 HB2 HIS 22 11.072 -14.500 2.220 167 HD1 HIS 22 HD1 HIS 22 9.612 -16.675 -0.300 168 HD2 HIS 22 HD2 HIS 22 8.548 -15.306 3.476 169 HE1 HIS 22 HE1 HIS 22 7.801 -18.229 0.493 170 HE2 HIS 22 HE2 HIS 22 7.118 -17.334 2.747 171 H LEU 23 H LEU 23 8.612 -11.134 1.827 172 HA LEU 23 HA LEU 23 10.752 -10.250 3.633 173 HB2 LEU 23 HB3 LEU 23 9.162 -8.886 1.749 174 HB3 LEU 23 HB2 LEU 23 8.626 -8.333 3.324 175 HG LEU 23 HG LEU 23 11.183 -8.004 3.768 176 HD11 LEU 23 HD11 LEU 23 11.027 -8.448 0.849 177 HD12 LEU 23 HD12 LEU 23 12.343 -8.766 1.980 178 HD13 LEU 23 HD13 LEU 23 12.048 -7.124 1.407 179 HD21 LEU 23 HD21 LEU 23 10.837 -5.765 2.294 180 HD22 LEU 23 HD22 LEU 23 10.135 -6.017 3.891 181 HD23 LEU 23 HD23 LEU 23 9.169 -6.319 2.446 182 HA PRO 24 HA PRO 24 7.629 -11.872 6.599 183 HB2 PRO 24 HB3 PRO 24 9.449 -12.479 8.524 184 HB3 PRO 24 HB2 PRO 24 9.060 -13.570 7.189 185 HG2 PRO 24 HG3 PRO 24 11.371 -11.690 7.486 186 HG3 PRO 24 HG2 PRO 24 11.357 -13.360 6.889 187 HD2 PRO 24 HD3 PRO 24 11.438 -11.232 5.226 188 HD3 PRO 24 HD2 PRO 24 10.603 -12.739 4.798 189 H ASP 25 H ASP 25 10.061 -9.414 6.750 190 HA ASP 25 HA ASP 25 9.269 -8.369 9.309 191 HB2 ASP 25 HB3 ASP 25 11.571 -8.103 8.492 192 HB3 ASP 25 HB2 ASP 25 10.984 -7.148 7.134 193 H ASP 26 H ASP 26 8.472 -7.778 5.956 194 HA ASP 26 HA ASP 26 7.069 -5.320 6.498 195 HB2 ASP 26 HB3 ASP 26 8.203 -5.856 4.311 196 HB3 ASP 26 HB2 ASP 26 6.917 -7.018 4.004 197 H LEU 27 H LEU 27 6.156 -8.656 5.692 198 HA LEU 27 HA LEU 27 3.386 -8.293 5.645 199 HB2 LEU 27 HB3 LEU 27 4.762 -10.783 6.629 200 HB3 LEU 27 HB2 LEU 27 3.196 -10.659 5.852 201 HG LEU 27 HG LEU 27 5.503 -9.720 4.256 202 HD11 LEU 27 HD11 LEU 27 5.120 -12.629 4.150 203 HD12 LEU 27 HD12 LEU 27 5.929 -12.029 5.598 204 HD13 LEU 27 HD13 LEU 27 6.591 -11.668 4.003 205 HD21 LEU 27 HD21 LEU 27 2.900 -10.110 3.739 206 HD22 LEU 27 HD22 LEU 27 3.538 -11.685 3.268 207 HD23 LEU 27 HD23 LEU 27 4.162 -10.219 2.512 208 H HIS 28 H HIS 28 5.342 -9.638 8.310 209 HA HIS 28 HA HIS 28 3.362 -9.766 10.231 210 HB2 HIS 28 HB3 HIS 28 5.762 -10.626 10.356 211 HB3 HIS 28 HB2 HIS 28 6.210 -9.001 10.863 212 HD1 HIS 28 HD1 HIS 28 4.366 -12.051 12.024 213 HD2 HIS 28 HD2 HIS 28 5.534 -8.340 13.484 214 HE1 HIS 28 HE1 HIS 28 3.959 -12.146 14.503 215 HE2 HIS 28 HE2 HIS 28 4.749 -9.918 15.376 216 H TYR 29 H TYR 29 5.597 -7.065 9.607 217 HA TYR 29 HA TYR 29 4.582 -5.356 11.596 218 HB2 TYR 29 HB3 TYR 29 6.761 -5.174 10.210 219 HB3 TYR 29 HB2 TYR 29 5.761 -4.351 9.018 220 HD1 TYR 29 HD1 TYR 29 6.055 -4.205 12.747 221 HD2 TYR 29 HD2 TYR 29 6.068 -2.070 9.068 222 HE1 TYR 29 HE1 TYR 29 6.343 -2.097 13.978 223 HE2 TYR 29 HE2 TYR 29 6.357 0.044 10.288 224 HH TYR 29 HH TYR 29 7.423 0.334 13.239 225 H PHE 30 H PHE 30 3.571 -6.002 8.311 226 HA PHE 30 HA PHE 30 1.938 -3.786 7.855 227 HB2 PHE 30 HB3 PHE 30 2.474 -6.268 6.585 228 HB3 PHE 30 HB2 PHE 30 0.726 -6.118 6.712 229 HD1 PHE 30 HD2 PHE 30 3.778 -4.615 5.328 230 HD2 PHE 30 HD1 PHE 30 -0.475 -4.495 5.443 231 HE1 PHE 30 HE2 PHE 30 3.771 -3.118 3.375 232 HE2 PHE 30 HE1 PHE 30 -0.489 -2.999 3.489 233 HZ PHE 30 HZ PHE 30 1.635 -2.308 2.454 234 H ARG 31 H ARG 31 1.031 -6.987 9.132 235 HA ARG 31 HA ARG 31 -1.652 -6.295 9.682 236 HB2 ARG 31 HB3 ARG 31 0.158 -8.519 10.561 237 HB3 ARG 31 HB2 ARG 31 -1.437 -8.341 11.276 238 HG2 ARG 31 HG3 ARG 31 -2.162 -8.235 8.733 239 HG3 ARG 31 HG2 ARG 31 -0.663 -9.146 8.531 240 HD2 ARG 31 HD3 ARG 31 -2.665 -9.951 10.605 241 HD3 ARG 31 HD2 ARG 31 -2.888 -10.421 8.921 242 HE ARG 31 HE ARG 31 -0.284 -11.044 9.976 243 HH11 ARG 31 HH11 ARG 31 -3.568 -12.162 9.593 244 HH12 ARG 31 HH12 ARG 31 -3.148 -13.835 9.741 245 HH21 ARG 31 HH21 ARG 31 0.270 -13.245 10.172 246 HH22 ARG 31 HH22 ARG 31 -0.970 -14.450 10.070 247 H ALA 32 H ALA 32 1.297 -6.172 11.596 248 HA ALA 32 HA ALA 32 0.072 -5.626 14.087 249 HB1 ALA 32 HB1 ALA 32 2.236 -5.163 14.899 250 HB2 ALA 32 HB2 ALA 32 2.834 -4.743 13.294 251 HB3 ALA 32 HB3 ALA 32 2.443 -6.419 13.678 252 H GLN 33 H GLN 33 1.078 -3.576 11.419 253 HA GLN 33 HA GLN 33 0.673 -1.137 12.912 254 HB2 GLN 33 HB3 GLN 33 1.923 -1.880 10.442 255 HB3 GLN 33 HB2 GLN 33 0.768 -0.592 10.131 256 HG2 GLN 33 HG3 GLN 33 1.857 0.636 12.073 257 HG3 GLN 33 HG2 GLN 33 3.145 -0.563 11.956 258 HE21 GLN 33 HE21 GLN 33 1.230 1.267 9.589 259 HE22 GLN 33 HE22 GLN 33 2.586 1.895 8.724 260 H THR 34 H THR 34 -1.146 -3.151 10.730 261 HA THR 34 HA THR 34 -3.244 -1.143 10.448 262 HB THR 34 HB THR 34 -4.254 -2.676 8.859 263 HG1 THR 34 HG1 THR 34 -2.309 -4.462 9.839 264 HG21 THR 34 HG21 THR 34 -2.673 -1.436 7.716 265 HG22 THR 34 HG22 THR 34 -2.248 -3.100 7.315 266 HG23 THR 34 HG23 THR 34 -1.321 -2.221 8.532 267 H VAL 35 H VAL 35 -2.838 -2.113 13.073 268 HA VAL 35 HA VAL 35 -4.940 -4.056 13.578 269 HB VAL 35 HB VAL 35 -3.259 -2.568 15.596 270 HG11 VAL 35 HG11 VAL 35 -5.082 -4.948 15.744 271 HG12 VAL 35 HG12 VAL 35 -5.116 -3.470 16.705 272 HG13 VAL 35 HG13 VAL 35 -3.833 -4.654 16.953 273 HG21 VAL 35 HG21 VAL 35 -2.736 -5.380 14.708 274 HG22 VAL 35 HG22 VAL 35 -1.662 -4.255 15.539 275 HG23 VAL 35 HG23 VAL 35 -2.041 -4.015 13.833 276 H GLY 36 H GLY 36 -6.900 -3.111 13.190 277 HA2 GLY 36 HA3 GLY 36 -8.787 -2.035 14.082 278 HA3 GLY 36 HA2 GLY 36 -7.731 -1.085 15.115 279 H LYS 37 H LYS 37 -7.117 -1.378 11.698 280 HA LYS 37 HA LYS 37 -8.162 1.342 11.286 281 HB2 LYS 37 HB3 LYS 37 -5.478 0.238 10.464 282 HB3 LYS 37 HB2 LYS 37 -6.168 1.690 9.750 283 HG2 LYS 37 HG3 LYS 37 -6.325 1.996 12.550 284 HG3 LYS 37 HG2 LYS 37 -4.706 1.400 12.179 285 HD2 LYS 37 HD3 LYS 37 -4.625 3.211 10.389 286 HD3 LYS 37 HD2 LYS 37 -6.062 3.884 11.161 287 HE2 LYS 37 HE3 LYS 37 -4.272 5.048 12.125 288 HE3 LYS 37 HE2 LYS 37 -4.714 3.835 13.326 289 HZ1 LYS 37 HZ1 LYS 37 -2.809 2.661 12.977 290 HZ2 LYS 37 HZ2 LYS 37 -2.233 4.212 12.626 291 HZ3 LYS 37 HZ3 LYS 37 -2.642 3.157 11.368 292 H ILE 38 H ILE 38 -7.927 1.798 8.742 293 HA ILE 38 HA ILE 38 -9.074 -0.544 7.362 294 HB ILE 38 HB ILE 38 -9.916 1.837 6.049 295 HG12 ILE 38 HG13 ILE 38 -10.909 1.808 8.889 296 HG13 ILE 38 HG12 ILE 38 -9.537 2.800 8.402 297 HG21 ILE 38 HG21 ILE 38 -10.903 -0.638 6.576 298 HG22 ILE 38 HG22 ILE 38 -11.823 0.689 5.865 299 HG23 ILE 38 HG23 ILE 38 -11.921 0.378 7.598 300 HD11 ILE 38 HD11 ILE 38 -12.375 3.224 8.004 301 HD12 ILE 38 HD12 ILE 38 -11.446 3.392 6.514 302 HD13 ILE 38 HD13 ILE 38 -11.033 4.366 7.926 303 H MET 39 H MET 39 -8.151 -1.123 5.493 304 HA MET 39 HA MET 39 -6.281 0.786 4.248 305 HB2 MET 39 HB3 MET 39 -4.874 -1.105 3.586 306 HB3 MET 39 HB2 MET 39 -5.048 -1.021 5.333 307 HG2 MET 39 HG3 MET 39 -5.356 -3.243 5.039 308 HG3 MET 39 HG2 MET 39 -7.025 -2.705 4.860 309 HE1 MET 39 HE1 MET 39 -5.101 -5.449 3.490 310 HE2 MET 39 HE2 MET 39 -6.415 -5.721 2.345 311 HE3 MET 39 HE3 MET 39 -6.777 -5.319 4.024 312 H VAL 40 H VAL 40 -6.551 1.196 2.145 313 HA VAL 40 HA VAL 40 -8.740 -0.128 0.755 314 HB VAL 40 HB VAL 40 -7.027 2.150 -0.245 315 HG11 VAL 40 HG11 VAL 40 -9.723 1.082 -1.066 316 HG12 VAL 40 HG12 VAL 40 -8.238 1.094 -2.016 317 HG13 VAL 40 HG13 VAL 40 -9.051 2.611 -1.633 318 HG21 VAL 40 HG21 VAL 40 -8.187 2.589 1.962 319 HG22 VAL 40 HG22 VAL 40 -9.710 2.416 1.091 320 HG23 VAL 40 HG23 VAL 40 -8.580 3.695 0.645 321 H VAL 41 H VAL 41 -8.442 -1.718 -0.670 322 HA VAL 41 HA VAL 41 -5.730 -2.100 -1.755 323 HB VAL 41 HB VAL 41 -7.025 -3.854 -0.179 324 HG11 VAL 41 HG11 VAL 41 -7.538 -5.077 -2.857 325 HG12 VAL 41 HG12 VAL 41 -8.758 -4.055 -2.101 326 HG13 VAL 41 HG13 VAL 41 -8.197 -5.510 -1.280 327 HG21 VAL 41 HG21 VAL 41 -5.578 -5.483 -1.946 328 HG22 VAL 41 HG22 VAL 41 -5.017 -4.743 -0.447 329 HG23 VAL 41 HG23 VAL 41 -4.802 -3.899 -1.980 330 H GLY 42 H GLY 42 -5.442 -2.487 -3.919 331 HA2 GLY 42 HA3 GLY 42 -7.489 -1.535 -5.679 332 HA3 GLY 42 HA2 GLY 42 -5.913 -2.153 -6.155 333 H ARG 43 H ARG 43 -8.095 -2.751 -7.683 334 HA ARG 43 HA ARG 43 -9.553 -5.016 -7.074 335 HB2 ARG 43 HB3 ARG 43 -9.953 -3.600 -9.046 336 HB3 ARG 43 HB2 ARG 43 -8.480 -4.217 -9.781 337 HG2 ARG 43 HG3 ARG 43 -9.796 -6.525 -9.238 338 HG3 ARG 43 HG2 ARG 43 -11.138 -5.430 -9.576 339 HD2 ARG 43 HD3 ARG 43 -8.778 -6.009 -11.360 340 HD3 ARG 43 HD2 ARG 43 -10.448 -6.517 -11.616 341 HE ARG 43 HE ARG 43 -10.119 -3.667 -11.407 342 HH11 ARG 43 HH11 ARG 43 -10.058 -6.408 -13.567 343 HH12 ARG 43 HH12 ARG 43 -10.382 -5.460 -14.979 344 HH21 ARG 43 HH21 ARG 43 -10.544 -2.422 -13.261 345 HH22 ARG 43 HH22 ARG 43 -10.657 -3.196 -14.806 346 H ARG 44 H ARG 44 -6.606 -4.977 -9.090 347 HA ARG 44 HA ARG 44 -6.280 -7.755 -9.165 348 HB2 ARG 44 HB3 ARG 44 -4.631 -5.400 -9.818 349 HB3 ARG 44 HB2 ARG 44 -3.727 -6.861 -9.452 350 HG2 ARG 44 HG3 ARG 44 -4.126 -6.667 -11.834 351 HG3 ARG 44 HG2 ARG 44 -4.972 -8.068 -11.173 352 HD2 ARG 44 HD3 ARG 44 -6.790 -7.278 -12.197 353 HD3 ARG 44 HD2 ARG 44 -6.823 -6.037 -10.945 354 HE ARG 44 HE ARG 44 -6.302 -4.514 -12.549 355 HH11 ARG 44 HH11 ARG 44 -5.228 -7.647 -13.649 356 HH12 ARG 44 HH12 ARG 44 -4.702 -7.063 -15.193 357 HH21 ARG 44 HH21 ARG 44 -5.611 -3.744 -14.580 358 HH22 ARG 44 HH22 ARG 44 -4.919 -4.848 -15.721 359 H THR 45 H THR 45 -5.681 -5.531 -6.627 360 HA THR 45 HA THR 45 -3.645 -7.054 -5.317 361 HB THR 45 HB THR 45 -5.383 -5.079 -3.885 362 HG1 THR 45 HG1 THR 45 -4.931 -3.973 -5.733 363 HG21 THR 45 HG21 THR 45 -2.492 -5.861 -3.756 364 HG22 THR 45 HG22 THR 45 -3.715 -5.948 -2.489 365 HG23 THR 45 HG23 THR 45 -3.107 -4.380 -3.022 366 H TYR 46 H TYR 46 -7.140 -6.562 -4.686 367 HA TYR 46 HA TYR 46 -7.330 -8.201 -2.459 368 HB2 TYR 46 HB3 TYR 46 -9.695 -8.348 -2.862 369 HB3 TYR 46 HB2 TYR 46 -9.170 -6.738 -3.334 370 HD1 TYR 46 HD2 TYR 46 -9.615 -10.110 -4.904 371 HD2 TYR 46 HD1 TYR 46 -10.071 -5.895 -5.291 372 HE1 TYR 46 HE2 TYR 46 -10.621 -10.430 -7.107 373 HE2 TYR 46 HE1 TYR 46 -11.104 -6.215 -7.498 374 HH TYR 46 HH TYR 46 -12.006 -9.340 -8.680 375 H GLU 47 H GLU 47 -7.436 -9.070 -5.886 376 HA GLU 47 HA GLU 47 -7.954 -11.837 -5.416 377 HB2 GLU 47 HB3 GLU 47 -7.687 -10.096 -7.676 378 HB3 GLU 47 HB2 GLU 47 -6.659 -11.502 -7.920 379 HG2 GLU 47 HG3 GLU 47 -8.419 -12.953 -7.995 380 HG3 GLU 47 HG2 GLU 47 -9.446 -11.927 -6.996 381 H SER 48 H SER 48 -5.152 -9.849 -5.433 382 HA SER 48 HA SER 48 -3.399 -12.213 -5.426 383 HB2 SER 48 HB3 SER 48 -1.561 -10.704 -5.936 384 HB3 SER 48 HB2 SER 48 -2.872 -10.449 -7.087 385 HG SER 48 HG SER 48 -2.821 -8.450 -6.480 386 H PHE 49 H PHE 49 -5.058 -10.993 -3.149 387 HA PHE 49 HA PHE 49 -2.872 -10.412 -1.279 388 HB2 PHE 49 HB3 PHE 49 -5.299 -9.157 -1.619 389 HB3 PHE 49 HB2 PHE 49 -5.598 -10.198 -0.231 390 HD1 PHE 49 HD1 PHE 49 -3.232 -7.635 -1.529 391 HD2 PHE 49 HD2 PHE 49 -4.896 -9.560 1.886 392 HE1 PHE 49 HE1 PHE 49 -2.102 -6.013 -0.067 393 HE2 PHE 49 HE2 PHE 49 -3.767 -7.939 3.352 394 HZ PHE 49 HZ PHE 49 -2.369 -6.162 2.376 395 HA PRO 50 HA PRO 50 -3.341 -14.704 -0.006 396 HB2 PRO 50 HB3 PRO 50 -1.362 -13.946 2.043 397 HB3 PRO 50 HB2 PRO 50 -1.269 -15.191 0.794 398 HG2 PRO 50 HG3 PRO 50 0.174 -12.937 0.638 399 HG3 PRO 50 HG2 PRO 50 -0.500 -13.715 -0.807 400 HD2 PRO 50 HD3 PRO 50 -1.491 -11.320 0.695 401 HD3 PRO 50 HD2 PRO 50 -1.396 -11.593 -1.059 402 H LYS 51 H LYS 51 -3.562 -11.908 2.118 403 HA LYS 51 HA LYS 51 -5.146 -13.552 3.986 404 HB2 LYS 51 HB3 LYS 51 -2.896 -11.881 4.487 405 HB3 LYS 51 HB2 LYS 51 -4.295 -11.141 5.251 406 HG2 LYS 51 HG3 LYS 51 -3.780 -14.052 5.637 407 HG3 LYS 51 HG2 LYS 51 -2.845 -12.866 6.549 408 HD2 LYS 51 HD3 LYS 51 -4.584 -12.338 7.868 409 HD3 LYS 51 HD2 LYS 51 -5.726 -12.344 6.523 410 HE2 LYS 51 HE3 LYS 51 -5.023 -15.013 6.855 411 HE3 LYS 51 HE2 LYS 51 -5.176 -14.390 8.497 412 HZ1 LYS 51 HZ1 LYS 51 -7.274 -15.258 7.652 413 HZ2 LYS 51 HZ2 LYS 51 -7.239 -14.150 6.374 414 HZ3 LYS 51 HZ3 LYS 51 -7.385 -13.599 7.966 415 H ARG 52 H ARG 52 -6.967 -13.066 2.557 416 HA ARG 52 HA ARG 52 -8.063 -10.388 3.098 417 HB2 ARG 52 HB3 ARG 52 -9.308 -10.589 0.965 418 HB3 ARG 52 HB2 ARG 52 -7.564 -10.564 0.747 419 HG2 ARG 52 HG3 ARG 52 -7.644 -13.069 0.618 420 HG3 ARG 52 HG2 ARG 52 -9.404 -12.934 0.574 421 HD2 ARG 52 HD3 ARG 52 -8.390 -11.116 -1.327 422 HD3 ARG 52 HD2 ARG 52 -7.513 -12.629 -1.551 423 HE ARG 52 HE ARG 52 -9.458 -13.625 -2.273 424 HH11 ARG 52 HH11 ARG 52 -10.192 -10.497 -0.907 425 HH12 ARG 52 HH12 ARG 52 -11.821 -10.485 -1.493 426 HH21 ARG 52 HH21 ARG 52 -11.600 -13.609 -3.043 427 HH22 ARG 52 HH22 ARG 52 -12.621 -12.252 -2.704 428 HA PRO 53 HA PRO 53 -9.196 -9.501 4.170 429 HB2 PRO 53 HB3 PRO 53 -10.739 -8.988 6.277 430 HB3 PRO 53 HB2 PRO 53 -11.416 -9.023 4.645 431 HG2 PRO 53 HG3 PRO 53 -11.621 -11.035 6.825 432 HG3 PRO 53 HG2 PRO 53 -12.800 -10.604 5.576 433 HD2 PRO 53 HD3 PRO 53 -11.027 -12.805 5.545 434 HD3 PRO 53 HD2 PRO 53 -12.025 -12.225 4.198 435 H LEU 54 H LEU 54 -7.954 -8.551 5.886 436 HA LEU 54 HA LEU 54 -6.388 -10.440 7.352 437 HB2 LEU 54 HB3 LEU 54 -6.432 -7.426 7.365 438 HB3 LEU 54 HB2 LEU 54 -5.280 -8.385 8.273 439 HG LEU 54 HG LEU 54 -5.196 -9.285 5.582 440 HD11 LEU 54 HD11 LEU 54 -4.269 -6.614 5.215 441 HD12 LEU 54 HD12 LEU 54 -5.969 -6.574 5.681 442 HD13 LEU 54 HD13 LEU 54 -5.462 -7.516 4.280 443 HD21 LEU 54 HD21 LEU 54 -3.437 -9.111 7.483 444 HD22 LEU 54 HD22 LEU 54 -3.130 -7.511 6.807 445 HD23 LEU 54 HD23 LEU 54 -2.926 -8.947 5.802 446 HA PRO 55 HA PRO 55 -8.811 -10.524 11.049 447 HB2 PRO 55 HB3 PRO 55 -6.986 -11.498 12.781 448 HB3 PRO 55 HB2 PRO 55 -7.704 -12.486 11.504 449 HG2 PRO 55 HG3 PRO 55 -5.045 -11.111 11.564 450 HG3 PRO 55 HG2 PRO 55 -5.447 -12.746 11.005 451 HD2 PRO 55 HD3 PRO 55 -5.103 -10.645 9.313 452 HD3 PRO 55 HD2 PRO 55 -6.197 -11.998 8.964 453 H GLU 56 H GLU 56 -9.285 -9.317 12.790 454 HA GLU 56 HA GLU 56 -9.262 -7.631 14.298 455 HB2 GLU 56 HB3 GLU 56 -6.824 -8.904 14.580 456 HB3 GLU 56 HB2 GLU 56 -6.381 -7.209 14.434 457 HG2 GLU 56 HG3 GLU 56 -8.366 -6.971 16.199 458 HG3 GLU 56 HG2 GLU 56 -7.850 -8.614 16.577 459 H ARG 57 H ARG 57 -9.170 -7.011 11.393 460 HA ARG 57 HA ARG 57 -8.627 -4.183 11.726 461 HB2 ARG 57 HB3 ARG 57 -7.130 -3.931 9.898 462 HB3 ARG 57 HB2 ARG 57 -6.478 -5.202 10.919 463 HG2 ARG 57 HG3 ARG 57 -6.197 -6.155 8.876 464 HG3 ARG 57 HG2 ARG 57 -7.805 -6.758 9.270 465 HD2 ARG 57 HD3 ARG 57 -7.430 -5.776 6.932 466 HD3 ARG 57 HD2 ARG 57 -8.856 -5.257 7.826 467 HE ARG 57 HE ARG 57 -8.033 -3.135 7.779 468 HH11 ARG 57 HH11 ARG 57 -5.375 -5.340 7.276 469 HH12 ARG 57 HH12 ARG 57 -4.222 -4.079 6.993 470 HH21 ARG 57 HH21 ARG 57 -6.522 -1.479 7.401 471 HH22 ARG 57 HH22 ARG 57 -4.872 -1.888 7.069 472 H THR 58 H THR 58 -9.105 -3.066 9.453 473 HA THR 58 HA THR 58 -11.620 -4.257 8.483 474 HB THR 58 HB THR 58 -10.888 -1.325 8.484 475 HG1 THR 58 HG1 THR 58 -12.066 -1.134 10.326 476 HG21 THR 58 HG21 THR 58 -13.282 -0.958 8.208 477 HG22 THR 58 HG22 THR 58 -13.537 -2.701 8.116 478 HG23 THR 58 HG23 THR 58 -12.605 -1.879 6.864 479 H ASN 59 H ASN 59 -11.576 -4.929 6.449 480 HA ASN 59 HA ASN 59 -9.410 -4.027 4.713 481 HB2 ASN 59 HB3 ASN 59 -11.355 -6.324 4.449 482 HB3 ASN 59 HB2 ASN 59 -10.100 -5.942 3.274 483 HD21 ASN 59 HD21 ASN 59 -10.507 -6.531 6.744 484 HD22 ASN 59 HD22 ASN 59 -9.048 -7.428 6.940 485 H VAL 60 H VAL 60 -9.671 -2.945 2.863 486 HA VAL 60 HA VAL 60 -12.404 -2.357 1.946 487 HB VAL 60 HB VAL 60 -10.140 -0.361 2.157 488 HG11 VAL 60 HG11 VAL 60 -11.188 0.512 0.357 489 HG12 VAL 60 HG12 VAL 60 -12.310 1.119 1.575 490 HG13 VAL 60 HG13 VAL 60 -12.692 -0.351 0.677 491 HG21 VAL 60 HG21 VAL 60 -12.504 0.473 3.491 492 HG22 VAL 60 HG22 VAL 60 -10.918 0.122 4.178 493 HG23 VAL 60 HG23 VAL 60 -12.119 -1.161 4.031 494 H VAL 61 H VAL 61 -12.697 -2.473 -0.226 495 HA VAL 61 HA VAL 61 -10.286 -2.932 -1.862 496 HB VAL 61 HB VAL 61 -12.999 -4.182 -2.290 497 HG11 VAL 61 HG11 VAL 61 -10.417 -4.257 -3.779 498 HG12 VAL 61 HG12 VAL 61 -12.068 -4.162 -4.390 499 HG13 VAL 61 HG13 VAL 61 -11.446 -5.689 -3.767 500 HG21 VAL 61 HG21 VAL 61 -12.361 -6.018 -1.138 501 HG22 VAL 61 HG22 VAL 61 -11.323 -4.866 -0.299 502 HG23 VAL 61 HG23 VAL 61 -10.667 -5.855 -1.604 503 H LEU 62 H LEU 62 -10.306 -2.261 -4.019 504 HA LEU 62 HA LEU 62 -12.435 -0.412 -4.829 505 HB2 LEU 62 HB3 LEU 62 -10.415 0.781 -3.822 506 HB3 LEU 62 HB2 LEU 62 -9.509 0.213 -5.210 507 HG LEU 62 HG LEU 62 -11.496 1.406 -6.528 508 HD11 LEU 62 HD11 LEU 62 -12.788 2.762 -5.339 509 HD12 LEU 62 HD12 LEU 62 -11.372 3.580 -4.673 510 HD13 LEU 62 HD13 LEU 62 -12.027 2.155 -3.866 511 HD21 LEU 62 HD21 LEU 62 -10.033 3.533 -6.370 512 HD22 LEU 62 HD22 LEU 62 -9.331 2.056 -7.031 513 HD23 LEU 62 HD23 LEU 62 -8.978 2.534 -5.369 514 H THR 63 H THR 63 -13.254 -1.509 -6.522 515 HA THR 63 HA THR 63 -11.403 -2.315 -8.655 516 HB THR 63 HB THR 63 -11.975 -4.393 -7.728 517 HG1 THR 63 HG1 THR 63 -12.525 -4.095 -10.040 518 HG21 THR 63 HG21 THR 63 -14.732 -4.653 -7.680 519 HG22 THR 63 HG22 THR 63 -14.418 -3.088 -6.929 520 HG23 THR 63 HG23 THR 63 -13.650 -4.542 -6.291 521 H HIS 64 H HIS 64 -12.284 -2.283 -10.788 522 HA HIS 64 HA HIS 64 -14.058 -0.105 -11.253 523 HB2 HIS 64 HB3 HIS 64 -12.348 -1.852 -12.835 524 HB3 HIS 64 HB2 HIS 64 -13.864 -1.500 -13.653 525 HD1 HIS 64 HD1 HIS 64 -13.578 0.401 -15.190 526 HD2 HIS 64 HD2 HIS 64 -11.307 0.861 -11.746 527 HE1 HIS 64 HE1 HIS 64 -12.403 2.609 -15.447 528 HE2 HIS 64 HE2 HIS 64 -11.107 2.908 -13.310 529 H GLN 65 H GLN 65 -14.419 -3.587 -11.178 530 HA GLN 65 HA GLN 65 -16.836 -3.867 -12.531 531 HB2 GLN 65 HB3 GLN 65 -15.571 -5.432 -10.294 532 HB3 GLN 65 HB2 GLN 65 -17.130 -5.889 -10.964 533 HG2 GLN 65 HG3 GLN 65 -16.198 -6.839 -12.736 534 HG3 GLN 65 HG2 GLN 65 -15.166 -5.442 -13.038 535 HE21 GLN 65 HE21 GLN 65 -13.228 -5.263 -11.649 536 HE22 GLN 65 HE22 GLN 65 -12.407 -6.718 -11.210 537 H GLU 66 H GLU 66 -18.845 -3.273 -12.107 538 HA GLU 66 HA GLU 66 -19.442 -1.908 -9.629 539 HB2 GLU 66 HB3 GLU 66 -21.576 -1.359 -10.684 540 HB3 GLU 66 HB2 GLU 66 -20.234 -0.990 -11.759 541 HG2 GLU 66 HG3 GLU 66 -20.650 -3.022 -13.015 542 HG3 GLU 66 HG2 GLU 66 -21.957 -3.452 -11.913 543 H ASP 67 H ASP 67 -20.149 -4.972 -11.144 544 HA ASP 67 HA ASP 67 -22.051 -5.636 -9.020 545 HB2 ASP 67 HB3 ASP 67 -21.558 -6.631 -11.772 546 HB3 ASP 67 HB2 ASP 67 -22.140 -7.803 -10.594 547 H TYR 68 H TYR 68 -18.981 -5.576 -8.807 548 HA TYR 68 HA TYR 68 -18.352 -8.361 -8.332 549 HB2 TYR 68 HB3 TYR 68 -16.680 -6.656 -9.172 550 HB3 TYR 68 HB2 TYR 68 -16.683 -5.970 -7.551 551 HD1 TYR 68 HD1 TYR 68 -15.763 -8.898 -9.576 552 HD2 TYR 68 HD2 TYR 68 -15.579 -7.090 -5.730 553 HE1 TYR 68 HE1 TYR 68 -14.077 -10.550 -8.888 554 HE2 TYR 68 HE2 TYR 68 -13.890 -8.735 -5.030 555 HH TYR 68 HH TYR 68 -12.497 -11.026 -7.299 556 H GLN 69 H GLN 69 -18.052 -9.346 -6.356 557 HA GLN 69 HA GLN 69 -18.916 -7.812 -4.000 558 HB2 GLN 69 HB3 GLN 69 -19.589 -10.397 -3.374 559 HB3 GLN 69 HB2 GLN 69 -20.707 -9.163 -3.927 560 HG2 GLN 69 HG3 GLN 69 -19.333 -10.646 -6.060 561 HG3 GLN 69 HG2 GLN 69 -20.412 -11.602 -5.051 562 HE21 GLN 69 HE21 GLN 69 -20.835 -8.201 -5.807 563 HE22 GLN 69 HE22 GLN 69 -22.270 -8.397 -6.746 564 H ALA 70 H ALA 70 -17.193 -7.542 -2.761 565 HA ALA 70 HA ALA 70 -15.150 -9.628 -2.618 566 HB1 ALA 70 HB1 ALA 70 -14.624 -7.149 -2.985 567 HB2 ALA 70 HB2 ALA 70 -13.678 -8.017 -1.777 568 HB3 ALA 70 HB3 ALA 70 -14.988 -6.951 -1.271 569 H GLN 71 H GLN 71 -15.814 -11.178 -1.253 570 HA GLN 71 HA GLN 71 -17.318 -10.713 1.102 571 HB2 GLN 71 HB3 GLN 71 -15.721 -13.110 0.189 572 HB3 GLN 71 HB2 GLN 71 -16.739 -13.100 1.623 573 HG2 GLN 71 HG3 GLN 71 -18.356 -13.830 0.289 574 HG3 GLN 71 HG2 GLN 71 -18.434 -12.180 -0.325 575 HE21 GLN 71 HE21 GLN 71 -17.741 -11.741 -2.360 576 HE22 GLN 71 HE22 GLN 71 -17.210 -12.948 -3.477 577 H GLY 72 H GLY 72 -16.661 -10.026 3.018 578 HA2 GLY 72 HA3 GLY 72 -15.216 -10.218 4.918 579 HA3 GLY 72 HA2 GLY 72 -13.885 -10.555 3.825 580 H ALA 73 H ALA 73 -14.577 -8.293 2.002 581 HA ALA 73 HA ALA 73 -13.885 -6.065 3.803 582 HB1 ALA 73 HB1 ALA 73 -11.892 -6.922 2.629 583 HB2 ALA 73 HB2 ALA 73 -12.281 -5.259 2.188 584 HB3 ALA 73 HB3 ALA 73 -12.681 -6.580 1.090 585 H VAL 74 H VAL 74 -14.128 -3.903 2.654 586 HA VAL 74 HA VAL 74 -16.785 -3.800 1.520 587 HB VAL 74 HB VAL 74 -14.918 -1.461 1.887 588 HG11 VAL 74 HG11 VAL 74 -17.924 -1.585 2.019 589 HG12 VAL 74 HG12 VAL 74 -17.020 -1.188 0.558 590 HG13 VAL 74 HG13 VAL 74 -16.906 -0.146 1.976 591 HG21 VAL 74 HG21 VAL 74 -15.814 -1.151 4.114 592 HG22 VAL 74 HG22 VAL 74 -15.058 -2.740 3.992 593 HG23 VAL 74 HG23 VAL 74 -16.815 -2.593 3.942 594 H VAL 75 H VAL 75 -17.325 -2.914 -0.519 595 HA VAL 75 HA VAL 75 -15.082 -2.813 -2.426 596 HB VAL 75 HB VAL 75 -17.858 -3.816 -3.050 597 HG11 VAL 75 HG11 VAL 75 -15.397 -3.336 -4.617 598 HG12 VAL 75 HG12 VAL 75 -17.090 -3.256 -5.106 599 HG13 VAL 75 HG13 VAL 75 -16.284 -4.819 -4.972 600 HG21 VAL 75 HG21 VAL 75 -15.561 -5.157 -1.850 601 HG22 VAL 75 HG22 VAL 75 -16.158 -5.955 -3.304 602 HG23 VAL 75 HG23 VAL 75 -17.247 -5.665 -1.948 603 H VAL 76 H VAL 76 -15.019 -1.151 -3.826 604 HA VAL 76 HA VAL 76 -17.363 0.534 -4.203 605 HB VAL 76 HB VAL 76 -15.880 2.592 -3.834 606 HG11 VAL 76 HG11 VAL 76 -16.977 2.892 -1.913 607 HG12 VAL 76 HG12 VAL 76 -16.272 1.456 -1.171 608 HG13 VAL 76 HG13 VAL 76 -17.672 1.304 -2.234 609 HG21 VAL 76 HG21 VAL 76 -14.313 0.579 -2.226 610 HG22 VAL 76 HG22 VAL 76 -14.084 2.327 -2.198 611 HG23 VAL 76 HG23 VAL 76 -13.756 1.418 -3.673 612 H HIS 77 H HIS 77 -17.330 1.715 -6.085 613 HA HIS 77 HA HIS 77 -14.982 1.360 -7.819 614 HB2 HIS 77 HB3 HIS 77 -17.445 1.521 -9.343 615 HB3 HIS 77 HB2 HIS 77 -16.174 0.306 -9.405 616 HD1 HIS 77 HD1 HIS 77 -16.416 -1.670 -7.578 617 HD2 HIS 77 HD2 HIS 77 -19.784 0.674 -8.230 618 HE1 HIS 77 HE1 HIS 77 -18.342 -2.986 -6.639 619 HE2 HIS 77 HE2 HIS 77 -20.358 -1.511 -6.970 620 H ASP 78 H ASP 78 -14.917 3.571 -6.486 621 HA ASP 78 HA ASP 78 -15.232 5.588 -8.429 622 HB2 ASP 78 HB3 ASP 78 -17.392 5.263 -6.477 623 HB3 ASP 78 HB2 ASP 78 -16.705 6.884 -6.489 624 H VAL 79 H VAL 79 -14.020 7.425 -7.917 625 HA VAL 79 HA VAL 79 -12.039 7.054 -5.921 626 HB VAL 79 HB VAL 79 -11.724 9.665 -6.476 627 HG11 VAL 79 HG11 VAL 79 -9.891 8.981 -7.584 628 HG12 VAL 79 HG12 VAL 79 -10.808 7.933 -8.667 629 HG13 VAL 79 HG13 VAL 79 -10.404 7.383 -7.040 630 HG21 VAL 79 HG21 VAL 79 -12.710 8.714 -9.124 631 HG22 VAL 79 HG22 VAL 79 -12.497 10.359 -8.527 632 HG23 VAL 79 HG23 VAL 79 -13.859 9.389 -7.970 633 H ALA 80 H ALA 80 -14.654 9.401 -6.255 634 HA ALA 80 HA ALA 80 -14.353 10.521 -3.677 635 HB1 ALA 80 HB1 ALA 80 -16.639 10.546 -5.635 636 HB2 ALA 80 HB2 ALA 80 -15.463 11.822 -5.321 637 HB3 ALA 80 HB3 ALA 80 -16.672 11.417 -4.102 638 H ALA 81 H ALA 81 -15.939 7.668 -4.862 639 HA ALA 81 HA ALA 81 -17.860 7.271 -2.872 640 HB1 ALA 81 HB1 ALA 81 -18.053 5.808 -4.651 641 HB2 ALA 81 HB2 ALA 81 -17.372 4.769 -3.400 642 HB3 ALA 81 HB3 ALA 81 -16.331 5.429 -4.662 643 H VAL 82 H VAL 82 -14.770 5.501 -3.038 644 HA VAL 82 HA VAL 82 -14.737 4.569 -0.453 645 HB VAL 82 HB VAL 82 -13.148 4.049 -2.413 646 HG11 VAL 82 HG11 VAL 82 -11.184 5.863 -1.162 647 HG12 VAL 82 HG12 VAL 82 -12.382 6.599 -2.227 648 HG13 VAL 82 HG13 VAL 82 -11.331 5.321 -2.834 649 HG21 VAL 82 HG21 VAL 82 -11.486 3.145 -0.940 650 HG22 VAL 82 HG22 VAL 82 -13.060 3.023 -0.154 651 HG23 VAL 82 HG23 VAL 82 -11.927 4.286 0.330 652 H PHE 83 H PHE 83 -13.852 7.760 -1.630 653 HA PHE 83 HA PHE 83 -12.476 8.627 0.671 654 HB2 PHE 83 HB3 PHE 83 -13.833 9.990 -1.624 655 HB3 PHE 83 HB2 PHE 83 -13.328 10.948 -0.239 656 HD1 PHE 83 HD2 PHE 83 -10.804 9.866 0.549 657 HD2 PHE 83 HD1 PHE 83 -12.392 10.362 -3.368 658 HE1 PHE 83 HE2 PHE 83 -8.520 9.970 -0.360 659 HE2 PHE 83 HE1 PHE 83 -10.111 10.465 -4.284 660 HZ PHE 83 HZ PHE 83 -8.172 10.269 -2.780 661 H ALA 84 H ALA 84 -15.894 8.772 -0.246 662 HA ALA 84 HA ALA 84 -16.755 10.270 1.990 663 HB1 ALA 84 HB1 ALA 84 -19.000 9.445 1.445 664 HB2 ALA 84 HB2 ALA 84 -18.298 8.269 0.333 665 HB3 ALA 84 HB3 ALA 84 -18.151 9.995 0.001 666 H TYR 85 H TYR 85 -16.166 6.885 1.428 667 HA TYR 85 HA TYR 85 -17.364 5.885 3.783 668 HB2 TYR 85 HB3 TYR 85 -16.786 3.929 2.855 669 HB3 TYR 85 HB2 TYR 85 -15.923 4.805 1.601 670 HD1 TYR 85 HD1 TYR 85 -15.387 3.648 5.125 671 HD2 TYR 85 HD2 TYR 85 -13.724 4.266 1.262 672 HE1 TYR 85 HE1 TYR 85 -13.273 2.641 5.879 673 HE2 TYR 85 HE2 TYR 85 -11.606 3.264 2.003 674 HH TYR 85 HH TYR 85 -10.492 3.025 4.581 675 H ALA 86 H ALA 86 -13.898 6.484 3.087 676 HA ALA 86 HA ALA 86 -12.802 6.149 5.530 677 HB1 ALA 86 HB1 ALA 86 -11.977 8.631 4.119 678 HB2 ALA 86 HB2 ALA 86 -11.820 7.094 3.269 679 HB3 ALA 86 HB3 ALA 86 -10.993 7.338 4.807 680 H LYS 87 H LYS 87 -14.728 8.959 4.547 681 HA LYS 87 HA LYS 87 -14.237 10.512 6.868 682 HB2 LYS 87 HB3 LYS 87 -15.579 10.926 4.516 683 HB3 LYS 87 HB2 LYS 87 -16.912 10.768 5.652 684 HG2 LYS 87 HG3 LYS 87 -16.412 13.066 5.526 685 HG3 LYS 87 HG2 LYS 87 -15.760 12.506 7.067 686 HD2 LYS 87 HD3 LYS 87 -13.630 12.121 5.432 687 HD3 LYS 87 HD2 LYS 87 -14.375 13.535 4.684 688 HE2 LYS 87 HE3 LYS 87 -12.862 14.402 6.256 689 HE3 LYS 87 HE2 LYS 87 -14.445 14.537 7.021 690 HZ1 LYS 87 HZ1 LYS 87 -13.698 12.145 7.888 691 HZ2 LYS 87 HZ2 LYS 87 -13.351 13.575 8.722 692 HZ3 LYS 87 HZ3 LYS 87 -12.175 12.867 7.734 693 H GLN 88 H GLN 88 -16.717 8.206 5.978 694 HA GLN 88 HA GLN 88 -18.335 8.331 8.243 695 HB2 GLN 88 HB3 GLN 88 -18.435 6.917 5.949 696 HB3 GLN 88 HB2 GLN 88 -17.932 5.646 7.056 697 HG2 GLN 88 HG3 GLN 88 -20.189 5.429 7.201 698 HG3 GLN 88 HG2 GLN 88 -19.910 6.577 8.510 699 HE21 GLN 88 HE21 GLN 88 -20.180 6.847 4.979 700 HE22 GLN 88 HE22 GLN 88 -21.393 8.077 4.995 701 H HIS 89 H HIS 89 -15.148 7.154 7.936 702 HA HIS 89 HA HIS 89 -15.336 5.793 10.544 703 HB2 HIS 89 HB3 HIS 89 -13.866 5.176 8.055 704 HB3 HIS 89 HB2 HIS 89 -12.946 4.968 9.543 705 HD1 HIS 89 HD1 HIS 89 -14.882 3.696 11.417 706 HD2 HIS 89 HD2 HIS 89 -14.746 2.718 7.381 707 HE1 HIS 89 HE1 HIS 89 -15.915 1.410 11.244 708 HE2 HIS 89 HE2 HIS 89 -15.743 0.803 8.804 709 HA PRO 90 HA PRO 90 -12.908 9.661 11.229 710 HB2 PRO 90 HB3 PRO 90 -14.114 9.600 13.889 711 HB3 PRO 90 HB2 PRO 90 -14.211 10.849 12.646 712 HG2 PRO 90 HG3 PRO 90 -16.326 9.309 13.329 713 HG3 PRO 90 HG2 PRO 90 -16.089 9.937 11.688 714 HD2 PRO 90 HD3 PRO 90 -15.524 7.201 12.771 715 HD3 PRO 90 HD2 PRO 90 -16.244 7.673 11.218 716 H ASP 91 H ASP 91 -13.430 7.105 13.698 717 HA ASP 91 HA ASP 91 -10.966 7.659 15.012 718 HB2 ASP 91 HB3 ASP 91 -13.225 5.867 15.367 719 HB3 ASP 91 HB2 ASP 91 -11.696 5.062 15.708 720 H GLN 92 H GLN 92 -11.652 6.079 12.121 721 HA GLN 92 HA GLN 92 -9.296 4.351 12.328 722 HB2 GLN 92 HB3 GLN 92 -11.835 4.132 10.999 723 HB3 GLN 92 HB2 GLN 92 -10.538 4.004 9.822 724 HG2 GLN 92 HG3 GLN 92 -9.882 1.999 10.569 725 HG3 GLN 92 HG2 GLN 92 -10.127 2.436 12.260 726 HE21 GLN 92 HE21 GLN 92 -12.676 2.961 12.538 727 HE22 GLN 92 HE22 GLN 92 -13.674 1.628 12.078 728 H GLU 93 H GLU 93 -8.087 4.154 10.142 729 HA GLU 93 HA GLU 93 -7.678 6.839 9.008 730 HB2 GLU 93 HB3 GLU 93 -5.922 5.914 10.724 731 HB3 GLU 93 HB2 GLU 93 -5.377 4.955 9.353 732 HG2 GLU 93 HG3 GLU 93 -4.101 7.024 9.609 733 HG3 GLU 93 HG2 GLU 93 -4.959 6.956 8.070 734 H LEU 94 H LEU 94 -6.597 6.825 6.890 735 HA LEU 94 HA LEU 94 -7.517 4.540 5.300 736 HB2 LEU 94 HB3 LEU 94 -7.976 7.173 4.934 737 HB3 LEU 94 HB2 LEU 94 -6.526 6.987 3.966 738 HG LEU 94 HG LEU 94 -7.601 5.311 2.588 739 HD11 LEU 94 HD11 LEU 94 -9.459 5.212 4.802 740 HD12 LEU 94 HD12 LEU 94 -9.185 4.050 3.504 741 HD13 LEU 94 HD13 LEU 94 -10.292 5.401 3.259 742 HD21 LEU 94 HD21 LEU 94 -7.906 7.584 1.886 743 HD22 LEU 94 HD22 LEU 94 -9.256 7.795 3.000 744 HD23 LEU 94 HD23 LEU 94 -9.415 6.711 1.618 745 H VAL 95 H VAL 95 -6.105 3.150 4.470 746 HA VAL 95 HA VAL 95 -3.361 4.041 3.945 747 HB VAL 95 HB VAL 95 -3.976 1.418 5.302 748 HG11 VAL 95 HG11 VAL 95 -1.323 2.808 5.050 749 HG12 VAL 95 HG12 VAL 95 -1.913 1.670 3.839 750 HG13 VAL 95 HG13 VAL 95 -1.648 1.134 5.498 751 HG21 VAL 95 HG21 VAL 95 -3.250 4.093 6.429 752 HG22 VAL 95 HG22 VAL 95 -2.734 2.614 7.240 753 HG23 VAL 95 HG23 VAL 95 -4.451 2.930 6.991 754 H ILE 96 H ILE 96 -3.216 3.824 1.798 755 HA ILE 96 HA ILE 96 -4.597 1.713 0.393 756 HB ILE 96 HB ILE 96 -2.735 3.890 -0.567 757 HG12 ILE 96 HG13 ILE 96 -4.772 4.800 -1.598 758 HG13 ILE 96 HG12 ILE 96 -5.706 3.454 -0.956 759 HG21 ILE 96 HG21 ILE 96 -3.657 1.469 -1.918 760 HG22 ILE 96 HG22 ILE 96 -2.351 2.576 -2.340 761 HG23 ILE 96 HG23 ILE 96 -4.009 2.953 -2.802 762 HD11 ILE 96 HD11 ILE 96 -5.501 4.226 1.245 763 HD12 ILE 96 HD12 ILE 96 -5.853 5.658 0.276 764 HD13 ILE 96 HD13 ILE 96 -4.204 5.343 0.821 765 H ALA 97 H ALA 97 -3.811 -0.269 0.266 766 HA ALA 97 HA ALA 97 -0.956 -0.738 0.628 767 HB1 ALA 97 HB1 ALA 97 -1.802 -3.194 0.559 768 HB2 ALA 97 HB2 ALA 97 -3.392 -2.462 0.769 769 HB3 ALA 97 HB3 ALA 97 -2.133 -2.197 1.975 770 H GLY 98 H GLY 98 -3.190 -0.470 -1.928 771 HA2 GLY 98 HA3 GLY 98 -1.429 -0.659 -3.997 772 HA3 GLY 98 HA2 GLY 98 -1.906 -2.327 -3.715 773 H GLY 99 H GLY 99 -4.167 -1.183 -6.314 774 HA2 GLY 99 HA3 GLY 99 -1.403 -1.864 -5.705 775 HA3 GLY 99 HA2 GLY 99 -2.231 -2.094 -7.234 776 H ALA 100 H ALA 100 -0.410 -1.222 -8.311 777 HA ALA 100 HA ALA 100 0.745 1.265 -7.831 778 HB1 ALA 100 HB1 ALA 100 1.385 -0.686 -9.464 779 HB2 ALA 100 HB2 ALA 100 1.884 0.973 -9.796 780 HB3 ALA 100 HB3 ALA 100 0.491 0.287 -10.632 781 H GLN 101 H GLN 101 -2.142 0.426 -9.690 782 HA GLN 101 HA GLN 101 -2.459 3.029 -10.822 783 HB2 GLN 101 HB3 GLN 101 -3.732 0.492 -11.060 784 HB3 GLN 101 HB2 GLN 101 -4.969 1.682 -10.677 785 HG2 GLN 101 HG3 GLN 101 -3.029 2.430 -12.770 786 HG3 GLN 101 HG2 GLN 101 -4.163 1.138 -13.165 787 HE21 GLN 101 HE21 GLN 101 -4.512 4.074 -11.213 788 HE22 GLN 101 HE22 GLN 101 -5.832 4.727 -12.117 789 H ILE 102 H ILE 102 -3.656 1.399 -7.944 790 HA ILE 102 HA ILE 102 -5.563 3.338 -7.195 791 HB ILE 102 HB ILE 102 -3.974 1.516 -5.376 792 HG12 ILE 102 HG13 ILE 102 -5.160 0.298 -7.173 793 HG13 ILE 102 HG12 ILE 102 -5.832 -0.044 -5.582 794 HG21 ILE 102 HG21 ILE 102 -6.693 2.717 -4.904 795 HG22 ILE 102 HG22 ILE 102 -5.197 3.445 -4.319 796 HG23 ILE 102 HG23 ILE 102 -5.677 1.845 -3.756 797 HD11 ILE 102 HD11 ILE 102 -7.259 2.147 -6.626 798 HD12 ILE 102 HD12 ILE 102 -7.828 0.502 -6.345 799 HD13 ILE 102 HD13 ILE 102 -7.136 0.942 -7.907 800 H PHE 103 H PHE 103 -2.182 2.855 -6.186 801 HA PHE 103 HA PHE 103 -1.954 5.030 -4.472 802 HB2 PHE 103 HB3 PHE 103 0.053 3.621 -6.221 803 HB3 PHE 103 HB2 PHE 103 0.519 4.964 -5.183 804 HD1 PHE 103 HD2 PHE 103 -0.276 4.723 -2.677 805 HD2 PHE 103 HD1 PHE 103 0.231 1.489 -5.394 806 HE1 PHE 103 HE2 PHE 103 -0.021 3.175 -0.780 807 HE2 PHE 103 HE1 PHE 103 0.486 -0.065 -3.503 808 HZ PHE 103 HZ PHE 103 0.360 0.778 -1.193 809 H THR 104 H THR 104 -1.890 4.876 -7.961 810 HA THR 104 HA THR 104 -0.774 7.396 -8.495 811 HB THR 104 HB THR 104 -2.788 5.840 -10.126 812 HG1 THR 104 HG1 THR 104 -1.076 4.847 -11.017 813 HG21 THR 104 HG21 THR 104 -2.513 7.231 -11.844 814 HG22 THR 104 HG22 THR 104 -0.796 7.463 -11.511 815 HG23 THR 104 HG23 THR 104 -2.001 8.390 -10.617 816 H ALA 105 H ALA 105 -4.212 6.426 -8.344 817 HA ALA 105 HA ALA 105 -5.295 8.952 -8.817 818 HB1 ALA 105 HB1 ALA 105 -6.265 6.412 -7.709 819 HB2 ALA 105 HB2 ALA 105 -6.992 7.480 -8.910 820 HB3 ALA 105 HB3 ALA 105 -7.160 7.841 -7.191 821 H PHE 106 H PHE 106 -4.892 7.382 -5.605 822 HA PHE 106 HA PHE 106 -5.544 9.712 -4.188 823 HB2 PHE 106 HB3 PHE 106 -3.994 7.257 -3.343 824 HB3 PHE 106 HB2 PHE 106 -4.579 8.497 -2.240 825 HD1 PHE 106 HD2 PHE 106 -5.697 5.956 -4.702 826 HD2 PHE 106 HD1 PHE 106 -6.757 8.415 -1.395 827 HE1 PHE 106 HE2 PHE 106 -7.841 4.764 -4.512 828 HE2 PHE 106 HE1 PHE 106 -8.901 7.222 -1.196 829 HZ PHE 106 HZ PHE 106 -9.441 5.394 -2.759 830 H LYS 107 H LYS 107 -2.697 8.900 -5.894 831 HA LYS 107 HA LYS 107 -0.622 9.869 -4.405 832 HB2 LYS 107 HB3 LYS 107 0.581 9.921 -6.332 833 HB3 LYS 107 HB2 LYS 107 -0.823 9.075 -6.956 834 HG2 LYS 107 HG3 LYS 107 -1.668 11.059 -7.970 835 HG3 LYS 107 HG2 LYS 107 -0.478 12.061 -7.139 836 HD2 LYS 107 HD3 LYS 107 0.917 11.808 -8.844 837 HD3 LYS 107 HD2 LYS 107 0.944 10.069 -8.558 838 HE2 LYS 107 HE3 LYS 107 0.231 10.175 -10.749 839 HE3 LYS 107 HE2 LYS 107 -1.299 10.091 -9.877 840 HZ1 LYS 107 HZ1 LYS 107 -0.172 12.733 -10.455 841 HZ2 LYS 107 HZ2 LYS 107 -1.790 12.253 -10.342 842 HZ3 LYS 107 HZ3 LYS 107 -0.893 11.877 -11.725 843 H ASP 108 H ASP 108 -3.076 11.741 -6.081 844 HA ASP 108 HA ASP 108 -1.841 14.260 -5.336 845 HB2 ASP 108 HB3 ASP 108 -4.156 13.436 -7.029 846 HB3 ASP 108 HB2 ASP 108 -4.164 15.062 -6.352 847 H ASP 109 H ASP 109 -4.611 12.275 -4.449 848 HA ASP 109 HA ASP 109 -5.539 14.231 -2.510 849 HB2 ASP 109 HB3 ASP 109 -6.785 12.237 -3.978 850 HB3 ASP 109 HB2 ASP 109 -6.764 11.591 -2.340 851 H VAL 110 H VAL 110 -2.972 12.333 -2.398 852 HA VAL 110 HA VAL 110 -3.406 11.038 0.155 853 HB VAL 110 HB VAL 110 -2.041 9.947 -1.577 854 HG11 VAL 110 HG11 VAL 110 0.306 11.651 -1.099 855 HG12 VAL 110 HG12 VAL 110 -0.977 12.385 -2.062 856 HG13 VAL 110 HG13 VAL 110 -0.247 10.864 -2.577 857 HG21 VAL 110 HG21 VAL 110 -0.216 10.590 0.711 858 HG22 VAL 110 HG22 VAL 110 -0.453 9.055 -0.124 859 HG23 VAL 110 HG23 VAL 110 -1.701 9.671 0.960 860 H ASP 111 H ASP 111 -1.963 11.368 1.980 861 HA ASP 111 HA ASP 111 -0.916 14.111 2.166 862 HB2 ASP 111 HB3 ASP 111 -2.918 12.746 3.863 863 HB3 ASP 111 HB2 ASP 111 -1.681 13.659 4.723 864 H THR 112 H THR 112 -0.763 10.784 3.357 865 HA THR 112 HA THR 112 1.939 11.355 4.378 866 HB THR 112 HB THR 112 0.085 9.139 5.260 867 HG1 THR 112 HG1 THR 112 -0.600 11.259 5.893 868 HG21 THR 112 HG21 THR 112 2.102 8.312 5.905 869 HG22 THR 112 HG22 THR 112 1.747 9.345 7.289 870 HG23 THR 112 HG23 THR 112 2.845 9.907 6.029 871 H LEU 113 H LEU 113 3.522 9.629 4.172 872 HA LEU 113 HA LEU 113 2.956 7.657 2.092 873 HB2 LEU 113 HB3 LEU 113 4.396 10.043 1.645 874 HB3 LEU 113 HB2 LEU 113 5.574 8.745 1.660 875 HG LEU 113 HG LEU 113 4.462 7.620 -0.146 876 HD11 LEU 113 HD11 LEU 113 2.472 8.820 -1.223 877 HD12 LEU 113 HD12 LEU 113 2.307 9.654 0.323 878 HD13 LEU 113 HD13 LEU 113 2.175 7.897 0.250 879 HD21 LEU 113 HD21 LEU 113 5.165 10.476 -0.382 880 HD22 LEU 113 HD22 LEU 113 4.318 9.759 -1.753 881 HD23 LEU 113 HD23 LEU 113 5.844 9.068 -1.198 882 H LEU 114 H LEU 114 3.846 5.742 2.481 883 HA LEU 114 HA LEU 114 6.150 5.535 4.283 884 HB2 LEU 114 HB3 LEU 114 3.474 4.219 4.601 885 HB3 LEU 114 HB2 LEU 114 4.920 3.416 5.183 886 HG LEU 114 HG LEU 114 4.458 6.228 6.040 887 HD11 LEU 114 HD11 LEU 114 2.362 5.673 6.680 888 HD12 LEU 114 HD12 LEU 114 3.225 4.953 8.040 889 HD13 LEU 114 HD13 LEU 114 2.703 3.942 6.692 890 HD21 LEU 114 HD21 LEU 114 6.480 5.222 6.762 891 HD22 LEU 114 HD22 LEU 114 5.650 3.747 7.255 892 HD23 LEU 114 HD23 LEU 114 5.400 5.242 8.156 893 H VAL 115 H VAL 115 7.660 4.661 3.000 894 HA VAL 115 HA VAL 115 6.857 2.373 1.320 895 HB VAL 115 HB VAL 115 8.521 3.029 -0.330 896 HG11 VAL 115 HG11 VAL 115 6.860 5.462 0.249 897 HG12 VAL 115 HG12 VAL 115 6.140 3.949 -0.301 898 HG13 VAL 115 HG13 VAL 115 7.317 4.785 -1.313 899 HG21 VAL 115 HG21 VAL 115 8.956 5.507 1.333 900 HG22 VAL 115 HG22 VAL 115 9.750 5.093 -0.186 901 HG23 VAL 115 HG23 VAL 115 10.068 4.141 1.264 902 H THR 116 H THR 116 8.275 0.677 1.078 903 HA THR 116 HA THR 116 10.507 0.589 3.001 904 HB THR 116 HB THR 116 8.664 -1.603 2.030 905 HG1 THR 116 HG1 THR 116 8.025 -1.680 4.127 906 HG21 THR 116 HG21 THR 116 11.359 -1.907 2.824 907 HG22 THR 116 HG22 THR 116 10.158 -3.155 2.492 908 HG23 THR 116 HG23 THR 116 10.335 -2.513 4.125 909 H ARG 117 H ARG 117 12.205 1.154 1.716 910 HA ARG 117 HA ARG 117 12.466 0.055 -0.947 911 HB2 ARG 117 HB3 ARG 117 13.606 2.265 0.547 912 HB3 ARG 117 HB2 ARG 117 14.844 1.367 -0.320 913 HG2 ARG 117 HG3 ARG 117 14.172 2.129 -2.307 914 HG3 ARG 117 HG2 ARG 117 12.464 1.914 -1.918 915 HD2 ARG 117 HD3 ARG 117 12.934 3.986 -0.345 916 HD3 ARG 117 HD2 ARG 117 14.234 4.269 -1.503 917 HE ARG 117 HE ARG 117 11.670 3.805 -2.721 918 HH11 ARG 117 HH11 ARG 117 13.796 6.206 -1.345 919 HH12 ARG 117 HH12 ARG 117 13.073 7.522 -2.208 920 HH21 ARG 117 HH21 ARG 117 10.718 5.534 -3.857 921 HH22 ARG 117 HH22 ARG 117 11.325 7.141 -3.634 922 H LEU 118 H LEU 118 13.087 -1.990 -1.112 923 HA LEU 118 HA LEU 118 14.705 -3.336 0.797 924 HB2 LEU 118 HB3 LEU 118 13.376 -3.967 -1.739 925 HB3 LEU 118 HB2 LEU 118 14.874 -4.845 -1.498 926 HG LEU 118 HG LEU 118 13.916 -5.500 0.791 927 HD11 LEU 118 HD11 LEU 118 11.643 -4.073 -0.428 928 HD12 LEU 118 HD12 LEU 118 12.053 -4.322 1.269 929 HD13 LEU 118 HD13 LEU 118 11.268 -5.609 0.354 930 HD21 LEU 118 HD21 LEU 118 13.294 -7.475 -0.112 931 HD22 LEU 118 HD22 LEU 118 13.962 -6.757 -1.578 932 HD23 LEU 118 HD23 LEU 118 12.222 -6.722 -1.293 933 H ALA 119 H ALA 119 16.809 -4.333 0.324 934 HA ALA 119 HA ALA 119 18.600 -2.388 -0.851 935 HB1 ALA 119 HB1 ALA 119 20.035 -4.692 -0.087 936 HB2 ALA 119 HB2 ALA 119 18.788 -4.433 1.134 937 HB3 ALA 119 HB3 ALA 119 19.931 -3.145 0.754 938 H GLY 120 H GLY 120 17.731 -5.785 -1.403 939 HA2 GLY 120 HA3 GLY 120 19.478 -6.232 -3.560 940 HA3 GLY 120 HA2 GLY 120 18.020 -7.151 -3.220 941 H SER 121 H SER 121 19.135 -6.327 -5.776 942 HA SER 121 HA SER 121 17.155 -4.404 -6.750 943 HB2 SER 121 HB3 SER 121 18.545 -4.019 -8.577 944 HB3 SER 121 HB2 SER 121 19.714 -4.373 -7.306 945 HG SER 121 HG SER 121 19.767 -6.536 -8.094 946 H PHE 122 H PHE 122 15.289 -5.205 -7.424 947 HA PHE 122 HA PHE 122 15.281 -7.835 -8.750 948 HB2 PHE 122 HB3 PHE 122 13.037 -6.536 -7.192 949 HB3 PHE 122 HB2 PHE 122 12.977 -8.116 -7.965 950 HD1 PHE 122 HD2 PHE 122 15.038 -6.233 -5.492 951 HD2 PHE 122 HD1 PHE 122 13.376 -9.968 -6.673 952 HE1 PHE 122 HE2 PHE 122 15.906 -7.266 -3.434 953 HE2 PHE 122 HE1 PHE 122 14.239 -11.007 -4.617 954 HZ PHE 122 HZ PHE 122 15.507 -9.656 -2.995 955 H GLU 123 H GLU 123 13.482 -8.130 -10.322 956 HA GLU 123 HA GLU 123 12.651 -5.651 -11.640 957 HB2 GLU 123 HB3 GLU 123 13.306 -6.533 -13.845 958 HB3 GLU 123 HB2 GLU 123 14.692 -6.299 -12.788 959 HG2 GLU 123 HG3 GLU 123 13.858 -8.930 -12.358 960 HG3 GLU 123 HG2 GLU 123 13.770 -8.680 -14.101 961 H GLY 124 H GLY 124 10.685 -5.749 -12.635 962 HA2 GLY 124 HA3 GLY 124 9.401 -8.317 -13.090 963 HA3 GLY 124 HA2 GLY 124 8.675 -7.320 -11.838 964 H ASP 125 H ASP 125 6.887 -6.408 -12.600 965 HA ASP 125 HA ASP 125 7.038 -4.872 -15.071 966 HB2 ASP 125 HB3 ASP 125 5.579 -7.387 -14.795 967 HB3 ASP 125 HB2 ASP 125 4.547 -6.059 -15.318 968 H THR 126 H THR 126 6.782 -4.308 -12.178 969 HA THR 126 HA THR 126 4.506 -2.507 -12.387 970 HB THR 126 HB THR 126 4.693 -3.960 -9.802 971 HG1 THR 126 HG1 THR 126 3.515 -5.686 -10.574 972 HG21 THR 126 HG21 THR 126 2.108 -3.654 -11.118 973 HG22 THR 126 HG22 THR 126 2.946 -2.135 -10.804 974 HG23 THR 126 HG23 THR 126 2.608 -3.247 -9.477 975 H LYS 127 H LYS 127 5.586 -0.647 -12.174 976 HA LYS 127 HA LYS 127 7.507 -0.390 -9.957 977 HB2 LYS 127 HB3 LYS 127 7.484 0.586 -12.716 978 HB3 LYS 127 HB2 LYS 127 7.860 1.841 -11.542 979 HG2 LYS 127 HG3 LYS 127 9.954 1.070 -11.926 980 HG3 LYS 127 HG2 LYS 127 9.495 -0.027 -10.622 981 HD2 LYS 127 HD3 LYS 127 10.061 -1.676 -12.024 982 HD3 LYS 127 HD2 LYS 127 8.553 -1.311 -12.865 983 HE2 LYS 127 HE3 LYS 127 10.461 -1.402 -14.403 984 HE3 LYS 127 HE2 LYS 127 9.724 0.199 -14.361 985 HZ1 LYS 127 HZ1 LYS 127 11.555 1.114 -13.463 986 HZ2 LYS 127 HZ2 LYS 127 12.339 -0.224 -14.138 987 HZ3 LYS 127 HZ3 LYS 127 11.911 -0.232 -12.502 988 H MET 128 H MET 128 7.611 1.835 -8.989 989 HA MET 128 HA MET 128 4.995 2.582 -8.102 990 HB2 MET 128 HB3 MET 128 6.945 2.607 -6.599 991 HB3 MET 128 HB2 MET 128 7.669 3.887 -7.564 992 HG2 MET 128 HG3 MET 128 6.621 4.722 -5.512 993 HG3 MET 128 HG2 MET 128 5.897 5.402 -6.968 994 HE1 MET 128 HE1 MET 128 4.579 6.126 -4.884 995 HE2 MET 128 HE2 MET 128 3.263 5.207 -4.153 996 HE3 MET 128 HE3 MET 128 3.058 5.920 -5.753 997 H ILE 129 H ILE 129 3.935 4.551 -8.365 998 HA ILE 129 HA ILE 129 4.406 5.833 -10.912 999 HB ILE 129 HB ILE 129 2.328 7.093 -10.397 1000 HG12 ILE 129 HG13 ILE 129 1.143 5.748 -8.326 1001 HG13 ILE 129 HG12 ILE 129 2.804 5.878 -7.757 1002 HG21 ILE 129 HG21 ILE 129 1.194 4.542 -9.907 1003 HG22 ILE 129 HG22 ILE 129 2.629 4.311 -10.905 1004 HG23 ILE 129 HG23 ILE 129 1.349 5.399 -11.440 1005 HD11 ILE 129 HD11 ILE 129 1.026 8.145 -8.604 1006 HD12 ILE 129 HD12 ILE 129 2.709 8.299 -8.103 1007 HD13 ILE 129 HD13 ILE 129 1.497 7.730 -6.957 1008 HA PRO 130 HA PRO 130 6.693 9.374 -9.606 1009 HB2 PRO 130 HB3 PRO 130 4.805 10.977 -11.253 1010 HB3 PRO 130 HB2 PRO 130 6.568 10.888 -11.327 1011 HG2 PRO 130 HG3 PRO 130 5.071 9.698 -13.178 1012 HG3 PRO 130 HG2 PRO 130 6.551 8.931 -12.572 1013 HD2 PRO 130 HD3 PRO 130 3.697 8.320 -11.927 1014 HD3 PRO 130 HD2 PRO 130 5.070 7.214 -12.136 1015 H LEU 131 H LEU 131 6.597 11.092 -8.164 1016 HA LEU 131 HA LEU 131 3.987 12.015 -7.242 1017 HB2 LEU 131 HB3 LEU 131 5.871 11.328 -5.069 1018 HB3 LEU 131 HB2 LEU 131 4.121 11.261 -5.100 1019 HG LEU 131 HG LEU 131 5.624 9.239 -6.695 1020 HD11 LEU 131 HD11 LEU 131 6.364 8.005 -4.953 1021 HD12 LEU 131 HD12 LEU 131 5.101 8.577 -3.863 1022 HD13 LEU 131 HD13 LEU 131 6.501 9.595 -4.203 1023 HD21 LEU 131 HD21 LEU 131 3.242 8.818 -4.929 1024 HD22 LEU 131 HD22 LEU 131 3.730 7.934 -6.375 1025 HD23 LEU 131 HD23 LEU 131 3.067 9.561 -6.519 1026 H ASN 132 H ASN 132 4.078 13.959 -5.981 1027 HA ASN 132 HA ASN 132 6.269 15.677 -6.746 1028 HB2 ASN 132 HB3 ASN 132 3.632 16.154 -6.390 1029 HB3 ASN 132 HB2 ASN 132 4.240 16.654 -4.815 1030 HD21 ASN 132 HD21 ASN 132 6.597 17.795 -5.347 1031 HD22 ASN 132 HD22 ASN 132 6.402 19.168 -6.377 1032 H TRP 133 H TRP 133 7.906 14.496 -5.576 1033 HA TRP 133 HA TRP 133 7.941 14.054 -2.841 1034 HB2 TRP 133 HB3 TRP 133 10.243 14.591 -4.718 1035 HB3 TRP 133 HB2 TRP 133 10.415 13.965 -3.080 1036 HD1 TRP 133 HD1 TRP 133 9.151 12.946 -6.553 1037 HE1 TRP 133 HE1 TRP 133 8.936 10.382 -6.629 1038 HE3 TRP 133 HE3 TRP 133 10.084 11.904 -1.635 1039 HZ2 TRP 133 HZ2 TRP 133 9.142 8.207 -4.844 1040 HZ3 TRP 133 HZ3 TRP 133 10.060 9.556 -0.901 1041 HH2 TRP 133 HH2 TRP 133 9.597 7.747 -2.472 1042 H ASP 134 H ASP 134 8.912 17.001 -4.613 1043 HA ASP 134 HA ASP 134 10.139 18.335 -2.513 1044 HB2 ASP 134 HB3 ASP 134 9.235 18.958 -5.135 1045 HB3 ASP 134 HB2 ASP 134 8.625 20.211 -4.058 1046 H ASP 135 H ASP 135 6.711 18.175 -3.385 1047 HA ASP 135 HA ASP 135 5.864 19.966 -1.335 1048 HB2 ASP 135 HB3 ASP 135 4.578 18.273 -3.380 1049 HB3 ASP 135 HB2 ASP 135 3.615 18.557 -1.933 1050 H PHE 136 H PHE 136 7.146 16.953 -1.044 1051 HA PHE 136 HA PHE 136 5.610 16.428 1.413 1052 HB2 PHE 136 HB3 PHE 136 6.765 14.444 -0.553 1053 HB3 PHE 136 HB2 PHE 136 6.186 13.999 1.050 1054 HD1 PHE 136 HD1 PHE 136 3.735 15.010 1.554 1055 HD2 PHE 136 HD2 PHE 136 5.321 14.092 -2.285 1056 HE1 PHE 136 HE1 PHE 136 1.451 14.788 0.669 1057 HE2 PHE 136 HE2 PHE 136 3.040 13.868 -3.179 1058 HZ PHE 136 HZ PHE 136 1.101 14.217 -1.701 1059 H THR 137 H THR 137 6.731 16.209 3.234 1060 HA THR 137 HA THR 137 9.673 16.224 3.044 1061 HB THR 137 HB THR 137 7.851 17.385 5.159 1062 HG1 THR 137 HG1 THR 137 8.333 19.270 4.291 1063 HG21 THR 137 HG21 THR 137 10.071 18.430 5.939 1064 HG22 THR 137 HG22 THR 137 10.817 17.054 5.127 1065 HG23 THR 137 HG23 THR 137 9.672 16.787 6.442 1066 H LYS 138 H LYS 138 10.826 14.702 4.062 1067 HA LYS 138 HA LYS 138 9.618 12.329 4.917 1068 HB2 LYS 138 HB3 LYS 138 11.975 12.632 4.046 1069 HB3 LYS 138 HB2 LYS 138 12.402 13.208 5.653 1070 HG2 LYS 138 HG3 LYS 138 12.549 11.144 6.443 1071 HG3 LYS 138 HG2 LYS 138 10.971 10.707 5.790 1072 HD2 LYS 138 HD3 LYS 138 12.428 9.254 4.701 1073 HD3 LYS 138 HD2 LYS 138 12.188 10.549 3.528 1074 HE2 LYS 138 HE3 LYS 138 14.381 11.185 5.273 1075 HE3 LYS 138 HE2 LYS 138 14.617 9.590 4.560 1076 HZ1 LYS 138 HZ1 LYS 138 13.831 11.869 2.866 1077 HZ2 LYS 138 HZ2 LYS 138 14.643 10.450 2.433 1078 HZ3 LYS 138 HZ3 LYS 138 15.451 11.655 3.303 1079 H VAL 139 H VAL 139 8.564 11.911 6.713 1080 HA VAL 139 HA VAL 139 8.837 13.632 9.030 1081 HB VAL 139 HB VAL 139 7.155 11.158 9.043 1082 HG11 VAL 139 HG11 VAL 139 6.157 13.754 10.012 1083 HG12 VAL 139 HG12 VAL 139 7.546 13.093 10.874 1084 HG13 VAL 139 HG13 VAL 139 6.060 12.152 10.743 1085 HG21 VAL 139 HG21 VAL 139 6.683 13.608 7.394 1086 HG22 VAL 139 HG22 VAL 139 5.319 12.734 8.090 1087 HG23 VAL 139 HG23 VAL 139 6.420 11.913 6.985 1088 H SER 140 H SER 140 9.704 10.401 8.009 1089 HA SER 140 HA SER 140 11.567 10.167 10.191 1090 HB2 SER 140 HB3 SER 140 8.976 8.739 10.244 1091 HB3 SER 140 HB2 SER 140 10.396 7.758 10.608 1092 HG SER 140 HG SER 140 10.622 8.771 12.442 1093 H SER 141 H SER 141 12.870 8.172 10.036 1094 HA SER 141 HA SER 141 12.706 6.602 7.635 1095 HB2 SER 141 HB3 SER 141 14.968 7.283 6.802 1096 HB3 SER 141 HB2 SER 141 13.752 8.553 6.665 1097 HG SER 141 HG SER 141 15.678 8.311 8.738 1098 H ARG 142 H ARG 142 13.367 4.628 8.150 1099 HA ARG 142 HA ARG 142 15.575 4.300 10.049 1100 HB2 ARG 142 HB3 ARG 142 13.337 4.095 11.218 1101 HB3 ARG 142 HB2 ARG 142 13.043 2.668 10.234 1102 HG2 ARG 142 HG3 ARG 142 13.863 1.725 12.151 1103 HG3 ARG 142 HG2 ARG 142 15.340 1.885 11.198 1104 HD2 ARG 142 HD3 ARG 142 15.335 4.272 12.421 1105 HD3 ARG 142 HD2 ARG 142 14.480 3.321 13.635 1106 HE ARG 142 HE ARG 142 17.254 3.242 13.074 1107 HH11 ARG 142 HH11 ARG 142 14.575 1.181 13.944 1108 HH12 ARG 142 HH12 ARG 142 15.572 0.012 14.742 1109 HH21 ARG 142 HH21 ARG 142 18.566 1.705 14.123 1110 HH22 ARG 142 HH22 ARG 142 17.837 0.309 14.844 1111 H THR 143 H THR 143 17.011 2.814 9.420 1112 HA THR 143 HA THR 143 16.335 1.173 7.087 1113 HB THR 143 HB THR 143 19.129 1.289 8.065 1114 HG1 THR 143 HG1 THR 143 17.713 3.538 7.131 1115 HG21 THR 143 HG21 THR 143 17.791 0.710 5.631 1116 HG22 THR 143 HG22 THR 143 19.508 0.578 6.013 1117 HG23 THR 143 HG23 THR 143 18.860 2.089 5.374 1118 H VAL 144 H VAL 144 15.794 -0.859 7.442 1119 HA VAL 144 HA VAL 144 16.813 -2.219 9.842 1120 HB VAL 144 HB VAL 144 14.517 -3.078 8.077 1121 HG11 VAL 144 HG11 VAL 144 15.738 -4.789 9.501 1122 HG12 VAL 144 HG12 VAL 144 13.996 -4.659 9.744 1123 HG13 VAL 144 HG13 VAL 144 15.105 -3.923 10.901 1124 HG21 VAL 144 HG21 VAL 144 14.495 -0.844 9.626 1125 HG22 VAL 144 HG22 VAL 144 13.924 -2.062 10.766 1126 HG23 VAL 144 HG23 VAL 144 13.071 -1.812 9.243 1127 H GLU 145 H GLU 145 18.207 -3.874 9.651 1128 HA GLU 145 HA GLU 145 18.594 -5.033 6.969 1129 HB2 GLU 145 HB3 GLU 145 21.006 -5.425 7.830 1130 HB3 GLU 145 HB2 GLU 145 20.552 -3.823 7.267 1131 HG2 GLU 145 HG3 GLU 145 20.553 -2.927 9.381 1132 HG3 GLU 145 HG2 GLU 145 20.289 -4.489 10.157 1133 H ASP 146 H ASP 146 18.989 -7.210 6.809 1134 HA ASP 146 HA ASP 146 18.519 -8.777 9.259 1135 HB2 ASP 146 HB3 ASP 146 17.276 -8.870 6.614 1136 HB3 ASP 146 HB2 ASP 146 17.858 -10.443 7.148 1137 H THR 147 H THR 147 19.128 -11.277 8.415 1138 HA THR 147 HA THR 147 21.921 -11.361 8.572 1139 HB THR 147 HB THR 147 21.409 -13.796 7.577 1140 HG1 THR 147 HG1 THR 147 19.369 -14.247 7.467 1141 HG21 THR 147 HG21 THR 147 21.987 -14.178 9.682 1142 HG22 THR 147 HG22 THR 147 20.268 -14.083 10.062 1143 HG23 THR 147 HG23 THR 147 21.289 -12.655 10.236 1144 H ASN 148 H ASN 148 19.741 -11.558 5.808 1145 HA ASN 148 HA ASN 148 21.976 -11.827 3.962 1146 HB2 ASN 148 HB3 ASN 148 19.010 -12.063 3.754 1147 HB3 ASN 148 HB2 ASN 148 19.904 -11.627 2.300 1148 HD21 ASN 148 HD21 ASN 148 18.400 -14.046 2.929 1149 HD22 ASN 148 HD22 ASN 148 19.511 -15.357 2.752 1150 HA PRO 149 HA PRO 149 22.354 -7.465 3.277 1151 HB2 PRO 149 HB3 PRO 149 23.392 -7.533 0.742 1152 HB3 PRO 149 HB2 PRO 149 24.338 -7.838 2.203 1153 HG2 PRO 149 HG3 PRO 149 23.114 -9.792 0.295 1154 HG3 PRO 149 HG2 PRO 149 24.711 -9.829 1.067 1155 HD2 PRO 149 HD3 PRO 149 22.667 -11.328 1.966 1156 HD3 PRO 149 HD2 PRO 149 23.863 -10.618 3.071 1157 H ALA 150 H ALA 150 20.602 -9.549 1.096 1158 HA ALA 150 HA ALA 150 19.415 -7.367 -0.378 1159 HB1 ALA 150 HB1 ALA 150 18.000 -9.275 -1.331 1160 HB2 ALA 150 HB2 ALA 150 19.073 -10.346 -0.430 1161 HB3 ALA 150 HB3 ALA 150 19.729 -9.284 -1.675 1162 H LEU 151 H LEU 151 18.759 -9.017 2.545 1163 HA LEU 151 HA LEU 151 15.910 -8.506 2.482 1164 HB2 LEU 151 HB3 LEU 151 17.748 -9.671 4.560 1165 HB3 LEU 151 HB2 LEU 151 16.054 -9.352 4.879 1166 HG LEU 151 HG LEU 151 17.243 -11.361 2.984 1167 HD11 LEU 151 HD11 LEU 151 16.622 -11.660 5.546 1168 HD12 LEU 151 HD12 LEU 151 16.370 -12.942 4.361 1169 HD13 LEU 151 HD13 LEU 151 15.019 -11.924 4.859 1170 HD21 LEU 151 HD21 LEU 151 14.413 -10.331 3.062 1171 HD22 LEU 151 HD22 LEU 151 14.890 -11.846 2.297 1172 HD23 LEU 151 HD23 LEU 151 15.526 -10.316 1.694 1173 H THR 152 H THR 152 18.358 -6.453 2.777 1174 HA THR 152 HA THR 152 17.659 -5.049 5.174 1175 HB THR 152 HB THR 152 19.101 -3.674 2.958 1176 HG1 THR 152 HG1 THR 152 21.004 -4.849 3.548 1177 HG21 THR 152 HG21 THR 152 19.626 -2.346 4.647 1178 HG22 THR 152 HG22 THR 152 20.614 -3.658 5.289 1179 HG23 THR 152 HG23 THR 152 18.944 -3.469 5.822 1180 H HIS 153 H HIS 153 15.958 -3.779 5.442 1181 HA HIS 153 HA HIS 153 14.705 -2.577 3.061 1182 HB2 HIS 153 HB3 HIS 153 13.238 -2.997 5.645 1183 HB3 HIS 153 HB2 HIS 153 12.594 -2.857 4.014 1184 HD1 HIS 153 HD1 HIS 153 12.289 -5.238 6.270 1185 HD2 HIS 153 HD2 HIS 153 14.358 -5.314 2.668 1186 HE1 HIS 153 HE1 HIS 153 12.457 -7.667 5.641 1187 HE2 HIS 153 HE2 HIS 153 13.638 -7.683 3.417 1188 H THR 154 H THR 154 13.700 -0.492 3.334 1189 HA THR 154 HA THR 154 14.785 1.082 5.570 1190 HB THR 154 HB THR 154 14.644 2.038 2.706 1191 HG1 THR 154 HG1 THR 154 16.327 0.706 2.657 1192 HG21 THR 154 HG21 THR 154 16.413 3.343 4.653 1193 HG22 THR 154 HG22 THR 154 14.684 3.602 4.888 1194 HG23 THR 154 HG23 THR 154 15.440 4.031 3.353 1195 H TYR 155 H TYR 155 13.067 1.677 6.718 1196 HA TYR 155 HA TYR 155 10.532 2.233 5.388 1197 HB2 TYR 155 HB3 TYR 155 11.384 1.617 8.167 1198 HB3 TYR 155 HB2 TYR 155 9.968 2.646 7.982 1199 HD1 TYR 155 HD1 TYR 155 8.102 1.760 6.407 1200 HD2 TYR 155 HD2 TYR 155 11.148 -0.693 8.080 1201 HE1 TYR 155 HE1 TYR 155 6.703 -0.227 6.027 1202 HE2 TYR 155 HE2 TYR 155 9.758 -2.687 7.704 1203 HH TYR 155 HH TYR 155 6.469 -2.512 6.923 1204 H GLU 156 H GLU 156 10.003 4.225 4.798 1205 HA GLU 156 HA GLU 156 11.100 6.482 6.338 1206 HB2 GLU 156 HB3 GLU 156 10.935 6.113 3.361 1207 HB3 GLU 156 HB2 GLU 156 10.996 7.719 4.073 1208 HG2 GLU 156 HG3 GLU 156 13.131 7.266 5.060 1209 HG3 GLU 156 HG2 GLU 156 13.054 5.579 4.554 1210 H VAL 157 H VAL 157 9.768 8.192 6.728 1211 HA VAL 157 HA VAL 157 6.949 7.851 5.952 1212 HB VAL 157 HB VAL 157 7.940 9.432 8.323 1213 HG11 VAL 157 HG11 VAL 157 5.457 8.768 8.965 1214 HG12 VAL 157 HG12 VAL 157 5.284 8.687 7.212 1215 HG13 VAL 157 HG13 VAL 157 5.812 10.185 7.977 1216 HG21 VAL 157 HG21 VAL 157 6.821 6.634 8.381 1217 HG22 VAL 157 HG22 VAL 157 7.445 7.571 9.738 1218 HG23 VAL 157 HG23 VAL 157 8.542 7.007 8.477 1219 H TRP 158 H TRP 158 5.771 9.654 5.333 1220 HA TRP 158 HA TRP 158 7.197 12.171 4.919 1221 HB2 TRP 158 HB3 TRP 158 5.882 10.642 2.671 1222 HB3 TRP 158 HB2 TRP 158 6.455 12.300 2.550 1223 HD1 TRP 158 HD1 TRP 158 7.894 8.772 3.267 1224 HE1 TRP 158 HE1 TRP 158 10.301 8.700 2.355 1225 HE3 TRP 158 HE3 TRP 158 8.326 13.628 1.731 1226 HZ2 TRP 158 HZ2 TRP 158 12.138 10.469 1.144 1227 HZ3 TRP 158 HZ3 TRP 158 10.440 14.358 0.706 1228 HH2 TRP 158 HH2 TRP 158 12.306 12.810 0.419 1229 H GLN 159 H GLN 159 5.947 13.929 5.140 1230 HA GLN 159 HA GLN 159 3.031 13.621 5.026 1231 HB2 GLN 159 HB3 GLN 159 4.677 14.469 7.358 1232 HB3 GLN 159 HB2 GLN 159 3.167 15.324 7.078 1233 HG2 GLN 159 HG3 GLN 159 1.917 13.281 7.234 1234 HG3 GLN 159 HG2 GLN 159 3.403 12.336 7.339 1235 HE21 GLN 159 HE21 GLN 159 2.440 15.344 8.938 1236 HE22 GLN 159 HE22 GLN 159 2.609 14.746 10.550 1237 H LYS 160 H LYS 160 2.106 15.185 3.844 1238 HA LYS 160 HA LYS 160 3.571 17.132 2.503 1239 HB2 LYS 160 HB3 LYS 160 1.204 16.166 2.038 1240 HB3 LYS 160 HB2 LYS 160 0.643 17.470 3.074 1241 HG2 LYS 160 HG3 LYS 160 2.504 18.291 0.960 1242 HG3 LYS 160 HG2 LYS 160 0.956 17.659 0.395 1243 HD2 LYS 160 HD3 LYS 160 1.062 19.707 2.578 1244 HD3 LYS 160 HD2 LYS 160 1.183 20.193 0.886 1245 HE2 LYS 160 HE3 LYS 160 -0.946 18.537 0.771 1246 HE3 LYS 160 HE2 LYS 160 -1.122 19.167 2.408 1247 HZ1 LYS 160 HZ1 LYS 160 -1.425 20.521 -0.141 1248 HZ2 LYS 160 HZ2 LYS 160 -0.638 21.409 1.064 1249 HZ3 LYS 160 HZ3 LYS 160 -2.195 20.809 1.338 1250 H LYS 161 H LYS 161 4.068 19.219 2.871 1251 HA LYS 161 HA LYS 161 4.161 20.196 5.503 1252 HB2 LYS 161 HB3 LYS 161 4.451 21.662 2.875 1253 HB3 LYS 161 HB2 LYS 161 4.845 22.347 4.445 1254 HG2 LYS 161 HG3 LYS 161 6.750 21.129 4.657 1255 HG3 LYS 161 HG2 LYS 161 6.119 19.772 3.722 1256 HD2 LYS 161 HD3 LYS 161 7.669 20.633 2.256 1257 HD3 LYS 161 HD2 LYS 161 6.211 21.485 1.743 1258 HE2 LYS 161 HE3 LYS 161 7.529 23.304 1.932 1259 HE3 LYS 161 HE2 LYS 161 7.106 23.176 3.638 1260 HZ1 LYS 161 HZ1 LYS 161 9.141 22.154 4.129 1261 HZ2 LYS 161 HZ2 LYS 161 9.543 23.425 3.087 1262 HZ3 LYS 161 HZ3 LYS 161 9.489 21.838 2.503 1263 H ALA 162 H ALA 162 2.748 21.291 6.708 1264 HA ALA 162 HA ALA 162 0.851 22.357 7.374 1265 HB1 ALA 162 HB1 ALA 162 0.433 24.312 6.334 1266 HB2 ALA 162 HB2 ALA 162 0.283 23.558 4.746 1267 HB3 ALA 162 HB3 ALA 162 1.880 23.898 5.414 1268 H51A NDP 170 H51A NDP 170 -4.983 -0.757 -10.923 1269 H52A NDP 170 H52A NDP 170 -5.689 0.419 -9.800 1270 H4B NDP 170 H4B NDP 170 -7.228 -1.621 -11.464 1271 H3B NDP 170 H3B NDP 170 -6.932 1.378 -11.734 1272 HO3A NDP 170 HO3A NDP 170 -6.991 0.644 -13.960 1273 H2B NDP 170 H2B NDP 170 -9.202 1.421 -12.510 1274 H1B NDP 170 H1B NDP 170 -10.194 -0.264 -10.558 1275 H8A NDP 170 H8A NDP 170 -7.357 2.183 -9.665 1276 H61A NDP 170 H61A NDP 170 -11.913 5.797 -7.502 1277 H62A NDP 170 H62A NDP 170 -10.183 5.634 -7.703 1278 H2A NDP 170 H2A NDP 170 -13.787 2.194 -9.409 1279 H51N NDP 170 H51N NDP 170 -1.342 -3.479 -8.049 1280 H52N NDP 170 H52N NDP 170 -0.425 -2.577 -9.269 1281 H4D NDP 170 H4D NDP 170 0.850 -4.668 -9.804 1282 H3D NDP 170 H3D NDP 170 -0.788 -5.865 -7.556 1283 HO3N NDP 170 HO3N NDP 170 -1.407 -6.773 -9.427 1284 H2D NDP 170 H2D NDP 170 1.160 -7.142 -6.978 1285 HO2N NDP 170 HO2N NDP 170 2.772 -7.555 -8.313 1286 H1D NDP 170 H1D NDP 170 2.941 -5.036 -7.205 1287 H2N NDP 170 H2N NDP 170 3.390 -4.884 -4.859 1288 H71N NDP 170 H71N NDP 170 5.127 -4.487 -2.170 1289 H72N NDP 170 H72N NDP 170 4.719 -5.065 -3.765 1290 H41N NDP 170 H41N NDP 170 0.325 -3.530 -2.695 1291 H42N NDP 170 H42N NDP 170 0.238 -5.309 -2.466 1292 H5N NDP 170 H5N NDP 170 -1.498 -4.508 -4.066 1293 H6N NDP 170 H6N NDP 170 -0.694 -4.873 -6.405 Start of MODEL 22 1 H1 THR 1 HT1 THR 1 -4.603 8.201 6.292 2 H2 THR 1 HT2 THR 1 -6.096 8.633 5.562 3 H3 THR 1 HT3 THR 1 -4.841 9.795 5.709 4 HA THR 1 HA THR 1 -5.019 7.465 3.947 5 HB THR 1 HB THR 1 -4.632 9.121 2.238 6 HG1 THR 1 HG1 THR 1 -4.325 11.318 2.833 7 HG21 THR 1 HG21 THR 1 -6.475 10.687 3.944 8 HG22 THR 1 HG22 THR 1 -6.933 9.034 3.534 9 HG23 THR 1 HG23 THR 1 -6.620 10.205 2.254 10 H ALA 2 H ALA 2 -3.297 6.176 4.318 11 HA ALA 2 HA ALA 2 -0.639 7.437 4.201 12 HB1 ALA 2 HB1 ALA 2 -1.242 5.021 5.890 13 HB2 ALA 2 HB2 ALA 2 -1.277 6.669 6.518 14 HB3 ALA 2 HB3 ALA 2 0.224 6.002 5.875 15 H PHE 3 H PHE 3 0.924 6.353 3.040 16 HA PHE 3 HA PHE 3 -0.064 4.159 1.351 17 HB2 PHE 3 HB3 PHE 3 1.954 6.331 0.974 18 HB3 PHE 3 HB2 PHE 3 2.161 4.827 0.088 19 HD1 PHE 3 HD2 PHE 3 -1.074 6.412 0.924 20 HD2 PHE 3 HD1 PHE 3 1.815 5.602 -2.094 21 HE1 PHE 3 HE2 PHE 3 -2.645 7.215 -0.792 22 HE2 PHE 3 HE1 PHE 3 0.251 6.405 -3.813 23 HZ PHE 3 HZ PHE 3 -1.980 7.213 -3.164 24 H LEU 4 H LEU 4 0.615 2.156 1.847 25 HA LEU 4 HA LEU 4 3.313 1.864 2.980 26 HB2 LEU 4 HB3 LEU 4 1.739 1.591 4.785 27 HB3 LEU 4 HB2 LEU 4 0.795 0.453 3.843 28 HG LEU 4 HG LEU 4 2.579 -1.185 3.949 29 HD11 LEU 4 HD11 LEU 4 4.577 0.004 3.906 30 HD12 LEU 4 HD12 LEU 4 4.512 -0.619 5.555 31 HD13 LEU 4 HD13 LEU 4 4.089 1.061 5.231 32 HD21 LEU 4 HD21 LEU 4 2.480 -0.337 6.772 33 HD22 LEU 4 HD22 LEU 4 2.059 -1.882 6.032 34 HD23 LEU 4 HD23 LEU 4 0.928 -0.530 5.958 35 H TRP 5 H TRP 5 4.523 0.794 1.559 36 HA TRP 5 HA TRP 5 3.654 -1.755 0.572 37 HB2 TRP 5 HB3 TRP 5 3.456 -1.353 -1.696 38 HB3 TRP 5 HB2 TRP 5 2.718 0.089 -1.014 39 HD1 TRP 5 HD1 TRP 5 5.784 -1.068 -2.969 40 HE1 TRP 5 HE1 TRP 5 6.973 0.999 -3.939 41 HE3 TRP 5 HE3 TRP 5 3.118 2.577 -0.594 42 HZ2 TRP 5 HZ2 TRP 5 6.799 3.809 -3.726 43 HZ3 TRP 5 HZ3 TRP 5 3.688 4.936 -1.034 44 HH2 TRP 5 HH2 TRP 5 5.490 5.535 -2.566 45 H ALA 6 H ALA 6 5.342 -2.935 -0.558 46 HA ALA 6 HA ALA 6 7.999 -2.042 0.323 47 HB1 ALA 6 HB1 ALA 6 6.973 -4.768 -0.454 48 HB2 ALA 6 HB2 ALA 6 7.391 -4.202 1.164 49 HB3 ALA 6 HB3 ALA 6 8.654 -4.418 -0.049 50 H GLN 7 H GLN 7 9.761 -1.949 -1.079 51 HA GLN 7 HA GLN 7 9.340 -2.560 -3.892 52 HB2 GLN 7 HB3 GLN 7 10.183 -0.270 -4.545 53 HB3 GLN 7 HB2 GLN 7 8.552 -0.321 -3.889 54 HG2 GLN 7 HG3 GLN 7 10.374 0.075 -1.742 55 HG3 GLN 7 HG2 GLN 7 10.754 1.224 -3.024 56 HE21 GLN 7 HE21 GLN 7 8.195 0.033 -0.931 57 HE22 GLN 7 HE22 GLN 7 7.235 1.468 -0.976 58 H ASP 8 H ASP 8 11.326 -2.365 -5.187 59 HA ASP 8 HA ASP 8 13.638 -3.123 -3.568 60 HB2 ASP 8 HB3 ASP 8 14.555 -4.082 -5.599 61 HB3 ASP 8 HB2 ASP 8 12.899 -4.638 -5.387 62 H ARG 9 H ARG 9 15.709 -2.572 -5.283 63 HA ARG 9 HA ARG 9 16.332 0.071 -4.637 64 HB2 ARG 9 HB3 ARG 9 17.563 -1.946 -6.476 65 HB3 ARG 9 HB2 ARG 9 18.197 -0.308 -6.406 66 HG2 ARG 9 HG3 ARG 9 17.913 -1.210 -3.744 67 HG3 ARG 9 HG2 ARG 9 18.695 -2.498 -4.662 68 HD2 ARG 9 HD3 ARG 9 20.528 -1.272 -4.061 69 HD3 ARG 9 HD2 ARG 9 20.133 -0.498 -5.595 70 HE ARG 9 HE ARG 9 18.750 0.953 -3.762 71 HH11 ARG 9 HH11 ARG 9 22.099 0.025 -4.087 72 HH12 ARG 9 HH12 ARG 9 22.698 1.442 -3.293 73 HH21 ARG 9 HH21 ARG 9 19.537 2.818 -2.718 74 HH22 ARG 9 HH22 ARG 9 21.245 3.028 -2.515 75 H ASP 10 H ASP 10 14.847 -1.236 -7.531 76 HA ASP 10 HA ASP 10 15.214 1.252 -8.983 77 HB2 ASP 10 HB3 ASP 10 13.692 -1.259 -9.720 78 HB3 ASP 10 HB2 ASP 10 13.969 0.111 -10.791 79 H GLY 11 H GLY 11 12.716 -0.471 -7.275 80 HA2 GLY 11 HA3 GLY 11 11.112 1.171 -6.179 81 HA3 GLY 11 HA2 GLY 11 10.836 1.739 -7.818 82 H LEU 12 H LEU 12 11.360 -1.576 -7.839 83 HA LEU 12 HA LEU 12 8.899 -2.308 -8.824 84 HB2 LEU 12 HB3 LEU 12 11.169 -3.616 -8.513 85 HB3 LEU 12 HB2 LEU 12 10.392 -4.207 -7.060 86 HG LEU 12 HG LEU 12 8.559 -5.154 -8.431 87 HD11 LEU 12 HD11 LEU 12 8.667 -5.184 -10.815 88 HD12 LEU 12 HD12 LEU 12 10.236 -4.380 -10.813 89 HD13 LEU 12 HD13 LEU 12 8.796 -3.503 -10.300 90 HD21 LEU 12 HD21 LEU 12 10.395 -6.620 -9.841 91 HD22 LEU 12 HD22 LEU 12 9.919 -6.903 -8.166 92 HD23 LEU 12 HD23 LEU 12 11.363 -5.956 -8.524 93 H ILE 13 H ILE 13 7.479 -4.048 -7.623 94 HA ILE 13 HA ILE 13 7.084 -3.516 -4.830 95 HB ILE 13 HB ILE 13 4.808 -2.782 -4.922 96 HG12 ILE 13 HG13 ILE 13 4.675 -2.232 -7.807 97 HG13 ILE 13 HG12 ILE 13 4.656 -3.943 -7.407 98 HG21 ILE 13 HG21 ILE 13 6.574 -1.079 -5.055 99 HG22 ILE 13 HG22 ILE 13 5.076 -0.560 -5.828 100 HG23 ILE 13 HG23 ILE 13 6.438 -1.097 -6.813 101 HD11 ILE 13 HD11 ILE 13 2.406 -3.065 -7.571 102 HD12 ILE 13 HD12 ILE 13 2.770 -1.860 -6.339 103 HD13 ILE 13 HD13 ILE 13 2.753 -3.571 -5.920 104 H GLY 14 H GLY 14 6.153 -5.145 -7.785 105 HA2 GLY 14 HA3 GLY 14 5.776 -7.585 -6.268 106 HA3 GLY 14 HA2 GLY 14 4.371 -7.012 -7.151 107 H LYS 15 H LYS 15 5.013 -9.364 -7.884 108 HA LYS 15 HA LYS 15 6.590 -9.095 -10.355 109 HB2 LYS 15 HB3 LYS 15 7.068 -11.533 -10.148 110 HB3 LYS 15 HB2 LYS 15 7.781 -10.563 -8.868 111 HG2 LYS 15 HG3 LYS 15 6.872 -11.978 -7.422 112 HG3 LYS 15 HG2 LYS 15 5.306 -11.299 -7.857 113 HD2 LYS 15 HD3 LYS 15 5.440 -13.795 -7.988 114 HD3 LYS 15 HD2 LYS 15 4.933 -13.010 -9.481 115 HE2 LYS 15 HE3 LYS 15 6.638 -13.902 -10.591 116 HE3 LYS 15 HE2 LYS 15 7.791 -13.257 -9.425 117 HZ1 LYS 15 HZ1 LYS 15 7.222 -15.207 -7.993 118 HZ2 LYS 15 HZ2 LYS 15 8.028 -15.596 -9.428 119 HZ3 LYS 15 HZ3 LYS 15 6.361 -15.851 -9.300 120 H ASP 16 H ASP 16 3.948 -8.410 -10.340 121 HA ASP 16 HA ASP 16 2.162 -8.698 -11.751 122 HB2 ASP 16 HB3 ASP 16 3.918 -10.512 -12.834 123 HB3 ASP 16 HB2 ASP 16 2.560 -11.539 -12.386 124 H GLY 17 H GLY 17 2.323 -9.310 -8.908 125 HA2 GLY 17 HA3 GLY 17 -0.278 -10.353 -8.536 126 HA3 GLY 17 HA2 GLY 17 0.910 -11.590 -8.152 127 H HIS 18 H HIS 18 2.901 -10.181 -6.961 128 HA HIS 18 HA HIS 18 2.092 -8.284 -5.039 129 HB2 HIS 18 HB3 HIS 18 2.051 -9.649 -3.022 130 HB3 HIS 18 HB2 HIS 18 0.822 -10.219 -4.144 131 HD1 HIS 18 HD1 HIS 18 4.256 -11.151 -2.865 132 HD2 HIS 18 HD2 HIS 18 1.031 -12.857 -4.855 133 HE1 HIS 18 HE1 HIS 18 4.762 -13.612 -2.981 134 HE2 HIS 18 HE2 HIS 18 2.840 -14.610 -4.268 135 H LEU 19 H LEU 19 3.819 -8.850 -2.952 136 HA LEU 19 HA LEU 19 6.299 -8.112 -4.073 137 HB2 LEU 19 HB3 LEU 19 6.485 -9.258 -1.389 138 HB3 LEU 19 HB2 LEU 19 6.927 -7.663 -1.964 139 HG LEU 19 HG LEU 19 4.276 -7.345 -1.947 140 HD11 LEU 19 HD11 LEU 19 4.138 -9.787 -1.114 141 HD12 LEU 19 HD12 LEU 19 3.143 -8.558 -0.331 142 HD13 LEU 19 HD13 LEU 19 4.630 -9.113 0.440 143 HD21 LEU 19 HD21 LEU 19 6.418 -6.889 0.008 144 HD22 LEU 19 HD22 LEU 19 4.777 -6.787 0.646 145 HD23 LEU 19 HD23 LEU 19 5.264 -5.763 -0.703 146 HA PRO 20 HA PRO 20 7.680 -12.246 -5.125 147 HB2 PRO 20 HB3 PRO 20 10.107 -11.554 -6.093 148 HB3 PRO 20 HB2 PRO 20 8.614 -11.278 -6.996 149 HG2 PRO 20 HG3 PRO 20 10.206 -9.356 -5.342 150 HG3 PRO 20 HG2 PRO 20 9.470 -9.114 -6.937 151 HD2 PRO 20 HD3 PRO 20 8.326 -8.224 -4.646 152 HD3 PRO 20 HD2 PRO 20 7.376 -8.742 -6.054 153 H TRP 21 H TRP 21 8.861 -10.220 -2.694 154 HA TRP 21 HA TRP 21 10.830 -12.226 -1.822 155 HB2 TRP 21 HB3 TRP 21 11.660 -10.342 -0.336 156 HB3 TRP 21 HB2 TRP 21 11.903 -10.116 -2.066 157 HD1 TRP 21 HD1 TRP 21 9.267 -9.085 0.595 158 HE1 TRP 21 HE1 TRP 21 8.444 -6.718 0.015 159 HE3 TRP 21 HE3 TRP 21 11.921 -8.338 -3.710 160 HZ2 TRP 21 HZ2 TRP 21 8.863 -4.790 -2.004 161 HZ3 TRP 21 HZ3 TRP 21 11.652 -6.205 -4.906 162 HH2 TRP 21 HH2 TRP 21 10.153 -4.468 -4.069 163 H HIS 22 H HIS 22 11.038 -12.357 0.615 164 HA HIS 22 HA HIS 22 8.366 -12.278 1.857 165 HB2 HIS 22 HB3 HIS 22 10.143 -14.496 1.463 166 HB3 HIS 22 HB2 HIS 22 9.970 -14.202 3.190 167 HD1 HIS 22 HD1 HIS 22 7.079 -13.537 3.512 168 HD2 HIS 22 HD2 HIS 22 8.399 -16.472 0.883 169 HE1 HIS 22 HE1 HIS 22 5.107 -15.056 3.154 170 HE2 HIS 22 HE2 HIS 22 5.904 -16.774 1.493 171 H LEU 23 H LEU 23 8.833 -10.196 2.698 172 HA LEU 23 HA LEU 23 11.075 -9.883 4.505 173 HB2 LEU 23 HB3 LEU 23 9.191 -8.142 3.126 174 HB3 LEU 23 HB2 LEU 23 9.457 -7.654 4.788 175 HG LEU 23 HG LEU 23 11.944 -7.732 4.274 176 HD11 LEU 23 HD11 LEU 23 10.954 -8.733 1.810 177 HD12 LEU 23 HD12 LEU 23 12.626 -8.470 2.306 178 HD13 LEU 23 HD13 LEU 23 11.731 -7.180 1.505 179 HD21 LEU 23 HD21 LEU 23 10.314 -5.729 2.721 180 HD22 LEU 23 HD22 LEU 23 11.945 -5.514 3.358 181 HD23 LEU 23 HD23 LEU 23 10.580 -5.666 4.464 182 HA PRO 24 HA PRO 24 8.452 -11.414 7.861 183 HB2 PRO 24 HB3 PRO 24 10.866 -10.969 9.481 184 HB3 PRO 24 HB2 PRO 24 9.965 -12.461 9.198 185 HG2 PRO 24 HG3 PRO 24 12.397 -12.050 8.130 186 HG3 PRO 24 HG2 PRO 24 11.139 -12.963 7.277 187 HD2 PRO 24 HD3 PRO 24 12.022 -10.128 6.882 188 HD3 PRO 24 HD2 PRO 24 11.610 -11.359 5.670 189 H ASP 25 H ASP 25 10.471 -8.544 7.846 190 HA ASP 25 HA ASP 25 9.270 -7.401 10.184 191 HB2 ASP 25 HB3 ASP 25 10.552 -5.349 9.371 192 HB3 ASP 25 HB2 ASP 25 11.504 -6.755 9.816 193 H ASP 26 H ASP 26 8.664 -7.353 6.762 194 HA ASP 26 HA ASP 26 7.025 -4.985 6.840 195 HB2 ASP 26 HB3 ASP 26 8.371 -6.022 4.834 196 HB3 ASP 26 HB2 ASP 26 6.903 -6.966 4.599 197 H LEU 27 H LEU 27 6.366 -8.454 6.297 198 HA LEU 27 HA LEU 27 3.592 -8.263 6.236 199 HB2 LEU 27 HB3 LEU 27 3.683 -10.689 6.872 200 HB3 LEU 27 HB2 LEU 27 4.598 -10.244 5.451 201 HG LEU 27 HG LEU 27 6.532 -10.052 7.324 202 HD11 LEU 27 HD11 LEU 27 5.340 -12.555 8.278 203 HD12 LEU 27 HD12 LEU 27 4.532 -11.087 8.830 204 HD13 LEU 27 HD13 LEU 27 6.251 -11.321 9.148 205 HD21 LEU 27 HD21 LEU 27 6.090 -12.810 6.418 206 HD22 LEU 27 HD22 LEU 27 7.467 -11.737 6.168 207 HD23 LEU 27 HD23 LEU 27 6.038 -11.590 5.145 208 H HIS 28 H HIS 28 5.737 -9.074 8.964 209 HA HIS 28 HA HIS 28 3.726 -9.365 10.892 210 HB2 HIS 28 HB3 HIS 28 6.347 -9.826 10.930 211 HB3 HIS 28 HB2 HIS 28 6.366 -8.248 11.710 212 HD1 HIS 28 HD1 HIS 28 3.331 -9.413 12.870 213 HD2 HIS 28 HD2 HIS 28 7.246 -10.566 13.650 214 HE1 HIS 28 HE1 HIS 28 3.253 -10.605 15.083 215 HE2 HIS 28 HE2 HIS 28 5.617 -11.375 15.489 216 H TYR 29 H TYR 29 5.597 -6.526 9.903 217 HA TYR 29 HA TYR 29 4.450 -4.780 11.837 218 HB2 TYR 29 HB3 TYR 29 6.640 -4.387 10.698 219 HB3 TYR 29 HB2 TYR 29 5.761 -4.047 9.212 220 HD1 TYR 29 HD1 TYR 29 5.458 -2.990 12.791 221 HD2 TYR 29 HD2 TYR 29 5.670 -1.804 8.711 222 HE1 TYR 29 HE1 TYR 29 5.239 -0.637 13.470 223 HE2 TYR 29 HE2 TYR 29 5.452 0.553 9.379 224 HH TYR 29 HH TYR 29 4.294 1.694 11.752 225 H PHE 30 H PHE 30 3.552 -5.807 8.631 226 HA PHE 30 HA PHE 30 1.769 -3.749 7.963 227 HB2 PHE 30 HB3 PHE 30 2.652 -5.624 6.470 228 HB3 PHE 30 HB2 PHE 30 1.402 -6.639 7.182 229 HD1 PHE 30 HD1 PHE 30 2.025 -3.656 5.115 230 HD2 PHE 30 HD2 PHE 30 -0.867 -6.439 6.529 231 HE1 PHE 30 HE1 PHE 30 0.405 -2.802 3.471 232 HE2 PHE 30 HE2 PHE 30 -2.492 -5.591 4.888 233 HZ PHE 30 HZ PHE 30 -1.857 -3.770 3.356 234 H ARG 31 H ARG 31 0.948 -7.002 9.181 235 HA ARG 31 HA ARG 31 -1.739 -6.373 9.746 236 HB2 ARG 31 HB3 ARG 31 -0.411 -8.676 9.568 237 HB3 ARG 31 HB2 ARG 31 -0.367 -8.497 11.316 238 HG2 ARG 31 HG3 ARG 31 -2.438 -9.251 11.474 239 HG3 ARG 31 HG2 ARG 31 -3.015 -7.961 10.416 240 HD2 ARG 31 HD3 ARG 31 -3.526 -10.289 9.632 241 HD3 ARG 31 HD2 ARG 31 -2.659 -9.282 8.473 242 HE ARG 31 HE ARG 31 -0.929 -10.763 8.563 243 HH11 ARG 31 HH11 ARG 31 -2.895 -11.199 11.413 244 HH12 ARG 31 HH12 ARG 31 -2.009 -12.580 11.966 245 HH21 ARG 31 HH21 ARG 31 0.238 -12.579 9.288 246 HH22 ARG 31 HH22 ARG 31 -0.230 -13.363 10.760 247 H ALA 32 H ALA 32 1.193 -5.910 11.546 248 HA ALA 32 HA ALA 32 -0.021 -5.622 14.112 249 HB1 ALA 32 HB1 ALA 32 2.675 -5.158 12.962 250 HB2 ALA 32 HB2 ALA 32 2.189 -6.102 14.371 251 HB3 ALA 32 HB3 ALA 32 2.274 -4.344 14.474 252 H GLN 33 H GLN 33 0.813 -3.407 11.505 253 HA GLN 33 HA GLN 33 0.037 -1.095 13.085 254 HB2 GLN 33 HB3 GLN 33 1.618 -1.561 10.719 255 HB3 GLN 33 HB2 GLN 33 0.413 -0.320 10.406 256 HG2 GLN 33 HG3 GLN 33 1.880 -0.054 12.940 257 HG3 GLN 33 HG2 GLN 33 2.835 0.155 11.473 258 HE21 GLN 33 HE21 GLN 33 2.240 1.808 10.002 259 HE22 GLN 33 HE22 GLN 33 1.336 3.182 10.532 260 H THR 34 H THR 34 -1.302 -3.189 10.659 261 HA THR 34 HA THR 34 -3.525 -1.372 10.147 262 HB THR 34 HB THR 34 -4.222 -3.035 8.473 263 HG1 THR 34 HG1 THR 34 -1.911 -4.469 9.261 264 HG21 THR 34 HG21 THR 34 -2.618 -1.369 7.740 265 HG22 THR 34 HG22 THR 34 -2.325 -2.919 6.951 266 HG23 THR 34 HG23 THR 34 -1.289 -2.396 8.279 267 H VAL 35 H VAL 35 -3.319 -2.379 12.796 268 HA VAL 35 HA VAL 35 -5.321 -4.478 13.019 269 HB VAL 35 HB VAL 35 -4.006 -2.971 15.277 270 HG11 VAL 35 HG11 VAL 35 -5.649 -4.117 16.332 271 HG12 VAL 35 HG12 VAL 35 -4.478 -5.431 16.224 272 HG13 VAL 35 HG13 VAL 35 -5.788 -5.317 15.048 273 HG21 VAL 35 HG21 VAL 35 -3.090 -5.609 14.157 274 HG22 VAL 35 HG22 VAL 35 -2.290 -4.599 15.361 275 HG23 VAL 35 HG23 VAL 35 -2.378 -4.067 13.682 276 H GLY 36 H GLY 36 -7.407 -3.987 12.987 277 HA2 GLY 36 HA3 GLY 36 -9.395 -2.945 13.496 278 HA3 GLY 36 HA2 GLY 36 -8.525 -2.004 14.698 279 H LYS 37 H LYS 37 -7.371 -1.931 11.446 280 HA LYS 37 HA LYS 37 -8.508 0.771 11.136 281 HB2 LYS 37 HB3 LYS 37 -5.930 -0.265 9.947 282 HB3 LYS 37 HB2 LYS 37 -6.531 1.386 9.887 283 HG2 LYS 37 HG3 LYS 37 -6.339 1.493 12.355 284 HG3 LYS 37 HG2 LYS 37 -5.605 -0.111 12.327 285 HD2 LYS 37 HD3 LYS 37 -3.823 0.769 10.858 286 HD3 LYS 37 HD2 LYS 37 -4.538 2.377 10.994 287 HE2 LYS 37 HE3 LYS 37 -3.555 0.736 13.325 288 HE3 LYS 37 HE2 LYS 37 -2.618 1.998 12.527 289 HZ1 LYS 37 HZ1 LYS 37 -4.131 3.638 13.232 290 HZ2 LYS 37 HZ2 LYS 37 -3.845 2.676 14.593 291 HZ3 LYS 37 HZ3 LYS 37 -5.283 2.499 13.721 292 H ILE 38 H ILE 38 -7.970 1.280 8.534 293 HA ILE 38 HA ILE 38 -9.362 -0.866 7.075 294 HB ILE 38 HB ILE 38 -9.868 1.637 5.793 295 HG12 ILE 38 HG13 ILE 38 -11.182 1.668 8.473 296 HG13 ILE 38 HG12 ILE 38 -9.549 2.309 8.348 297 HG21 ILE 38 HG21 ILE 38 -11.218 -0.324 5.486 298 HG22 ILE 38 HG22 ILE 38 -12.223 0.960 6.161 299 HG23 ILE 38 HG23 ILE 38 -11.647 -0.346 7.196 300 HD11 ILE 38 HD11 ILE 38 -10.820 4.187 8.024 301 HD12 ILE 38 HD12 ILE 38 -12.071 3.317 7.137 302 HD13 ILE 38 HD13 ILE 38 -10.526 3.670 6.365 303 H MET 39 H MET 39 -8.312 -1.616 5.368 304 HA MET 39 HA MET 39 -6.145 0.025 4.231 305 HB2 MET 39 HB3 MET 39 -5.226 -1.945 5.215 306 HB3 MET 39 HB2 MET 39 -6.451 -2.966 4.476 307 HG2 MET 39 HG3 MET 39 -4.678 -1.406 2.683 308 HG3 MET 39 HG2 MET 39 -3.993 -2.794 3.526 309 HE1 MET 39 HE1 MET 39 -5.645 -5.770 2.462 310 HE2 MET 39 HE2 MET 39 -7.088 -4.955 3.066 311 HE3 MET 39 HE3 MET 39 -5.551 -4.769 3.910 312 H VAL 40 H VAL 40 -6.227 0.584 2.147 313 HA VAL 40 HA VAL 40 -8.517 -0.260 0.561 314 HB VAL 40 HB VAL 40 -6.373 1.723 -0.201 315 HG11 VAL 40 HG11 VAL 40 -7.453 1.431 -2.164 316 HG12 VAL 40 HG12 VAL 40 -8.609 2.547 -1.437 317 HG13 VAL 40 HG13 VAL 40 -8.913 0.811 -1.394 318 HG21 VAL 40 HG21 VAL 40 -9.050 2.396 0.994 319 HG22 VAL 40 HG22 VAL 40 -7.683 3.471 0.698 320 HG23 VAL 40 HG23 VAL 40 -7.584 2.245 1.962 321 H VAL 41 H VAL 41 -8.422 -1.797 -0.942 322 HA VAL 41 HA VAL 41 -5.785 -2.495 -2.053 323 HB VAL 41 HB VAL 41 -7.150 -4.130 -0.399 324 HG11 VAL 41 HG11 VAL 41 -7.870 -5.302 -3.054 325 HG12 VAL 41 HG12 VAL 41 -8.974 -4.201 -2.232 326 HG13 VAL 41 HG13 VAL 41 -8.483 -5.702 -1.449 327 HG21 VAL 41 HG21 VAL 41 -5.912 -5.903 -2.158 328 HG22 VAL 41 HG22 VAL 41 -5.201 -5.130 -0.742 329 HG23 VAL 41 HG23 VAL 41 -5.031 -4.385 -2.331 330 H GLY 42 H GLY 42 -5.655 -2.925 -4.237 331 HA2 GLY 42 HA3 GLY 42 -7.715 -1.792 -5.873 332 HA3 GLY 42 HA2 GLY 42 -6.221 -2.521 -6.440 333 H ARG 43 H ARG 43 -8.479 -2.925 -7.879 334 HA ARG 43 HA ARG 43 -10.104 -5.073 -7.236 335 HB2 ARG 43 HB3 ARG 43 -10.491 -3.617 -9.173 336 HB3 ARG 43 HB2 ARG 43 -9.079 -4.297 -9.971 337 HG2 ARG 43 HG3 ARG 43 -10.389 -6.559 -9.557 338 HG3 ARG 43 HG2 ARG 43 -11.772 -5.465 -9.551 339 HD2 ARG 43 HD3 ARG 43 -9.733 -5.807 -11.745 340 HD3 ARG 43 HD2 ARG 43 -11.426 -6.297 -11.784 341 HE ARG 43 HE ARG 43 -10.996 -3.479 -11.334 342 HH11 ARG 43 HH11 ARG 43 -11.460 -5.986 -13.719 343 HH12 ARG 43 HH12 ARG 43 -12.049 -4.897 -14.930 344 HH21 ARG 43 HH21 ARG 43 -11.767 -2.049 -12.927 345 HH22 ARG 43 HH22 ARG 43 -12.223 -2.663 -14.481 346 H ARG 44 H ARG 44 -7.232 -5.215 -9.348 347 HA ARG 44 HA ARG 44 -7.101 -8.013 -9.453 348 HB2 ARG 44 HB3 ARG 44 -5.280 -5.766 -10.096 349 HB3 ARG 44 HB2 ARG 44 -4.521 -7.333 -9.849 350 HG2 ARG 44 HG3 ARG 44 -5.050 -6.869 -12.210 351 HG3 ARG 44 HG2 ARG 44 -5.851 -8.314 -11.592 352 HD2 ARG 44 HD3 ARG 44 -7.343 -5.769 -11.374 353 HD3 ARG 44 HD2 ARG 44 -7.118 -6.416 -12.999 354 HE ARG 44 HE ARG 44 -8.798 -7.480 -10.923 355 HH11 ARG 44 HH11 ARG 44 -7.034 -8.226 -13.840 356 HH12 ARG 44 HH12 ARG 44 -8.009 -9.604 -14.226 357 HH21 ARG 44 HH21 ARG 44 -10.080 -9.293 -11.429 358 HH22 ARG 44 HH22 ARG 44 -9.738 -10.209 -12.858 359 H THR 45 H THR 45 -6.241 -5.806 -6.973 360 HA THR 45 HA THR 45 -4.292 -7.440 -5.677 361 HB THR 45 HB THR 45 -5.786 -5.465 -4.068 362 HG1 THR 45 HG1 THR 45 -4.427 -4.791 -6.444 363 HG21 THR 45 HG21 THR 45 -2.950 -6.232 -4.508 364 HG22 THR 45 HG22 THR 45 -3.850 -6.041 -3.003 365 HG23 THR 45 HG23 THR 45 -3.318 -4.618 -3.900 366 H TYR 46 H TYR 46 -7.698 -6.649 -4.875 367 HA TYR 46 HA TYR 46 -7.951 -8.242 -2.643 368 HB2 TYR 46 HB3 TYR 46 -10.315 -8.156 -2.923 369 HB3 TYR 46 HB2 TYR 46 -9.683 -6.642 -3.553 370 HD1 TYR 46 HD2 TYR 46 -10.536 -10.071 -4.804 371 HD2 TYR 46 HD1 TYR 46 -10.593 -5.878 -5.536 372 HE1 TYR 46 HE2 TYR 46 -11.712 -10.460 -6.914 373 HE2 TYR 46 HE1 TYR 46 -11.783 -6.263 -7.648 374 HH TYR 46 HH TYR 46 -13.024 -9.395 -8.524 375 H GLU 47 H GLU 47 -8.232 -9.195 -6.035 376 HA GLU 47 HA GLU 47 -8.870 -11.928 -5.361 377 HB2 GLU 47 HB3 GLU 47 -8.986 -10.283 -7.692 378 HB3 GLU 47 HB2 GLU 47 -8.025 -11.706 -8.069 379 HG2 GLU 47 HG3 GLU 47 -10.595 -12.090 -6.643 380 HG3 GLU 47 HG2 GLU 47 -10.641 -11.672 -8.355 381 H SER 48 H SER 48 -6.043 -10.057 -5.879 382 HA SER 48 HA SER 48 -4.412 -12.505 -6.070 383 HB2 SER 48 HB3 SER 48 -3.563 -9.686 -6.764 384 HB3 SER 48 HB2 SER 48 -2.663 -11.172 -7.070 385 HG SER 48 HG SER 48 -5.215 -10.592 -8.167 386 H PHE 49 H PHE 49 -5.542 -11.330 -3.603 387 HA PHE 49 HA PHE 49 -3.133 -10.387 -2.238 388 HB2 PHE 49 HB3 PHE 49 -5.734 -9.560 -2.038 389 HB3 PHE 49 HB2 PHE 49 -5.598 -10.643 -0.656 390 HD1 PHE 49 HD1 PHE 49 -3.395 -8.081 -2.264 391 HD2 PHE 49 HD2 PHE 49 -5.186 -9.552 1.306 392 HE1 PHE 49 HE1 PHE 49 -2.287 -6.301 -0.978 393 HE2 PHE 49 HE2 PHE 49 -4.081 -7.774 2.597 394 HZ PHE 49 HZ PHE 49 -2.630 -6.145 1.455 395 HA PRO 50 HA PRO 50 -2.225 -14.481 -0.743 396 HB2 PRO 50 HB3 PRO 50 -0.995 -12.987 1.514 397 HB3 PRO 50 HB2 PRO 50 -0.294 -14.224 0.465 398 HG2 PRO 50 HG3 PRO 50 0.358 -11.661 0.164 399 HG3 PRO 50 HG2 PRO 50 0.141 -12.718 -1.244 400 HD2 PRO 50 HD3 PRO 50 -1.693 -10.635 -0.134 401 HD3 PRO 50 HD2 PRO 50 -1.355 -11.059 -1.825 402 H LYS 51 H LYS 51 -3.852 -12.035 1.141 403 HA LYS 51 HA LYS 51 -5.291 -14.133 2.563 404 HB2 LYS 51 HB3 LYS 51 -3.218 -13.120 3.873 405 HB3 LYS 51 HB2 LYS 51 -4.365 -11.833 4.218 406 HG2 LYS 51 HG3 LYS 51 -4.638 -13.228 6.027 407 HG3 LYS 51 HG2 LYS 51 -5.928 -13.768 4.950 408 HD2 LYS 51 HD3 LYS 51 -4.920 -15.762 4.521 409 HD3 LYS 51 HD2 LYS 51 -3.294 -15.092 4.664 410 HE2 LYS 51 HE3 LYS 51 -3.177 -15.506 6.879 411 HE3 LYS 51 HE2 LYS 51 -4.876 -15.118 7.146 412 HZ1 LYS 51 HZ1 LYS 51 -3.918 -17.577 7.299 413 HZ2 LYS 51 HZ2 LYS 51 -4.320 -17.556 5.656 414 HZ3 LYS 51 HZ3 LYS 51 -5.507 -17.246 6.820 415 H ARG 52 H ARG 52 -7.118 -13.562 1.396 416 HA ARG 52 HA ARG 52 -8.239 -10.917 2.044 417 HB2 ARG 52 HB3 ARG 52 -9.553 -11.193 -0.108 418 HB3 ARG 52 HB2 ARG 52 -7.829 -10.896 -0.286 419 HG2 ARG 52 HG3 ARG 52 -7.515 -12.815 -1.359 420 HG3 ARG 52 HG2 ARG 52 -8.422 -13.726 -0.150 421 HD2 ARG 52 HD3 ARG 52 -10.493 -13.235 -1.220 422 HD3 ARG 52 HD2 ARG 52 -9.729 -12.065 -2.294 423 HE ARG 52 HE ARG 52 -9.037 -13.789 -3.643 424 HH11 ARG 52 HH11 ARG 52 -10.184 -15.090 -0.613 425 HH12 ARG 52 HH12 ARG 52 -10.156 -16.731 -1.164 426 HH21 ARG 52 HH21 ARG 52 -9.000 -15.947 -4.368 427 HH22 ARG 52 HH22 ARG 52 -9.483 -17.218 -3.295 428 HA PRO 53 HA PRO 53 -9.474 -10.034 3.019 429 HB2 PRO 53 HB3 PRO 53 -11.081 -9.782 5.268 430 HB3 PRO 53 HB2 PRO 53 -11.557 -9.369 3.621 431 HG2 PRO 53 HG3 PRO 53 -12.566 -11.476 5.260 432 HG3 PRO 53 HG2 PRO 53 -13.009 -11.090 3.592 433 HD2 PRO 53 HD3 PRO 53 -11.178 -13.164 4.622 434 HD3 PRO 53 HD2 PRO 53 -12.056 -13.093 3.081 435 H LEU 54 H LEU 54 -8.272 -9.012 4.706 436 HA LEU 54 HA LEU 54 -6.559 -10.762 6.131 437 HB2 LEU 54 HB3 LEU 54 -6.916 -7.787 6.068 438 HB3 LEU 54 HB2 LEU 54 -5.830 -8.529 7.226 439 HG LEU 54 HG LEU 54 -5.597 -8.947 4.250 440 HD11 LEU 54 HD11 LEU 54 -3.641 -7.360 4.491 441 HD12 LEU 54 HD12 LEU 54 -4.345 -6.880 6.035 442 HD13 LEU 54 HD13 LEU 54 -5.248 -6.635 4.540 443 HD21 LEU 54 HD21 LEU 54 -3.387 -9.235 6.229 444 HD22 LEU 54 HD22 LEU 54 -3.623 -10.038 4.677 445 HD23 LEU 54 HD23 LEU 54 -4.579 -10.526 6.076 446 HA PRO 55 HA PRO 55 -8.970 -11.256 9.825 447 HB2 PRO 55 HB3 PRO 55 -6.531 -12.004 11.237 448 HB3 PRO 55 HB2 PRO 55 -7.908 -13.009 10.781 449 HG2 PRO 55 HG3 PRO 55 -5.466 -13.252 9.629 450 HG3 PRO 55 HG2 PRO 55 -6.977 -13.603 8.770 451 HD2 PRO 55 HD3 PRO 55 -5.245 -11.163 8.642 452 HD3 PRO 55 HD2 PRO 55 -6.076 -12.028 7.332 453 H GLU 56 H GLU 56 -9.309 -10.378 11.864 454 HA GLU 56 HA GLU 56 -9.440 -8.636 13.323 455 HB2 GLU 56 HB3 GLU 56 -6.442 -8.989 13.268 456 HB3 GLU 56 HB2 GLU 56 -7.348 -8.156 14.523 457 HG2 GLU 56 HG3 GLU 56 -7.566 -10.070 15.600 458 HG3 GLU 56 HG2 GLU 56 -8.511 -10.701 14.253 459 H ARG 57 H ARG 57 -9.207 -7.850 10.479 460 HA ARG 57 HA ARG 57 -8.622 -5.061 10.983 461 HB2 ARG 57 HB3 ARG 57 -6.951 -4.734 9.401 462 HB3 ARG 57 HB2 ARG 57 -6.486 -6.251 10.152 463 HG2 ARG 57 HG3 ARG 57 -6.173 -6.715 7.929 464 HG3 ARG 57 HG2 ARG 57 -7.804 -7.330 8.190 465 HD2 ARG 57 HD3 ARG 57 -7.242 -5.809 6.121 466 HD3 ARG 57 HD2 ARG 57 -8.778 -5.658 6.967 467 HE ARG 57 HE ARG 57 -8.160 -3.561 7.651 468 HH11 ARG 57 HH11 ARG 57 -5.344 -5.227 6.441 469 HH12 ARG 57 HH12 ARG 57 -4.340 -3.817 6.482 470 HH21 ARG 57 HH21 ARG 57 -6.846 -1.709 7.704 471 HH22 ARG 57 HH22 ARG 57 -5.192 -1.818 7.200 472 H THR 58 H THR 58 -9.366 -3.639 9.254 473 HA THR 58 HA THR 58 -11.694 -4.798 7.901 474 HB THR 58 HB THR 58 -11.028 -1.872 8.253 475 HG1 THR 58 HG1 THR 58 -12.224 -1.908 10.094 476 HG21 THR 58 HG21 THR 58 -13.238 -1.388 7.745 477 HG22 THR 58 HG22 THR 58 -13.758 -3.057 7.974 478 HG23 THR 58 HG23 THR 58 -12.794 -2.619 6.563 479 H ASN 59 H ASN 59 -11.471 -5.310 5.826 480 HA ASN 59 HA ASN 59 -9.328 -4.083 4.275 481 HB2 ASN 59 HB3 ASN 59 -11.138 -6.422 3.653 482 HB3 ASN 59 HB2 ASN 59 -9.836 -5.852 2.612 483 HD21 ASN 59 HD21 ASN 59 -10.509 -7.054 5.858 484 HD22 ASN 59 HD22 ASN 59 -8.986 -7.835 6.080 485 H VAL 60 H VAL 60 -9.664 -3.269 2.158 486 HA VAL 60 HA VAL 60 -12.410 -2.445 1.528 487 HB VAL 60 HB VAL 60 -9.997 -0.632 1.608 488 HG11 VAL 60 HG11 VAL 60 -12.412 -0.482 -0.018 489 HG12 VAL 60 HG12 VAL 60 -10.893 0.405 -0.156 490 HG13 VAL 60 HG13 VAL 60 -12.139 0.958 0.964 491 HG21 VAL 60 HG21 VAL 60 -12.051 -1.197 3.475 492 HG22 VAL 60 HG22 VAL 60 -12.302 0.443 2.875 493 HG23 VAL 60 HG23 VAL 60 -10.755 -0.007 3.593 494 H VAL 61 H VAL 61 -12.930 -2.751 -0.544 495 HA VAL 61 HA VAL 61 -10.777 -3.479 -2.405 496 HB VAL 61 HB VAL 61 -13.714 -4.179 -2.460 497 HG11 VAL 61 HG11 VAL 61 -11.685 -4.239 -4.549 498 HG12 VAL 61 HG12 VAL 61 -13.438 -4.401 -4.664 499 HG13 VAL 61 HG13 VAL 61 -12.447 -5.807 -4.278 500 HG21 VAL 61 HG21 VAL 61 -11.695 -6.300 -2.402 501 HG22 VAL 61 HG22 VAL 61 -13.201 -6.137 -1.498 502 HG23 VAL 61 HG23 VAL 61 -11.748 -5.299 -0.952 503 H LEU 62 H LEU 62 -10.384 -2.277 -4.141 504 HA LEU 62 HA LEU 62 -12.355 -0.217 -4.872 505 HB2 LEU 62 HB3 LEU 62 -10.157 0.569 -3.858 506 HB3 LEU 62 HB2 LEU 62 -9.383 -0.016 -5.319 507 HG LEU 62 HG LEU 62 -10.914 1.533 -6.614 508 HD11 LEU 62 HD11 LEU 62 -12.645 2.217 -5.318 509 HD12 LEU 62 HD12 LEU 62 -11.524 3.533 -4.969 510 HD13 LEU 62 HD13 LEU 62 -11.691 2.192 -3.835 511 HD21 LEU 62 HD21 LEU 62 -9.581 3.577 -5.946 512 HD22 LEU 62 HD22 LEU 62 -8.648 2.152 -6.401 513 HD23 LEU 62 HD23 LEU 62 -8.843 2.572 -4.699 514 H THR 63 H THR 63 -13.395 -1.205 -6.525 515 HA THR 63 HA THR 63 -11.759 -1.923 -8.861 516 HB THR 63 HB THR 63 -12.544 -3.982 -7.784 517 HG1 THR 63 HG1 THR 63 -13.670 -4.817 -9.608 518 HG21 THR 63 HG21 THR 63 -15.115 -2.559 -7.736 519 HG22 THR 63 HG22 THR 63 -14.478 -3.806 -6.664 520 HG23 THR 63 HG23 THR 63 -15.183 -4.253 -8.217 521 H HIS 64 H HIS 64 -12.738 -1.549 -10.904 522 HA HIS 64 HA HIS 64 -14.369 0.771 -10.991 523 HB2 HIS 64 HB3 HIS 64 -13.490 -1.138 -13.159 524 HB3 HIS 64 HB2 HIS 64 -14.384 0.346 -13.471 525 HD1 HIS 64 HD1 HIS 64 -13.014 2.386 -13.824 526 HD2 HIS 64 HD2 HIS 64 -10.887 -0.603 -11.873 527 HE1 HIS 64 HE1 HIS 64 -10.660 3.250 -13.635 528 HE2 HIS 64 HE2 HIS 64 -9.373 1.389 -12.529 529 H GLN 65 H GLN 65 -15.019 -2.653 -11.378 530 HA GLN 65 HA GLN 65 -17.474 -2.683 -12.574 531 HB2 GLN 65 HB3 GLN 65 -16.178 -4.395 -10.514 532 HB3 GLN 65 HB2 GLN 65 -17.897 -4.628 -10.800 533 HG2 GLN 65 HG3 GLN 65 -17.520 -5.736 -12.680 534 HG3 GLN 65 HG2 GLN 65 -16.437 -4.483 -13.283 535 HE21 GLN 65 HE21 GLN 65 -14.268 -4.482 -12.000 536 HE22 GLN 65 HE22 GLN 65 -13.517 -6.031 -11.853 537 H GLU 66 H GLU 66 -19.476 -2.045 -12.103 538 HA GLU 66 HA GLU 66 -19.925 -0.547 -9.674 539 HB2 GLU 66 HB3 GLU 66 -21.867 -1.160 -11.907 540 HB3 GLU 66 HB2 GLU 66 -22.049 0.072 -10.665 541 HG2 GLU 66 HG3 GLU 66 -19.574 0.369 -12.143 542 HG3 GLU 66 HG2 GLU 66 -20.991 0.416 -13.191 543 H ASP 67 H ASP 67 -20.968 -3.576 -11.108 544 HA ASP 67 HA ASP 67 -22.728 -4.137 -8.842 545 HB2 ASP 67 HB3 ASP 67 -22.384 -5.232 -11.581 546 HB3 ASP 67 HB2 ASP 67 -22.948 -6.346 -10.339 547 H TYR 68 H TYR 68 -19.653 -4.142 -8.775 548 HA TYR 68 HA TYR 68 -18.970 -6.891 -8.309 549 HB2 TYR 68 HB3 TYR 68 -17.254 -5.321 -9.039 550 HB3 TYR 68 HB2 TYR 68 -17.502 -4.343 -7.597 551 HD1 TYR 68 HD1 TYR 68 -16.415 -7.714 -8.726 552 HD2 TYR 68 HD2 TYR 68 -16.294 -4.788 -5.640 553 HE1 TYR 68 HE1 TYR 68 -14.716 -9.040 -7.543 554 HE2 TYR 68 HE2 TYR 68 -14.593 -6.105 -4.451 555 HH TYR 68 HH TYR 68 -12.955 -7.802 -4.863 556 H GLN 69 H GLN 69 -19.074 -8.027 -6.460 557 HA GLN 69 HA GLN 69 -19.811 -6.573 -4.008 558 HB2 GLN 69 HB3 GLN 69 -20.775 -9.104 -3.587 559 HB3 GLN 69 HB2 GLN 69 -21.735 -7.729 -4.105 560 HG2 GLN 69 HG3 GLN 69 -21.012 -8.521 -6.497 561 HG3 GLN 69 HG2 GLN 69 -20.748 -10.057 -5.673 562 HE21 GLN 69 HE21 GLN 69 -23.148 -7.498 -6.093 563 HE22 GLN 69 HE22 GLN 69 -24.529 -8.535 -6.048 564 H ALA 70 H ALA 70 -18.158 -6.588 -2.660 565 HA ALA 70 HA ALA 70 -16.443 -8.975 -2.523 566 HB1 ALA 70 HB1 ALA 70 -14.661 -7.641 -2.339 567 HB2 ALA 70 HB2 ALA 70 -15.450 -6.606 -1.148 568 HB3 ALA 70 HB3 ALA 70 -15.728 -6.342 -2.869 569 H GLN 71 H GLN 71 -17.371 -10.256 -1.022 570 HA GLN 71 HA GLN 71 -18.628 -9.292 1.337 571 HB2 GLN 71 HB3 GLN 71 -17.758 -12.023 0.417 572 HB3 GLN 71 HB2 GLN 71 -18.458 -11.765 2.010 573 HG2 GLN 71 HG3 GLN 71 -20.335 -12.309 0.866 574 HG3 GLN 71 HG2 GLN 71 -20.339 -10.566 0.600 575 HE21 GLN 71 HE21 GLN 71 -20.121 -9.785 -1.426 576 HE22 GLN 71 HE22 GLN 71 -19.971 -10.770 -2.837 577 H GLY 72 H GLY 72 -17.757 -8.719 3.210 578 HA2 GLY 72 HA3 GLY 72 -16.286 -9.133 5.055 579 HA3 GLY 72 HA2 GLY 72 -15.116 -9.794 3.925 580 H ALA 73 H ALA 73 -15.530 -7.495 2.040 581 HA ALA 73 HA ALA 73 -14.147 -5.429 3.628 582 HB1 ALA 73 HB1 ALA 73 -12.357 -5.624 2.335 583 HB2 ALA 73 HB2 ALA 73 -13.331 -5.287 0.904 584 HB3 ALA 73 HB3 ALA 73 -13.132 -6.947 1.466 585 H VAL 74 H VAL 74 -14.132 -3.270 2.482 586 HA VAL 74 HA VAL 74 -16.855 -2.604 1.768 587 HB VAL 74 HB VAL 74 -14.498 -0.722 1.815 588 HG11 VAL 74 HG11 VAL 74 -16.485 0.804 2.572 589 HG12 VAL 74 HG12 VAL 74 -17.465 -0.426 1.773 590 HG13 VAL 74 HG13 VAL 74 -16.232 0.448 0.863 591 HG21 VAL 74 HG21 VAL 74 -14.384 -0.812 4.035 592 HG22 VAL 74 HG22 VAL 74 -15.455 -2.213 3.987 593 HG23 VAL 74 HG23 VAL 74 -16.127 -0.595 4.183 594 H VAL 75 H VAL 75 -17.592 -1.892 -0.192 595 HA VAL 75 HA VAL 75 -15.718 -2.208 -2.441 596 HB VAL 75 HB VAL 75 -18.724 -2.468 -2.504 597 HG11 VAL 75 HG11 VAL 75 -18.277 -3.514 -4.721 598 HG12 VAL 75 HG12 VAL 75 -16.595 -3.005 -4.571 599 HG13 VAL 75 HG13 VAL 75 -17.878 -1.798 -4.646 600 HG21 VAL 75 HG21 VAL 75 -16.955 -4.802 -2.932 601 HG22 VAL 75 HG22 VAL 75 -18.551 -4.708 -2.186 602 HG23 VAL 75 HG23 VAL 75 -17.121 -4.219 -1.275 603 H VAL 76 H VAL 76 -15.356 -0.617 -3.809 604 HA VAL 76 HA VAL 76 -17.208 1.540 -4.241 605 HB VAL 76 HB VAL 76 -15.763 3.362 -3.595 606 HG11 VAL 76 HG11 VAL 76 -15.888 3.190 -1.203 607 HG12 VAL 76 HG12 VAL 76 -15.943 1.430 -1.290 608 HG13 VAL 76 HG13 VAL 76 -17.292 2.385 -1.904 609 HG21 VAL 76 HG21 VAL 76 -13.568 3.131 -3.399 610 HG22 VAL 76 HG22 VAL 76 -13.730 1.391 -3.636 611 HG23 VAL 76 HG23 VAL 76 -13.785 2.068 -2.008 612 H HIS 77 H HIS 77 -16.462 2.969 -6.014 613 HA HIS 77 HA HIS 77 -14.368 1.685 -7.642 614 HB2 HIS 77 HB3 HIS 77 -16.601 2.963 -9.101 615 HB3 HIS 77 HB2 HIS 77 -15.700 1.497 -9.473 616 HD1 HIS 77 HD1 HIS 77 -16.309 -0.388 -7.306 617 HD2 HIS 77 HD2 HIS 77 -19.177 2.265 -8.722 618 HE1 HIS 77 HE1 HIS 77 -18.524 -1.388 -6.663 619 HE2 HIS 77 HE2 HIS 77 -20.247 0.194 -7.600 620 H ASP 78 H ASP 78 -15.487 4.573 -6.268 621 HA ASP 78 HA ASP 78 -13.762 6.122 -8.089 622 HB2 ASP 78 HB3 ASP 78 -16.385 6.822 -6.811 623 HB3 ASP 78 HB2 ASP 78 -15.243 8.093 -7.238 624 H VAL 79 H VAL 79 -12.438 7.725 -7.195 625 HA VAL 79 HA VAL 79 -11.326 7.135 -4.686 626 HB VAL 79 HB VAL 79 -10.226 9.444 -5.025 627 HG11 VAL 79 HG11 VAL 79 -8.725 8.498 -6.794 628 HG12 VAL 79 HG12 VAL 79 -9.844 7.140 -6.913 629 HG13 VAL 79 HG13 VAL 79 -8.992 7.451 -5.401 630 HG21 VAL 79 HG21 VAL 79 -11.177 9.097 -7.844 631 HG22 VAL 79 HG22 VAL 79 -10.364 10.483 -7.116 632 HG23 VAL 79 HG23 VAL 79 -12.036 10.119 -6.691 633 H ALA 80 H ALA 80 -13.648 9.539 -5.761 634 HA ALA 80 HA ALA 80 -13.723 10.995 -3.313 635 HB1 ALA 80 HB1 ALA 80 -15.182 12.363 -4.364 636 HB2 ALA 80 HB2 ALA 80 -16.126 11.026 -5.023 637 HB3 ALA 80 HB3 ALA 80 -14.620 11.512 -5.803 638 H ALA 81 H ALA 81 -15.635 8.373 -4.703 639 HA ALA 81 HA ALA 81 -17.686 8.213 -2.849 640 HB1 ALA 81 HB1 ALA 81 -17.264 6.858 -5.016 641 HB2 ALA 81 HB2 ALA 81 -18.134 6.096 -3.685 642 HB3 ALA 81 HB3 ALA 81 -16.429 5.728 -3.949 643 H VAL 82 H VAL 82 -14.729 6.201 -2.822 644 HA VAL 82 HA VAL 82 -15.047 5.051 -0.349 645 HB VAL 82 HB VAL 82 -13.238 4.658 -2.164 646 HG11 VAL 82 HG11 VAL 82 -11.453 6.261 -0.408 647 HG12 VAL 82 HG12 VAL 82 -12.370 7.087 -1.666 648 HG13 VAL 82 HG13 VAL 82 -11.255 5.792 -2.096 649 HG21 VAL 82 HG21 VAL 82 -11.936 3.401 -0.656 650 HG22 VAL 82 HG22 VAL 82 -13.558 3.448 0.037 651 HG23 VAL 82 HG23 VAL 82 -12.292 4.494 0.682 652 H PHE 83 H PHE 83 -13.830 8.266 -1.117 653 HA PHE 83 HA PHE 83 -12.703 8.891 1.364 654 HB2 PHE 83 HB3 PHE 83 -13.591 10.372 -1.001 655 HB3 PHE 83 HB2 PHE 83 -13.752 11.294 0.490 656 HD1 PHE 83 HD2 PHE 83 -11.532 10.727 2.093 657 HD2 PHE 83 HD1 PHE 83 -11.698 10.921 -2.155 658 HE1 PHE 83 HE2 PHE 83 -9.130 11.254 2.027 659 HE2 PHE 83 HE1 PHE 83 -9.295 11.447 -2.229 660 HZ PHE 83 HZ PHE 83 -8.008 11.615 -0.136 661 H ALA 84 H ALA 84 -16.045 9.178 0.225 662 HA ALA 84 HA ALA 84 -17.095 10.506 2.457 663 HB1 ALA 84 HB1 ALA 84 -18.251 10.026 0.239 664 HB2 ALA 84 HB2 ALA 84 -19.234 9.861 1.694 665 HB3 ALA 84 HB3 ALA 84 -18.601 8.425 0.889 666 H TYR 85 H TYR 85 -16.640 7.081 1.778 667 HA TYR 85 HA TYR 85 -17.825 6.057 4.098 668 HB2 TYR 85 HB3 TYR 85 -17.225 4.106 3.169 669 HB3 TYR 85 HB2 TYR 85 -16.359 5.001 1.931 670 HD1 TYR 85 HD1 TYR 85 -15.852 3.776 5.434 671 HD2 TYR 85 HD2 TYR 85 -14.139 4.514 1.616 672 HE1 TYR 85 HE1 TYR 85 -13.734 2.786 6.199 673 HE2 TYR 85 HE2 TYR 85 -12.015 3.527 2.368 674 HH TYR 85 HH TYR 85 -11.387 1.744 4.264 675 H ALA 86 H ALA 86 -14.331 6.620 3.513 676 HA ALA 86 HA ALA 86 -13.320 6.197 5.982 677 HB1 ALA 86 HB1 ALA 86 -12.471 8.603 4.400 678 HB2 ALA 86 HB2 ALA 86 -12.112 6.957 3.878 679 HB3 ALA 86 HB3 ALA 86 -11.486 7.551 5.416 680 H LYS 87 H LYS 87 -15.301 8.923 5.037 681 HA LYS 87 HA LYS 87 -14.742 10.509 7.347 682 HB2 LYS 87 HB3 LYS 87 -16.035 10.956 4.974 683 HB3 LYS 87 HB2 LYS 87 -17.386 10.843 6.094 684 HG2 LYS 87 HG3 LYS 87 -16.750 13.137 5.899 685 HG3 LYS 87 HG2 LYS 87 -16.284 12.569 7.505 686 HD2 LYS 87 HD3 LYS 87 -14.026 12.028 6.141 687 HD3 LYS 87 HD2 LYS 87 -14.607 13.423 5.229 688 HE2 LYS 87 HE3 LYS 87 -14.563 13.542 8.210 689 HE3 LYS 87 HE2 LYS 87 -13.053 13.735 7.321 690 HZ1 LYS 87 HZ1 LYS 87 -14.527 15.788 7.889 691 HZ2 LYS 87 HZ2 LYS 87 -15.386 15.320 6.509 692 HZ3 LYS 87 HZ3 LYS 87 -13.740 15.693 6.394 693 H GLN 88 H GLN 88 -17.306 8.273 6.426 694 HA GLN 88 HA GLN 88 -18.892 8.489 8.720 695 HB2 GLN 88 HB3 GLN 88 -19.067 7.106 6.377 696 HB3 GLN 88 HB2 GLN 88 -18.750 5.804 7.515 697 HG2 GLN 88 HG3 GLN 88 -20.751 6.026 8.546 698 HG3 GLN 88 HG2 GLN 88 -20.824 7.767 8.276 699 HE21 GLN 88 HE21 GLN 88 -21.968 8.529 6.605 700 HE22 GLN 88 HE22 GLN 88 -22.757 7.551 5.419 701 H HIS 89 H HIS 89 -15.831 6.992 8.267 702 HA HIS 89 HA HIS 89 -16.106 5.530 10.803 703 HB2 HIS 89 HB3 HIS 89 -14.547 5.066 8.323 704 HB3 HIS 89 HB2 HIS 89 -13.755 4.638 9.837 705 HD1 HIS 89 HD1 HIS 89 -16.177 3.494 11.365 706 HD2 HIS 89 HD2 HIS 89 -15.271 2.606 7.409 707 HE1 HIS 89 HE1 HIS 89 -17.281 1.282 10.903 708 HE2 HIS 89 HE2 HIS 89 -16.796 0.810 8.477 709 HA PRO 90 HA PRO 90 -13.402 9.153 11.820 710 HB2 PRO 90 HB3 PRO 90 -14.595 9.802 14.144 711 HB3 PRO 90 HB2 PRO 90 -15.230 10.337 12.583 712 HG2 PRO 90 HG3 PRO 90 -16.118 8.054 14.308 713 HG3 PRO 90 HG2 PRO 90 -17.102 9.252 13.446 714 HD2 PRO 90 HD3 PRO 90 -16.645 6.741 12.497 715 HD3 PRO 90 HD2 PRO 90 -16.924 8.141 11.443 716 H ASP 91 H ASP 91 -13.975 6.088 13.064 717 HA ASP 91 HA ASP 91 -11.994 6.424 15.210 718 HB2 ASP 91 HB3 ASP 91 -14.301 4.594 14.810 719 HB3 ASP 91 HB2 ASP 91 -12.900 3.950 15.660 720 H GLN 92 H GLN 92 -11.928 5.737 12.076 721 HA GLN 92 HA GLN 92 -9.767 3.768 12.395 722 HB2 GLN 92 HB3 GLN 92 -12.224 3.467 10.934 723 HB3 GLN 92 HB2 GLN 92 -10.869 3.430 9.816 724 HG2 GLN 92 HG3 GLN 92 -10.377 1.359 10.403 725 HG3 GLN 92 HG2 GLN 92 -10.257 1.825 12.099 726 HE21 GLN 92 HE21 GLN 92 -12.275 0.473 9.629 727 HE22 GLN 92 HE22 GLN 92 -13.531 -0.092 10.672 728 H GLU 93 H GLU 93 -8.425 3.682 10.274 729 HA GLU 93 HA GLU 93 -8.077 6.420 9.241 730 HB2 GLU 93 HB3 GLU 93 -5.940 4.469 10.108 731 HB3 GLU 93 HB2 GLU 93 -5.611 5.931 9.189 732 HG2 GLU 93 HG3 GLU 93 -5.802 7.251 10.982 733 HG3 GLU 93 HG2 GLU 93 -7.193 6.368 11.609 734 H LEU 94 H LEU 94 -7.002 6.551 7.148 735 HA LEU 94 HA LEU 94 -7.725 4.262 5.463 736 HB2 LEU 94 HB3 LEU 94 -8.283 6.936 5.201 737 HB3 LEU 94 HB2 LEU 94 -6.908 6.742 4.131 738 HG LEU 94 HG LEU 94 -8.117 4.937 2.942 739 HD11 LEU 94 HD11 LEU 94 -10.606 4.830 3.368 740 HD12 LEU 94 HD12 LEU 94 -10.288 5.660 4.891 741 HD13 LEU 94 HD13 LEU 94 -9.576 4.076 4.585 742 HD21 LEU 94 HD21 LEU 94 -9.098 7.732 3.111 743 HD22 LEU 94 HD22 LEU 94 -10.052 6.581 2.176 744 HD23 LEU 94 HD23 LEU 94 -8.362 6.869 1.762 745 H VAL 95 H VAL 95 -6.214 3.032 4.555 746 HA VAL 95 HA VAL 95 -3.530 4.135 4.129 747 HB VAL 95 HB VAL 95 -3.967 1.392 5.309 748 HG11 VAL 95 HG11 VAL 95 -1.909 1.843 3.931 749 HG12 VAL 95 HG12 VAL 95 -1.609 1.322 5.589 750 HG13 VAL 95 HG13 VAL 95 -1.440 3.023 5.155 751 HG21 VAL 95 HG21 VAL 95 -4.502 2.579 7.166 752 HG22 VAL 95 HG22 VAL 95 -3.683 4.037 6.605 753 HG23 VAL 95 HG23 VAL 95 -2.748 2.709 7.292 754 H ILE 96 H ILE 96 -2.406 3.272 2.394 755 HA ILE 96 HA ILE 96 -3.997 1.547 0.615 756 HB ILE 96 HB ILE 96 -1.718 3.312 -0.256 757 HG12 ILE 96 HG13 ILE 96 -3.445 4.712 0.814 758 HG13 ILE 96 HG12 ILE 96 -3.373 4.986 -0.924 759 HG21 ILE 96 HG21 ILE 96 -2.468 1.437 -1.718 760 HG22 ILE 96 HG22 ILE 96 -2.626 3.034 -2.451 761 HG23 ILE 96 HG23 ILE 96 -4.050 2.212 -1.812 762 HD11 ILE 96 HD11 ILE 96 -5.662 4.918 -0.201 763 HD12 ILE 96 HD12 ILE 96 -5.414 3.342 0.551 764 HD13 ILE 96 HD13 ILE 96 -5.322 3.507 -1.203 765 H ALA 97 H ALA 97 -3.204 -0.375 -0.009 766 HA ALA 97 HA ALA 97 -0.419 -1.001 0.729 767 HB1 ALA 97 HB1 ALA 97 -2.799 -2.853 0.691 768 HB2 ALA 97 HB2 ALA 97 -2.005 -2.201 2.125 769 HB3 ALA 97 HB3 ALA 97 -1.141 -3.320 1.070 770 H GLY 98 H GLY 98 -2.906 -1.260 -1.724 771 HA2 GLY 98 HA3 GLY 98 -1.214 -1.330 -3.894 772 HA3 GLY 98 HA2 GLY 98 -1.443 -3.013 -3.446 773 H GLY 99 H GLY 99 -3.969 -2.320 -6.007 774 HA2 GLY 99 HA3 GLY 99 -1.176 -2.894 -5.557 775 HA3 GLY 99 HA2 GLY 99 -2.022 -2.937 -7.094 776 H ALA 100 H ALA 100 -0.164 -1.906 -8.009 777 HA ALA 100 HA ALA 100 0.875 0.556 -7.214 778 HB1 ALA 100 HB1 ALA 100 2.203 0.342 -9.004 779 HB2 ALA 100 HB2 ALA 100 0.845 0.125 -10.109 780 HB3 ALA 100 HB3 ALA 100 1.452 -1.244 -9.177 781 H GLN 101 H GLN 101 -1.837 -0.200 -9.358 782 HA GLN 101 HA GLN 101 -2.302 2.387 -10.325 783 HB2 GLN 101 HB3 GLN 101 -3.501 -0.127 -10.585 784 HB3 GLN 101 HB2 GLN 101 -4.766 0.912 -9.945 785 HG2 GLN 101 HG3 GLN 101 -3.124 1.825 -12.261 786 HG3 GLN 101 HG2 GLN 101 -4.436 0.673 -12.508 787 HE21 GLN 101 HE21 GLN 101 -3.818 3.731 -10.813 788 HE22 GLN 101 HE22 GLN 101 -5.326 4.464 -11.229 789 H ILE 102 H ILE 102 -3.458 0.752 -7.413 790 HA ILE 102 HA ILE 102 -5.289 2.692 -6.564 791 HB ILE 102 HB ILE 102 -3.591 0.906 -4.814 792 HG12 ILE 102 HG13 ILE 102 -4.866 -0.331 -6.547 793 HG13 ILE 102 HG12 ILE 102 -5.429 -0.681 -4.916 794 HG21 ILE 102 HG21 ILE 102 -4.722 2.779 -3.648 795 HG22 ILE 102 HG22 ILE 102 -5.298 1.191 -3.141 796 HG23 ILE 102 HG23 ILE 102 -6.267 2.170 -4.242 797 HD11 ILE 102 HD11 ILE 102 -7.095 -0.193 -6.897 798 HD12 ILE 102 HD12 ILE 102 -6.795 1.477 -6.416 799 HD13 ILE 102 HD13 ILE 102 -7.436 0.325 -5.246 800 H PHE 103 H PHE 103 -1.805 2.424 -6.125 801 HA PHE 103 HA PHE 103 -1.549 4.577 -4.295 802 HB2 PHE 103 HB3 PHE 103 0.447 3.321 -6.189 803 HB3 PHE 103 HB2 PHE 103 0.865 4.528 -4.978 804 HD1 PHE 103 HD2 PHE 103 -0.716 3.672 -2.675 805 HD2 PHE 103 HD1 PHE 103 1.473 1.368 -5.505 806 HE1 PHE 103 HE2 PHE 103 -0.432 1.892 -1.000 807 HE2 PHE 103 HE1 PHE 103 1.760 -0.416 -3.836 808 HZ PHE 103 HZ PHE 103 0.808 -0.155 -1.580 809 H THR 104 H THR 104 -1.500 4.325 -7.802 810 HA THR 104 HA THR 104 -0.554 6.872 -8.433 811 HB THR 104 HB THR 104 -2.606 5.259 -9.957 812 HG1 THR 104 HG1 THR 104 -0.915 4.243 -10.897 813 HG21 THR 104 HG21 THR 104 -0.641 6.778 -11.465 814 HG22 THR 104 HG22 THR 104 -1.738 7.787 -10.522 815 HG23 THR 104 HG23 THR 104 -2.384 6.631 -11.688 816 H ALA 105 H ALA 105 -3.950 5.785 -8.224 817 HA ALA 105 HA ALA 105 -5.156 8.243 -8.662 818 HB1 ALA 105 HB1 ALA 105 -7.140 7.320 -7.687 819 HB2 ALA 105 HB2 ALA 105 -6.204 6.104 -6.818 820 HB3 ALA 105 HB3 ALA 105 -6.315 6.040 -8.577 821 H PHE 106 H PHE 106 -4.553 6.751 -5.449 822 HA PHE 106 HA PHE 106 -5.238 9.113 -4.063 823 HB2 PHE 106 HB3 PHE 106 -3.791 6.597 -3.246 824 HB3 PHE 106 HB2 PHE 106 -4.131 7.906 -2.119 825 HD1 PHE 106 HD2 PHE 106 -5.756 5.522 -4.451 826 HD2 PHE 106 HD1 PHE 106 -6.194 8.035 -1.046 827 HE1 PHE 106 HE2 PHE 106 -7.992 4.579 -4.049 828 HE2 PHE 106 HE1 PHE 106 -8.432 7.096 -0.637 829 HZ PHE 106 HZ PHE 106 -9.333 5.366 -2.140 830 H LYS 107 H LYS 107 -2.425 8.266 -5.790 831 HA LYS 107 HA LYS 107 -0.317 9.258 -4.365 832 HB2 LYS 107 HB3 LYS 107 0.837 9.358 -6.338 833 HB3 LYS 107 HB2 LYS 107 -0.537 8.404 -6.870 834 HG2 LYS 107 HG3 LYS 107 -1.593 10.517 -7.681 835 HG3 LYS 107 HG2 LYS 107 -0.084 11.347 -7.299 836 HD2 LYS 107 HD3 LYS 107 1.103 9.785 -8.816 837 HD3 LYS 107 HD2 LYS 107 -0.454 9.081 -9.257 838 HE2 LYS 107 HE3 LYS 107 -1.198 11.183 -10.170 839 HE3 LYS 107 HE2 LYS 107 0.265 11.989 -9.603 840 HZ1 LYS 107 HZ1 LYS 107 0.912 11.582 -11.709 841 HZ2 LYS 107 HZ2 LYS 107 -0.128 10.263 -11.912 842 HZ3 LYS 107 HZ3 LYS 107 1.332 10.068 -11.080 843 H ASP 108 H ASP 108 -2.842 11.078 -5.973 844 HA ASP 108 HA ASP 108 -1.618 13.628 -5.295 845 HB2 ASP 108 HB3 ASP 108 -3.421 12.754 -7.285 846 HB3 ASP 108 HB2 ASP 108 -4.318 13.876 -6.267 847 H ASP 109 H ASP 109 -4.368 11.631 -4.373 848 HA ASP 109 HA ASP 109 -5.300 13.573 -2.430 849 HB2 ASP 109 HB3 ASP 109 -6.305 11.032 -3.567 850 HB3 ASP 109 HB2 ASP 109 -6.804 11.395 -1.918 851 H VAL 110 H VAL 110 -2.704 11.719 -2.303 852 HA VAL 110 HA VAL 110 -3.136 10.411 0.243 853 HB VAL 110 HB VAL 110 -1.720 9.339 -1.447 854 HG11 VAL 110 HG11 VAL 110 -0.739 11.816 -1.962 855 HG12 VAL 110 HG12 VAL 110 0.021 10.311 -2.481 856 HG13 VAL 110 HG13 VAL 110 0.574 11.118 -1.014 857 HG21 VAL 110 HG21 VAL 110 -0.143 10.157 0.992 858 HG22 VAL 110 HG22 VAL 110 0.122 8.722 0.002 859 HG23 VAL 110 HG23 VAL 110 -1.359 8.880 0.946 860 H ASP 111 H ASP 111 -1.837 10.808 2.122 861 HA ASP 111 HA ASP 111 -0.917 13.600 2.335 862 HB2 ASP 111 HB3 ASP 111 -3.087 12.681 3.603 863 HB3 ASP 111 HB2 ASP 111 -1.867 12.181 4.770 864 H THR 112 H THR 112 -0.482 10.281 3.501 865 HA THR 112 HA THR 112 2.231 11.032 4.361 866 HB THR 112 HB THR 112 0.545 8.741 5.383 867 HG1 THR 112 HG1 THR 112 -0.112 10.046 6.886 868 HG21 THR 112 HG21 THR 112 3.271 9.728 6.160 869 HG22 THR 112 HG22 THR 112 2.778 8.098 5.699 870 HG23 THR 112 HG23 THR 112 2.259 8.773 7.243 871 H LEU 113 H LEU 113 3.911 9.412 4.067 872 HA LEU 113 HA LEU 113 3.334 7.413 2.004 873 HB2 LEU 113 HB3 LEU 113 4.564 9.826 1.454 874 HB3 LEU 113 HB2 LEU 113 5.913 8.724 1.641 875 HG LEU 113 HG LEU 113 5.124 7.330 -0.139 876 HD11 LEU 113 HD11 LEU 113 2.591 8.483 0.494 877 HD12 LEU 113 HD12 LEU 113 2.957 7.118 -0.561 878 HD13 LEU 113 HD13 LEU 113 2.936 8.757 -1.213 879 HD21 LEU 113 HD21 LEU 113 4.743 9.327 -1.899 880 HD22 LEU 113 HD22 LEU 113 6.319 8.895 -1.236 881 HD23 LEU 113 HD23 LEU 113 5.405 10.234 -0.539 882 H LEU 114 H LEU 114 3.826 5.560 2.964 883 HA LEU 114 HA LEU 114 6.336 5.377 4.501 884 HB2 LEU 114 HB3 LEU 114 3.669 4.062 4.862 885 HB3 LEU 114 HB2 LEU 114 5.117 3.245 5.418 886 HG LEU 114 HG LEU 114 4.614 6.062 6.285 887 HD11 LEU 114 HD11 LEU 114 3.463 5.038 8.305 888 HD12 LEU 114 HD12 LEU 114 3.226 3.603 7.307 889 HD13 LEU 114 HD13 LEU 114 2.519 5.143 6.819 890 HD21 LEU 114 HD21 LEU 114 5.649 4.926 8.394 891 HD22 LEU 114 HD22 LEU 114 6.677 5.361 7.029 892 HD23 LEU 114 HD23 LEU 114 6.154 3.691 7.241 893 H VAL 115 H VAL 115 7.842 4.523 3.194 894 HA VAL 115 HA VAL 115 7.067 2.175 1.585 895 HB VAL 115 HB VAL 115 8.674 2.857 -0.125 896 HG11 VAL 115 HG11 VAL 115 6.290 3.561 -0.223 897 HG12 VAL 115 HG12 VAL 115 7.388 4.640 -1.085 898 HG13 VAL 115 HG13 VAL 115 6.761 5.100 0.498 899 HG21 VAL 115 HG21 VAL 115 10.337 4.111 0.839 900 HG22 VAL 115 HG22 VAL 115 9.211 5.048 1.822 901 HG23 VAL 115 HG23 VAL 115 9.366 5.383 0.097 902 H THR 116 H THR 116 8.585 0.567 1.255 903 HA THR 116 HA THR 116 10.898 0.597 3.082 904 HB THR 116 HB THR 116 9.015 -1.646 2.345 905 HG1 THR 116 HG1 THR 116 8.587 -1.670 4.477 906 HG21 THR 116 HG21 THR 116 10.459 -3.072 3.832 907 HG22 THR 116 HG22 THR 116 11.718 -1.854 3.629 908 HG23 THR 116 HG23 THR 116 11.101 -2.727 2.226 909 H ARG 117 H ARG 117 12.500 1.155 1.668 910 HA ARG 117 HA ARG 117 12.621 -0.042 -0.964 911 HB2 ARG 117 HB3 ARG 117 13.791 2.250 0.365 912 HB3 ARG 117 HB2 ARG 117 15.010 1.337 -0.513 913 HG2 ARG 117 HG3 ARG 117 13.813 1.572 -2.563 914 HG3 ARG 117 HG2 ARG 117 12.422 2.271 -1.731 915 HD2 ARG 117 HD3 ARG 117 13.775 4.199 -1.083 916 HD3 ARG 117 HD2 ARG 117 15.174 3.496 -1.893 917 HE ARG 117 HE ARG 117 13.060 3.706 -3.729 918 HH11 ARG 117 HH11 ARG 117 15.277 5.734 -1.954 919 HH12 ARG 117 HH12 ARG 117 15.266 6.997 -3.138 920 HH21 ARG 117 HH21 ARG 117 13.044 5.368 -5.287 921 HH22 ARG 117 HH22 ARG 117 13.998 6.790 -5.029 922 H LEU 118 H LEU 118 13.247 -2.099 -1.053 923 HA LEU 118 HA LEU 118 15.009 -3.328 0.797 924 HB2 LEU 118 HB3 LEU 118 13.714 -4.097 -1.768 925 HB3 LEU 118 HB2 LEU 118 15.096 -5.042 -1.247 926 HG LEU 118 HG LEU 118 13.880 -5.399 0.945 927 HD11 LEU 118 HD11 LEU 118 11.311 -4.852 -0.388 928 HD12 LEU 118 HD12 LEU 118 12.230 -3.436 0.122 929 HD13 LEU 118 HD13 LEU 118 11.780 -4.666 1.302 930 HD21 LEU 118 HD21 LEU 118 12.075 -6.875 -0.426 931 HD22 LEU 118 HD22 LEU 118 13.763 -7.331 -0.198 932 HD23 LEU 118 HD23 LEU 118 13.257 -6.540 -1.691 933 H ALA 119 H ALA 119 17.126 -4.157 0.413 934 HA ALA 119 HA ALA 119 18.819 -2.314 -0.996 935 HB1 ALA 119 HB1 ALA 119 20.362 -4.513 -0.222 936 HB2 ALA 119 HB2 ALA 119 19.129 -4.339 1.028 937 HB3 ALA 119 HB3 ALA 119 20.181 -2.980 0.631 938 H GLY 120 H GLY 120 17.687 -5.610 -1.473 939 HA2 GLY 120 HA3 GLY 120 19.425 -6.255 -3.617 940 HA3 GLY 120 HA2 GLY 120 17.918 -7.070 -3.229 941 H SER 121 H SER 121 19.106 -6.275 -5.817 942 HA SER 121 HA SER 121 17.155 -4.317 -6.785 943 HB2 SER 121 HB3 SER 121 19.771 -5.349 -7.791 944 HB3 SER 121 HB2 SER 121 18.597 -4.768 -8.973 945 HG SER 121 HG SER 121 19.891 -3.362 -6.909 946 H PHE 122 H PHE 122 15.313 -5.013 -7.625 947 HA PHE 122 HA PHE 122 15.260 -7.675 -8.889 948 HB2 PHE 122 HB3 PHE 122 13.051 -6.284 -7.361 949 HB3 PHE 122 HB2 PHE 122 12.895 -7.833 -8.182 950 HD1 PHE 122 HD2 PHE 122 14.473 -6.076 -5.364 951 HD2 PHE 122 HD1 PHE 122 13.734 -9.836 -7.214 952 HE1 PHE 122 HE2 PHE 122 15.251 -7.224 -3.331 953 HE2 PHE 122 HE1 PHE 122 14.510 -10.991 -5.185 954 HZ PHE 122 HZ PHE 122 15.270 -9.686 -3.241 955 H GLU 123 H GLU 123 13.522 -7.946 -10.513 956 HA GLU 123 HA GLU 123 12.709 -5.483 -11.858 957 HB2 GLU 123 HB3 GLU 123 13.507 -6.290 -14.034 958 HB3 GLU 123 HB2 GLU 123 14.835 -6.070 -12.904 959 HG2 GLU 123 HG3 GLU 123 14.106 -8.704 -12.539 960 HG3 GLU 123 HG2 GLU 123 13.932 -8.458 -14.276 961 H GLY 124 H GLY 124 10.826 -5.663 -13.046 962 HA2 GLY 124 HA3 GLY 124 9.666 -8.181 -13.736 963 HA3 GLY 124 HA2 GLY 124 8.921 -7.505 -12.296 964 H ASP 125 H ASP 125 6.957 -6.884 -12.990 965 HA ASP 125 HA ASP 125 6.879 -4.847 -15.102 966 HB2 ASP 125 HB3 ASP 125 6.151 -7.216 -15.858 967 HB3 ASP 125 HB2 ASP 125 4.710 -6.918 -14.892 968 H THR 126 H THR 126 6.795 -4.721 -12.165 969 HA THR 126 HA THR 126 4.376 -3.119 -11.948 970 HB THR 126 HB THR 126 5.003 -5.191 -9.844 971 HG1 THR 126 HG1 THR 126 3.292 -6.372 -10.720 972 HG21 THR 126 HG21 THR 126 3.218 -4.487 -8.702 973 HG22 THR 126 HG22 THR 126 2.279 -4.169 -10.160 974 HG23 THR 126 HG23 THR 126 3.459 -2.987 -9.596 975 H LYS 127 H LYS 127 5.323 -1.215 -11.532 976 HA LYS 127 HA LYS 127 7.097 -1.070 -9.192 977 HB2 LYS 127 HB3 LYS 127 8.367 0.739 -10.403 978 HB3 LYS 127 HB2 LYS 127 8.590 -0.887 -11.034 979 HG2 LYS 127 HG3 LYS 127 7.116 -0.441 -12.872 980 HG3 LYS 127 HG2 LYS 127 6.687 1.133 -12.198 981 HD2 LYS 127 HD3 LYS 127 8.717 2.073 -12.754 982 HD3 LYS 127 HD2 LYS 127 9.553 0.520 -12.758 983 HE2 LYS 127 HE3 LYS 127 7.951 0.027 -14.779 984 HE3 LYS 127 HE2 LYS 127 7.877 1.786 -14.874 985 HZ1 LYS 127 HZ1 LYS 127 10.558 1.029 -14.580 986 HZ2 LYS 127 HZ2 LYS 127 9.819 1.776 -15.905 987 HZ3 LYS 127 HZ3 LYS 127 9.888 0.088 -15.817 988 H MET 128 H MET 128 7.283 1.193 -8.344 989 HA MET 128 HA MET 128 4.741 2.226 -7.770 990 HB2 MET 128 HB3 MET 128 6.804 2.467 -6.357 991 HB3 MET 128 HB2 MET 128 7.370 3.686 -7.490 992 HG2 MET 128 HG3 MET 128 6.341 4.647 -5.479 993 HG3 MET 128 HG2 MET 128 5.513 5.116 -6.963 994 HE1 MET 128 HE1 MET 128 4.368 5.863 -4.680 995 HE2 MET 128 HE2 MET 128 3.191 4.882 -3.807 996 HE3 MET 128 HE3 MET 128 2.766 5.590 -5.365 997 H ILE 129 H ILE 129 4.059 4.504 -8.134 998 HA ILE 129 HA ILE 129 4.554 5.258 -10.934 999 HB ILE 129 HB ILE 129 2.379 6.417 -10.848 1000 HG12 ILE 129 HG13 ILE 129 0.910 5.596 -8.823 1001 HG13 ILE 129 HG12 ILE 129 2.463 5.453 -8.013 1002 HG21 ILE 129 HG21 ILE 129 1.382 3.868 -9.993 1003 HG22 ILE 129 HG22 ILE 129 2.858 3.653 -10.935 1004 HG23 ILE 129 HG23 ILE 129 1.494 4.536 -11.622 1005 HD11 ILE 129 HD11 ILE 129 2.854 7.729 -8.094 1006 HD12 ILE 129 HD12 ILE 129 1.128 7.624 -7.756 1007 HD13 ILE 129 HD13 ILE 129 1.687 7.985 -9.390 1008 HA PRO 130 HA PRO 130 6.370 9.173 -10.064 1009 HB2 PRO 130 HB3 PRO 130 4.103 10.447 -11.524 1010 HB3 PRO 130 HB2 PRO 130 5.844 10.638 -11.761 1011 HG2 PRO 130 HG3 PRO 130 4.404 9.170 -13.449 1012 HG3 PRO 130 HG2 PRO 130 6.032 8.662 -12.962 1013 HD2 PRO 130 HD3 PRO 130 3.377 7.616 -12.089 1014 HD3 PRO 130 HD2 PRO 130 4.904 6.749 -12.347 1015 H LEU 131 H LEU 131 6.257 10.812 -8.563 1016 HA LEU 131 HA LEU 131 3.660 11.479 -7.399 1017 HB2 LEU 131 HB3 LEU 131 5.795 11.040 -5.409 1018 HB3 LEU 131 HB2 LEU 131 4.073 10.741 -5.294 1019 HG LEU 131 HG LEU 131 5.616 8.912 -7.049 1020 HD11 LEU 131 HD11 LEU 131 5.958 7.603 -4.757 1021 HD12 LEU 131 HD12 LEU 131 6.133 9.252 -4.157 1022 HD13 LEU 131 HD13 LEU 131 7.190 8.664 -5.441 1023 HD21 LEU 131 HD21 LEU 131 3.622 8.232 -4.917 1024 HD22 LEU 131 HD22 LEU 131 4.007 7.357 -6.400 1025 HD23 LEU 131 HD23 LEU 131 3.108 8.872 -6.478 1026 H ASN 132 H ASN 132 3.629 13.443 -6.217 1027 HA ASN 132 HA ASN 132 5.561 15.371 -7.150 1028 HB2 ASN 132 HB3 ASN 132 2.898 15.522 -6.503 1029 HB3 ASN 132 HB2 ASN 132 3.652 16.244 -5.085 1030 HD21 ASN 132 HD21 ASN 132 5.622 17.709 -5.863 1031 HD22 ASN 132 HD22 ASN 132 5.170 18.888 -7.042 1032 H TRP 133 H TRP 133 7.382 14.339 -6.087 1033 HA TRP 133 HA TRP 133 7.672 13.952 -3.367 1034 HB2 TRP 133 HB3 TRP 133 9.754 14.717 -5.416 1035 HB3 TRP 133 HB2 TRP 133 10.121 14.145 -3.790 1036 HD1 TRP 133 HD1 TRP 133 8.732 12.924 -7.149 1037 HE1 TRP 133 HE1 TRP 133 8.810 10.352 -7.184 1038 HE3 TRP 133 HE3 TRP 133 10.129 12.086 -2.302 1039 HZ2 TRP 133 HZ2 TRP 133 9.392 8.247 -5.397 1040 HZ3 TRP 133 HZ3 TRP 133 10.425 9.764 -1.545 1041 HH2 TRP 133 HH2 TRP 133 10.063 7.885 -3.062 1042 H ASP 134 H ASP 134 8.187 16.955 -5.222 1043 HA ASP 134 HA ASP 134 9.388 18.455 -3.211 1044 HB2 ASP 134 HB3 ASP 134 7.645 19.185 -5.550 1045 HB3 ASP 134 HB2 ASP 134 8.227 20.419 -4.437 1046 H ASP 135 H ASP 135 5.960 17.907 -3.902 1047 HA ASP 135 HA ASP 135 5.023 19.640 -1.840 1048 HB2 ASP 135 HB3 ASP 135 3.795 17.673 -3.706 1049 HB3 ASP 135 HB2 ASP 135 2.877 18.119 -2.271 1050 H PHE 136 H PHE 136 6.614 16.764 -1.594 1051 HA PHE 136 HA PHE 136 5.287 16.138 0.959 1052 HB2 PHE 136 HB3 PHE 136 6.456 14.259 -1.094 1053 HB3 PHE 136 HB2 PHE 136 6.132 13.766 0.565 1054 HD1 PHE 136 HD1 PHE 136 3.672 14.392 1.388 1055 HD2 PHE 136 HD2 PHE 136 4.850 13.817 -2.661 1056 HE1 PHE 136 HE1 PHE 136 1.340 13.889 0.785 1057 HE2 PHE 136 HE2 PHE 136 2.520 13.314 -3.272 1058 HZ PHE 136 HZ PHE 136 0.762 13.350 -1.548 1059 H THR 137 H THR 137 6.538 16.067 2.711 1060 HA THR 137 HA THR 137 9.450 16.317 2.327 1061 HB THR 137 HB THR 137 7.657 17.445 4.482 1062 HG1 THR 137 HG1 THR 137 9.281 18.628 2.486 1063 HG21 THR 137 HG21 THR 137 9.668 18.544 5.377 1064 HG22 THR 137 HG22 THR 137 10.657 17.553 4.305 1065 HG23 THR 137 HG23 THR 137 9.695 16.791 5.571 1066 H LYS 138 H LYS 138 10.820 15.041 3.491 1067 HA LYS 138 HA LYS 138 9.741 12.624 4.568 1068 HB2 LYS 138 HB3 LYS 138 11.885 12.728 3.316 1069 HB3 LYS 138 HB2 LYS 138 12.591 13.613 4.663 1070 HG2 LYS 138 HG3 LYS 138 12.891 11.765 5.870 1071 HG3 LYS 138 HG2 LYS 138 11.299 11.127 5.464 1072 HD2 LYS 138 HD3 LYS 138 13.028 9.656 4.615 1073 HD3 LYS 138 HD2 LYS 138 12.161 10.413 3.277 1074 HE2 LYS 138 HE3 LYS 138 14.659 10.323 3.020 1075 HE3 LYS 138 HE2 LYS 138 13.944 11.928 2.867 1076 HZ1 LYS 138 HZ1 LYS 138 14.779 11.193 5.543 1077 HZ2 LYS 138 HZ2 LYS 138 14.971 12.652 4.710 1078 HZ3 LYS 138 HZ3 LYS 138 16.036 11.370 4.424 1079 H VAL 139 H VAL 139 9.005 12.358 6.538 1080 HA VAL 139 HA VAL 139 9.817 14.231 8.634 1081 HB VAL 139 HB VAL 139 7.956 13.017 9.944 1082 HG11 VAL 139 HG11 VAL 139 7.312 15.129 9.466 1083 HG12 VAL 139 HG12 VAL 139 6.224 14.304 8.349 1084 HG13 VAL 139 HG13 VAL 139 7.738 14.990 7.760 1085 HG21 VAL 139 HG21 VAL 139 6.629 11.511 8.944 1086 HG22 VAL 139 HG22 VAL 139 7.956 11.333 7.798 1087 HG23 VAL 139 HG23 VAL 139 6.605 12.399 7.421 1088 H SER 140 H SER 140 10.001 10.856 7.731 1089 HA SER 140 HA SER 140 11.837 10.444 9.980 1090 HB2 SER 140 HB3 SER 140 9.227 9.366 9.917 1091 HB3 SER 140 HB2 SER 140 10.326 8.029 9.577 1092 HG SER 140 HG SER 140 10.685 9.829 11.735 1093 H SER 141 H SER 141 13.456 8.932 9.626 1094 HA SER 141 HA SER 141 13.497 7.387 7.182 1095 HB2 SER 141 HB3 SER 141 14.336 9.357 6.195 1096 HB3 SER 141 HB2 SER 141 15.303 9.759 7.614 1097 HG SER 141 HG SER 141 15.749 7.526 5.919 1098 H ARG 142 H ARG 142 14.390 5.491 7.634 1099 HA ARG 142 HA ARG 142 16.679 5.331 9.427 1100 HB2 ARG 142 HB3 ARG 142 14.584 5.072 10.813 1101 HB3 ARG 142 HB2 ARG 142 14.244 3.609 9.899 1102 HG2 ARG 142 HG3 ARG 142 15.372 2.556 11.505 1103 HG3 ARG 142 HG2 ARG 142 16.819 3.191 10.719 1104 HD2 ARG 142 HD3 ARG 142 17.166 3.891 12.875 1105 HD3 ARG 142 HD2 ARG 142 16.327 5.291 12.209 1106 HE ARG 142 HE ARG 142 14.556 4.850 13.594 1107 HH11 ARG 142 HH11 ARG 142 16.656 2.063 13.514 1108 HH12 ARG 142 HH12 ARG 142 15.824 1.244 14.793 1109 HH21 ARG 142 HH21 ARG 142 13.461 3.773 15.276 1110 HH22 ARG 142 HH22 ARG 142 14.010 2.214 15.793 1111 H THR 143 H THR 143 17.972 3.523 9.092 1112 HA THR 143 HA THR 143 17.238 1.897 6.747 1113 HB THR 143 HB THR 143 20.046 2.450 7.702 1114 HG1 THR 143 HG1 THR 143 19.178 4.421 7.118 1115 HG21 THR 143 HG21 THR 143 19.488 0.528 6.079 1116 HG22 THR 143 HG22 THR 143 20.802 1.636 5.680 1117 HG23 THR 143 HG23 THR 143 19.229 1.817 4.902 1118 H VAL 144 H VAL 144 16.673 -0.093 7.294 1119 HA VAL 144 HA VAL 144 17.926 -1.342 9.642 1120 HB VAL 144 HB VAL 144 15.434 -2.252 8.201 1121 HG11 VAL 144 HG11 VAL 144 16.760 -3.036 10.781 1122 HG12 VAL 144 HG12 VAL 144 16.333 -4.059 9.409 1123 HG13 VAL 144 HG13 VAL 144 15.066 -3.395 10.442 1124 HG21 VAL 144 HG21 VAL 144 14.108 -1.102 9.755 1125 HG22 VAL 144 HG22 VAL 144 15.338 0.067 9.276 1126 HG23 VAL 144 HG23 VAL 144 15.478 -0.779 10.817 1127 H GLU 145 H GLU 145 19.177 -3.107 9.432 1128 HA GLU 145 HA GLU 145 19.274 -4.418 6.797 1129 HB2 GLU 145 HB3 GLU 145 21.755 -4.809 7.388 1130 HB3 GLU 145 HB2 GLU 145 21.272 -3.218 6.815 1131 HG2 GLU 145 HG3 GLU 145 21.626 -2.227 8.830 1132 HG3 GLU 145 HG2 GLU 145 21.266 -3.694 9.740 1133 H ASP 146 H ASP 146 19.594 -6.619 6.754 1134 HA ASP 146 HA ASP 146 19.377 -7.986 9.356 1135 HB2 ASP 146 HB3 ASP 146 17.913 -8.312 6.813 1136 HB3 ASP 146 HB2 ASP 146 18.422 -9.815 7.575 1137 H THR 147 H THR 147 19.858 -10.549 8.693 1138 HA THR 147 HA THR 147 22.646 -10.687 8.508 1139 HB THR 147 HB THR 147 21.404 -12.468 9.556 1140 HG1 THR 147 HG1 THR 147 22.535 -13.498 7.173 1141 HG21 THR 147 HG21 THR 147 19.518 -12.243 7.688 1142 HG22 THR 147 HG22 THR 147 19.738 -13.694 8.666 1143 HG23 THR 147 HG23 THR 147 20.403 -13.622 7.034 1144 H ASN 148 H ASN 148 20.139 -11.231 6.071 1145 HA ASN 148 HA ASN 148 22.067 -11.790 4.000 1146 HB2 ASN 148 HB3 ASN 148 19.079 -11.578 4.122 1147 HB3 ASN 148 HB2 ASN 148 19.888 -11.534 2.558 1148 HD21 ASN 148 HD21 ASN 148 18.190 -13.516 4.255 1149 HD22 ASN 148 HD22 ASN 148 19.006 -15.018 4.001 1150 HA PRO 149 HA PRO 149 22.873 -7.585 2.858 1151 HB2 PRO 149 HB3 PRO 149 23.513 -7.993 0.221 1152 HB3 PRO 149 HB2 PRO 149 24.621 -8.288 1.565 1153 HG2 PRO 149 HG3 PRO 149 22.924 -10.228 0.045 1154 HG3 PRO 149 HG2 PRO 149 24.598 -10.401 0.605 1155 HD2 PRO 149 HD3 PRO 149 22.546 -11.548 1.908 1156 HD3 PRO 149 HD2 PRO 149 23.955 -10.899 2.772 1157 H ALA 150 H ALA 150 20.734 -9.583 0.898 1158 HA ALA 150 HA ALA 150 19.546 -7.320 -0.439 1159 HB1 ALA 150 HB1 ALA 150 17.861 -9.308 -1.031 1160 HB2 ALA 150 HB2 ALA 150 19.269 -10.260 -0.562 1161 HB3 ALA 150 HB3 ALA 150 19.399 -9.074 -1.861 1162 H LEU 151 H LEU 151 19.089 -8.891 2.553 1163 HA LEU 151 HA LEU 151 16.276 -8.239 2.760 1164 HB2 LEU 151 HB3 LEU 151 18.260 -9.506 4.625 1165 HB3 LEU 151 HB2 LEU 151 16.663 -9.035 5.172 1166 HG LEU 151 HG LEU 151 17.391 -11.153 3.164 1167 HD11 LEU 151 HD11 LEU 151 15.487 -11.400 5.455 1168 HD12 LEU 151 HD12 LEU 151 17.227 -11.496 5.726 1169 HD13 LEU 151 HD13 LEU 151 16.437 -12.647 4.648 1170 HD21 LEU 151 HD21 LEU 151 14.710 -9.859 3.622 1171 HD22 LEU 151 HD22 LEU 151 14.916 -11.435 2.857 1172 HD23 LEU 151 HD23 LEU 151 15.602 -9.993 2.107 1173 H THR 152 H THR 152 18.783 -6.281 2.720 1174 HA THR 152 HA THR 152 18.258 -4.774 5.141 1175 HB THR 152 HB THR 152 20.023 -4.044 2.796 1176 HG1 THR 152 HG1 THR 152 20.555 -6.054 3.922 1177 HG21 THR 152 HG21 THR 152 21.268 -2.844 4.700 1178 HG22 THR 152 HG22 THR 152 19.730 -2.944 5.555 1179 HG23 THR 152 HG23 THR 152 19.828 -2.092 4.014 1180 H HIS 153 H HIS 153 16.683 -3.314 5.281 1181 HA HIS 153 HA HIS 153 15.819 -1.952 2.816 1182 HB2 HIS 153 HB3 HIS 153 13.759 -2.301 4.900 1183 HB3 HIS 153 HB2 HIS 153 13.628 -2.432 3.150 1184 HD1 HIS 153 HD1 HIS 153 13.146 -4.435 5.960 1185 HD2 HIS 153 HD2 HIS 153 15.166 -5.026 2.378 1186 HE1 HIS 153 HE1 HIS 153 13.318 -6.929 5.687 1187 HE2 HIS 153 HE2 HIS 153 14.464 -7.262 3.471 1188 H THR 154 H THR 154 14.567 0.070 3.275 1189 HA THR 154 HA THR 154 15.537 1.414 5.706 1190 HB THR 154 HB THR 154 15.379 2.694 2.972 1191 HG1 THR 154 HG1 THR 154 17.339 2.053 2.642 1192 HG21 THR 154 HG21 THR 154 15.255 4.089 5.161 1193 HG22 THR 154 HG22 THR 154 16.321 4.589 3.849 1194 HG23 THR 154 HG23 THR 154 16.982 3.745 5.250 1195 H TYR 155 H TYR 155 13.956 2.293 6.864 1196 HA TYR 155 HA TYR 155 11.291 2.494 5.698 1197 HB2 TYR 155 HB3 TYR 155 12.402 2.246 8.429 1198 HB3 TYR 155 HB2 TYR 155 10.953 3.234 8.286 1199 HD1 TYR 155 HD1 TYR 155 9.009 2.128 6.871 1200 HD2 TYR 155 HD2 TYR 155 12.154 -0.025 8.761 1201 HE1 TYR 155 HE1 TYR 155 7.622 0.097 6.852 1202 HE2 TYR 155 HE2 TYR 155 10.776 -2.062 8.747 1203 HH TYR 155 HH TYR 155 7.853 -2.292 6.965 1204 H GLU 156 H GLU 156 10.746 4.341 4.751 1205 HA GLU 156 HA GLU 156 11.728 6.856 5.935 1206 HB2 GLU 156 HB3 GLU 156 11.086 6.305 3.033 1207 HB3 GLU 156 HB2 GLU 156 11.637 7.840 3.690 1208 HG2 GLU 156 HG3 GLU 156 13.784 7.077 4.035 1209 HG3 GLU 156 HG2 GLU 156 13.287 5.385 4.070 1210 H VAL 157 H VAL 157 10.297 8.402 6.426 1211 HA VAL 157 HA VAL 157 7.470 7.879 5.803 1212 HB VAL 157 HB VAL 157 8.500 9.535 8.105 1213 HG11 VAL 157 HG11 VAL 157 5.773 8.327 7.649 1214 HG12 VAL 157 HG12 VAL 157 6.193 9.990 7.245 1215 HG13 VAL 157 HG13 VAL 157 6.249 9.450 8.922 1216 HG21 VAL 157 HG21 VAL 157 9.137 7.090 8.200 1217 HG22 VAL 157 HG22 VAL 157 7.411 6.736 8.280 1218 HG23 VAL 157 HG23 VAL 157 8.175 7.690 9.552 1219 H TRP 158 H TRP 158 6.161 9.567 5.233 1220 HA TRP 158 HA TRP 158 7.342 12.181 4.698 1221 HB2 TRP 158 HB3 TRP 158 6.139 10.502 2.498 1222 HB3 TRP 158 HB2 TRP 158 6.561 12.202 2.343 1223 HD1 TRP 158 HD1 TRP 158 8.294 8.806 3.030 1224 HE1 TRP 158 HE1 TRP 158 10.698 8.945 2.122 1225 HE3 TRP 158 HE3 TRP 158 8.332 13.707 1.575 1226 HZ2 TRP 158 HZ2 TRP 158 12.387 10.876 0.945 1227 HZ3 TRP 158 HZ3 TRP 158 10.381 14.623 0.567 1228 HH2 TRP 158 HH2 TRP 158 12.366 13.235 0.259 1229 H GLN 159 H GLN 159 5.937 13.844 4.776 1230 HA GLN 159 HA GLN 159 3.063 13.272 4.780 1231 HB2 GLN 159 HB3 GLN 159 4.502 14.838 6.932 1232 HB3 GLN 159 HB2 GLN 159 2.756 14.698 6.779 1233 HG2 GLN 159 HG3 GLN 159 3.736 12.076 6.789 1234 HG3 GLN 159 HG2 GLN 159 4.623 12.934 8.048 1235 HE21 GLN 159 HE21 GLN 159 3.566 13.614 9.865 1236 HE22 GLN 159 HE22 GLN 159 1.934 13.185 10.232 1237 H LYS 160 H LYS 160 1.925 14.746 3.642 1238 HA LYS 160 HA LYS 160 3.175 16.688 2.096 1239 HB2 LYS 160 HB3 LYS 160 0.573 15.645 2.393 1240 HB3 LYS 160 HB2 LYS 160 0.419 17.388 2.558 1241 HG2 LYS 160 HG3 LYS 160 2.141 16.804 0.355 1242 HG3 LYS 160 HG2 LYS 160 0.652 15.871 0.199 1243 HD2 LYS 160 HD3 LYS 160 -0.059 18.491 1.021 1244 HD3 LYS 160 HD2 LYS 160 1.088 18.642 -0.311 1245 HE2 LYS 160 HE3 LYS 160 -0.554 16.650 -1.201 1246 HE3 LYS 160 HE2 LYS 160 -1.675 17.667 -0.298 1247 HZ1 LYS 160 HZ1 LYS 160 -0.994 18.098 -2.837 1248 HZ2 LYS 160 HZ2 LYS 160 0.145 19.077 -2.060 1249 HZ3 LYS 160 HZ3 LYS 160 -1.507 19.321 -1.787 1250 H LYS 161 H LYS 161 3.500 18.850 2.277 1251 HA LYS 161 HA LYS 161 3.900 19.990 4.783 1252 HB2 LYS 161 HB3 LYS 161 3.412 21.445 2.178 1253 HB3 LYS 161 HB2 LYS 161 4.195 22.109 3.606 1254 HG2 LYS 161 HG3 LYS 161 6.054 20.618 3.355 1255 HG3 LYS 161 HG2 LYS 161 5.246 19.765 2.038 1256 HD2 LYS 161 HD3 LYS 161 5.541 21.522 0.550 1257 HD3 LYS 161 HD2 LYS 161 5.760 22.707 1.839 1258 HE2 LYS 161 HE3 LYS 161 7.752 20.544 1.764 1259 HE3 LYS 161 HE2 LYS 161 7.778 21.637 0.381 1260 HZ1 LYS 161 HZ1 LYS 161 8.023 23.498 1.869 1261 HZ2 LYS 161 HZ2 LYS 161 9.240 22.368 2.184 1262 HZ3 LYS 161 HZ3 LYS 161 7.911 22.490 3.223 1263 H ALA 162 H ALA 162 2.771 21.480 6.018 1264 HA ALA 162 HA ALA 162 0.952 22.445 6.986 1265 HB1 ALA 162 HB1 ALA 162 0.209 22.693 4.086 1266 HB2 ALA 162 HB2 ALA 162 0.832 23.935 5.172 1267 HB3 ALA 162 HB3 ALA 162 -0.811 23.327 5.377 1268 H51A NDP 170 H51A NDP 170 -4.763 -0.720 -9.123 1269 H52A NDP 170 H52A NDP 170 -5.117 -2.361 -8.567 1270 H4B NDP 170 H4B NDP 170 -6.467 -2.712 -10.675 1271 H3B NDP 170 H3B NDP 170 -5.801 0.198 -11.160 1272 HO3A NDP 170 HO3A NDP 170 -5.838 -0.690 -13.317 1273 H2B NDP 170 H2B NDP 170 -8.013 0.455 -12.046 1274 H1B NDP 170 H1B NDP 170 -9.291 -0.896 -10.014 1275 H8A NDP 170 H8A NDP 170 -6.253 0.956 -8.719 1276 H61A NDP 170 H61A NDP 170 -10.116 5.736 -7.855 1277 H62A NDP 170 H62A NDP 170 -8.491 5.140 -7.601 1278 H2A NDP 170 H2A NDP 170 -12.331 2.548 -10.103 1279 H51N NDP 170 H51N NDP 170 -1.694 -5.597 -9.223 1280 H52N NDP 170 H52N NDP 170 -1.553 -5.018 -7.554 1281 H4D NDP 170 H4D NDP 170 0.760 -5.692 -9.423 1282 H3D NDP 170 H3D NDP 170 -0.352 -7.136 -7.005 1283 HO3N NDP 170 HO3N NDP 170 0.318 -7.674 -9.691 1284 H2D NDP 170 H2D NDP 170 1.905 -7.817 -6.532 1285 HO2N NDP 170 HO2N NDP 170 3.338 -8.065 -8.039 1286 H1D NDP 170 H1D NDP 170 3.028 -5.332 -6.959 1287 H2N NDP 170 H2N NDP 170 3.590 -5.281 -4.596 1288 H71N NDP 170 H71N NDP 170 5.368 -4.596 -1.979 1289 H72N NDP 170 H72N NDP 170 4.944 -4.903 -3.644 1290 H41N NDP 170 H41N NDP 170 0.493 -4.096 -2.381 1291 H42N NDP 170 H42N NDP 170 0.564 -5.865 -2.076 1292 H5N NDP 170 H5N NDP 170 -1.283 -5.277 -3.645 1293 H6N NDP 170 H6N NDP 170 -0.530 -5.676 -5.993 Start of MODEL 23 1 H1 THR 1 HT1 THR 1 -5.464 10.060 5.094 2 H2 THR 1 HT2 THR 1 -4.977 8.832 6.190 3 H3 THR 1 HT3 THR 1 -6.566 8.825 5.541 4 HA THR 1 HA THR 1 -5.482 7.228 4.352 5 HB THR 1 HB THR 1 -5.017 8.522 2.108 6 HG1 THR 1 HG1 THR 1 -5.330 10.595 2.161 7 HG21 THR 1 HG21 THR 1 -7.252 7.424 3.108 8 HG22 THR 1 HG22 THR 1 -7.170 8.242 1.548 9 HG23 THR 1 HG23 THR 1 -7.766 9.105 2.965 10 H ALA 2 H ALA 2 -3.610 6.187 4.370 11 HA ALA 2 HA ALA 2 -1.126 7.731 4.002 12 HB1 ALA 2 HB1 ALA 2 -1.030 7.192 6.263 13 HB2 ALA 2 HB2 ALA 2 -0.092 5.908 5.500 14 HB3 ALA 2 HB3 ALA 2 -1.750 5.601 6.014 15 H PHE 3 H PHE 3 0.679 6.484 3.145 16 HA PHE 3 HA PHE 3 -0.242 4.352 1.330 17 HB2 PHE 3 HB3 PHE 3 1.649 6.616 1.035 18 HB3 PHE 3 HB2 PHE 3 2.107 5.111 0.251 19 HD1 PHE 3 HD1 PHE 3 -1.359 6.321 0.668 20 HD2 PHE 3 HD2 PHE 3 1.928 5.807 -1.986 21 HE1 PHE 3 HE1 PHE 3 -2.812 6.882 -1.238 22 HE2 PHE 3 HE2 PHE 3 0.482 6.366 -3.894 23 HZ PHE 3 HZ PHE 3 -1.888 6.905 -3.523 24 H LEU 4 H LEU 4 0.680 2.367 1.465 25 HA LEU 4 HA LEU 4 3.259 2.076 2.795 26 HB2 LEU 4 HB3 LEU 4 1.768 1.799 4.632 27 HB3 LEU 4 HB2 LEU 4 0.709 0.760 3.698 28 HG LEU 4 HG LEU 4 2.613 -0.909 3.611 29 HD11 LEU 4 HD11 LEU 4 4.157 -0.555 5.680 30 HD12 LEU 4 HD12 LEU 4 3.781 1.149 5.429 31 HD13 LEU 4 HD13 LEU 4 4.549 0.217 4.144 32 HD21 LEU 4 HD21 LEU 4 1.944 -0.523 6.462 33 HD22 LEU 4 HD22 LEU 4 1.767 -1.945 5.434 34 HD23 LEU 4 HD23 LEU 4 0.590 -0.634 5.336 35 H TRP 5 H TRP 5 4.472 0.980 1.386 36 HA TRP 5 HA TRP 5 3.586 -1.571 0.409 37 HB2 TRP 5 HB3 TRP 5 3.449 -1.161 -1.880 38 HB3 TRP 5 HB2 TRP 5 2.646 0.243 -1.188 39 HD1 TRP 5 HD1 TRP 5 5.754 -0.776 -3.136 40 HE1 TRP 5 HE1 TRP 5 6.912 1.340 -4.030 41 HE3 TRP 5 HE3 TRP 5 3.002 2.759 -0.673 42 HZ2 TRP 5 HZ2 TRP 5 6.692 4.135 -3.729 43 HZ3 TRP 5 HZ3 TRP 5 3.541 5.133 -1.035 44 HH2 TRP 5 HH2 TRP 5 5.347 5.805 -2.532 45 H ALA 6 H ALA 6 5.276 -2.778 -0.658 46 HA ALA 6 HA ALA 6 7.935 -1.873 0.197 47 HB1 ALA 6 HB1 ALA 6 8.535 -4.311 -0.238 48 HB2 ALA 6 HB2 ALA 6 6.802 -4.591 -0.403 49 HB3 ALA 6 HB3 ALA 6 7.457 -3.983 1.118 50 H GLN 7 H GLN 7 9.748 -2.031 -1.218 51 HA GLN 7 HA GLN 7 9.284 -2.642 -4.007 52 HB2 GLN 7 HB3 GLN 7 10.103 -0.379 -4.745 53 HB3 GLN 7 HB2 GLN 7 8.492 -0.397 -4.040 54 HG2 GLN 7 HG3 GLN 7 10.288 0.047 -1.923 55 HG3 GLN 7 HG2 GLN 7 10.796 1.092 -3.248 56 HE21 GLN 7 HE21 GLN 7 8.229 0.323 -1.018 57 HE22 GLN 7 HE22 GLN 7 7.330 1.779 -1.244 58 H ASP 8 H ASP 8 11.219 -2.623 -5.300 59 HA ASP 8 HA ASP 8 13.598 -3.199 -3.696 60 HB2 ASP 8 HB3 ASP 8 14.444 -4.349 -5.665 61 HB3 ASP 8 HB2 ASP 8 12.809 -4.899 -5.325 62 H ARG 9 H ARG 9 15.593 -2.778 -5.591 63 HA ARG 9 HA ARG 9 16.019 0.021 -5.321 64 HB2 ARG 9 HB3 ARG 9 17.499 -2.243 -6.595 65 HB3 ARG 9 HB2 ARG 9 17.970 -0.594 -6.987 66 HG2 ARG 9 HG3 ARG 9 17.734 -1.543 -4.151 67 HG3 ARG 9 HG2 ARG 9 19.211 -1.754 -5.095 68 HD2 ARG 9 HD3 ARG 9 18.029 0.951 -5.110 69 HD3 ARG 9 HD2 ARG 9 18.704 0.409 -3.574 70 HE ARG 9 HE ARG 9 20.150 1.095 -5.961 71 HH11 ARG 9 HH11 ARG 9 20.240 -0.736 -2.991 72 HH12 ARG 9 HH12 ARG 9 21.970 -0.769 -2.917 73 HH21 ARG 9 HH21 ARG 9 22.425 1.052 -5.866 74 HH22 ARG 9 HH22 ARG 9 23.211 0.247 -4.549 75 H ASP 10 H ASP 10 14.791 -2.018 -7.860 76 HA ASP 10 HA ASP 10 14.955 0.025 -9.897 77 HB2 ASP 10 HB3 ASP 10 14.156 -2.821 -9.770 78 HB3 ASP 10 HB2 ASP 10 13.328 -1.847 -10.981 79 H GLY 11 H GLY 11 13.052 -0.214 -7.290 80 HA2 GLY 11 HA3 GLY 11 11.185 1.101 -6.789 81 HA3 GLY 11 HA2 GLY 11 10.965 1.396 -8.508 82 H LEU 12 H LEU 12 11.349 -1.812 -8.376 83 HA LEU 12 HA LEU 12 8.832 -2.574 -9.100 84 HB2 LEU 12 HB3 LEU 12 11.025 -3.914 -9.030 85 HB3 LEU 12 HB2 LEU 12 10.580 -4.324 -7.387 86 HG LEU 12 HG LEU 12 8.557 -5.450 -8.187 87 HD11 LEU 12 HD11 LEU 12 8.186 -5.764 -10.584 88 HD12 LEU 12 HD12 LEU 12 9.537 -4.686 -10.936 89 HD13 LEU 12 HD13 LEU 12 8.096 -4.062 -10.134 90 HD21 LEU 12 HD21 LEU 12 9.645 -7.355 -8.721 91 HD22 LEU 12 HD22 LEU 12 11.059 -6.397 -8.279 92 HD23 LEU 12 HD23 LEU 12 10.614 -6.583 -9.977 93 H ILE 13 H ILE 13 7.393 -4.132 -7.822 94 HA ILE 13 HA ILE 13 7.191 -3.622 -4.994 95 HB ILE 13 HB ILE 13 4.865 -2.851 -5.052 96 HG12 ILE 13 HG13 ILE 13 4.995 -2.021 -7.888 97 HG13 ILE 13 HG12 ILE 13 4.755 -3.740 -7.613 98 HG21 ILE 13 HG21 ILE 13 5.298 -0.557 -5.657 99 HG22 ILE 13 HG22 ILE 13 6.675 -1.044 -6.644 100 HG23 ILE 13 HG23 ILE 13 6.729 -1.248 -4.893 101 HD11 ILE 13 HD11 ILE 13 2.635 -2.622 -7.867 102 HD12 ILE 13 HD12 ILE 13 3.035 -1.516 -6.553 103 HD13 ILE 13 HD13 ILE 13 2.803 -3.232 -6.221 104 H GLY 14 H GLY 14 5.968 -5.116 -7.924 105 HA2 GLY 14 HA3 GLY 14 5.413 -7.537 -6.385 106 HA3 GLY 14 HA2 GLY 14 4.107 -6.860 -7.342 107 H LYS 15 H LYS 15 4.562 -9.260 -8.031 108 HA LYS 15 HA LYS 15 6.176 -9.125 -10.485 109 HB2 LYS 15 HB3 LYS 15 6.792 -11.471 -10.203 110 HB3 LYS 15 HB2 LYS 15 7.333 -10.526 -8.822 111 HG2 LYS 15 HG3 LYS 15 6.027 -11.642 -7.386 112 HG3 LYS 15 HG2 LYS 15 4.672 -11.711 -8.512 113 HD2 LYS 15 HD3 LYS 15 6.528 -13.372 -9.680 114 HD3 LYS 15 HD2 LYS 15 6.749 -13.684 -7.958 115 HE2 LYS 15 HE3 LYS 15 4.161 -13.845 -7.916 116 HE3 LYS 15 HE2 LYS 15 4.316 -14.071 -9.657 117 HZ1 LYS 15 HZ1 LYS 15 4.395 -16.067 -7.914 118 HZ2 LYS 15 HZ2 LYS 15 6.046 -15.712 -7.997 119 HZ3 LYS 15 HZ3 LYS 15 5.197 -16.112 -9.404 120 H ASP 16 H ASP 16 3.717 -8.384 -10.800 121 HA ASP 16 HA ASP 16 1.878 -8.782 -12.093 122 HB2 ASP 16 HB3 ASP 16 3.590 -10.946 -12.773 123 HB3 ASP 16 HB2 ASP 16 1.978 -11.614 -12.535 124 H GLY 17 H GLY 17 2.034 -9.089 -9.202 125 HA2 GLY 17 HA3 GLY 17 -0.587 -9.964 -8.684 126 HA3 GLY 17 HA2 GLY 17 0.531 -11.245 -8.236 127 H HIS 18 H HIS 18 2.596 -10.089 -7.080 128 HA HIS 18 HA HIS 18 2.084 -7.908 -5.371 129 HB2 HIS 18 HB3 HIS 18 1.772 -9.045 -3.241 130 HB3 HIS 18 HB2 HIS 18 0.481 -9.493 -4.351 131 HD1 HIS 18 HD1 HIS 18 2.132 -11.052 -1.834 132 HD2 HIS 18 HD2 HIS 18 1.778 -12.018 -5.860 133 HE1 HIS 18 HE1 HIS 18 2.585 -13.522 -1.975 134 HE2 HIS 18 HE2 HIS 18 2.284 -14.098 -4.409 135 H LEU 19 H LEU 19 3.645 -8.361 -3.230 136 HA LEU 19 HA LEU 19 6.252 -8.366 -4.340 137 HB2 LEU 19 HB3 LEU 19 7.007 -8.251 -1.974 138 HB3 LEU 19 HB2 LEU 19 5.842 -7.021 -2.420 139 HG LEU 19 HG LEU 19 4.162 -8.865 -1.413 140 HD11 LEU 19 HD11 LEU 19 6.581 -10.000 -0.801 141 HD12 LEU 19 HD12 LEU 19 5.054 -10.327 0.019 142 HD13 LEU 19 HD13 LEU 19 6.173 -9.135 0.681 143 HD21 LEU 19 HD21 LEU 19 4.170 -7.550 0.641 144 HD22 LEU 19 HD22 LEU 19 4.300 -6.508 -0.777 145 HD23 LEU 19 HD23 LEU 19 5.729 -6.854 0.198 146 HA PRO 20 HA PRO 20 6.702 -12.835 -4.038 147 HB2 PRO 20 HB3 PRO 20 8.790 -13.090 -5.678 148 HB3 PRO 20 HB2 PRO 20 7.185 -12.686 -6.295 149 HG2 PRO 20 HG3 PRO 20 9.541 -10.911 -5.832 150 HG3 PRO 20 HG2 PRO 20 8.369 -10.894 -7.161 151 HD2 PRO 20 HD3 PRO 20 8.309 -9.214 -4.948 152 HD3 PRO 20 HD2 PRO 20 6.931 -9.557 -6.010 153 H TRP 21 H TRP 21 9.064 -10.418 -3.197 154 HA TRP 21 HA TRP 21 11.076 -12.201 -2.267 155 HB2 TRP 21 HB3 TRP 21 11.884 -10.123 -1.017 156 HB3 TRP 21 HB2 TRP 21 11.812 -10.019 -2.772 157 HD1 TRP 21 HD1 TRP 21 9.297 -9.229 0.092 158 HE1 TRP 21 HE1 TRP 21 8.201 -6.963 -0.434 159 HE3 TRP 21 HE3 TRP 21 11.673 -8.183 -4.310 160 HZ2 TRP 21 HZ2 TRP 21 8.324 -4.991 -2.452 161 HZ3 TRP 21 HZ3 TRP 21 11.126 -6.087 -5.477 162 HH2 TRP 21 HH2 TRP 21 9.485 -4.526 -4.566 163 H HIS 22 H HIS 22 11.633 -12.755 -0.142 164 HA HIS 22 HA HIS 22 9.352 -13.107 1.601 165 HB2 HIS 22 HB3 HIS 22 11.888 -14.409 1.185 166 HB3 HIS 22 HB2 HIS 22 11.688 -14.027 2.891 167 HD1 HIS 22 HD1 HIS 22 10.357 -15.654 4.207 168 HD2 HIS 22 HD2 HIS 22 9.581 -15.940 0.135 169 HE1 HIS 22 HE1 HIS 22 8.818 -17.626 3.953 170 HE2 HIS 22 HE2 HIS 22 8.437 -17.836 1.471 171 H LEU 23 H LEU 23 8.804 -11.246 2.604 172 HA LEU 23 HA LEU 23 10.905 -9.852 4.126 173 HB2 LEU 23 HB3 LEU 23 8.747 -8.906 2.428 174 HB3 LEU 23 HB2 LEU 23 8.689 -8.176 4.020 175 HG LEU 23 HG LEU 23 11.116 -7.548 3.698 176 HD11 LEU 23 HD11 LEU 23 10.812 -9.153 1.399 177 HD12 LEU 23 HD12 LEU 23 12.233 -8.245 1.918 178 HD13 LEU 23 HD13 LEU 23 11.049 -7.494 0.847 179 HD21 LEU 23 HD21 LEU 23 10.311 -5.844 1.762 180 HD22 LEU 23 HD22 LEU 23 9.901 -5.669 3.469 181 HD23 LEU 23 HD23 LEU 23 8.754 -6.420 2.359 182 HA PRO 24 HA PRO 24 8.274 -11.914 7.324 183 HB2 PRO 24 HB3 PRO 24 10.762 -11.547 8.875 184 HB3 PRO 24 HB2 PRO 24 9.788 -13.001 8.638 185 HG2 PRO 24 HG3 PRO 24 12.166 -12.711 7.446 186 HG3 PRO 24 HG2 PRO 24 10.815 -13.522 6.633 187 HD2 PRO 24 HD3 PRO 24 11.866 -10.746 6.250 188 HD3 PRO 24 HD2 PRO 24 11.291 -11.912 5.041 189 H ASP 25 H ASP 25 10.577 -9.243 7.809 190 HA ASP 25 HA ASP 25 9.260 -8.190 10.082 191 HB2 ASP 25 HB3 ASP 25 10.701 -6.166 9.552 192 HB3 ASP 25 HB2 ASP 25 11.553 -7.673 9.845 193 H ASP 26 H ASP 26 8.754 -7.831 6.670 194 HA ASP 26 HA ASP 26 7.293 -5.356 6.908 195 HB2 ASP 26 HB3 ASP 26 8.621 -6.357 4.851 196 HB3 ASP 26 HB2 ASP 26 7.063 -7.096 4.494 197 H LEU 27 H LEU 27 6.410 -8.726 6.105 198 HA LEU 27 HA LEU 27 3.682 -8.373 5.889 199 HB2 LEU 27 HB3 LEU 27 3.559 -10.791 6.527 200 HB3 LEU 27 HB2 LEU 27 4.623 -10.420 5.193 201 HG LEU 27 HG LEU 27 6.430 -10.369 7.152 202 HD11 LEU 27 HD11 LEU 27 4.208 -11.163 8.567 203 HD12 LEU 27 HD12 LEU 27 5.886 -11.385 9.060 204 HD13 LEU 27 HD13 LEU 27 5.033 -12.684 8.226 205 HD21 LEU 27 HD21 LEU 27 6.665 -12.907 6.687 206 HD22 LEU 27 HD22 LEU 27 6.840 -11.768 5.353 207 HD23 LEU 27 HD23 LEU 27 5.329 -12.652 5.564 208 H HIS 28 H HIS 28 5.576 -9.205 8.787 209 HA HIS 28 HA HIS 28 3.374 -9.350 10.543 210 HB2 HIS 28 HB3 HIS 28 5.926 -10.045 10.812 211 HB3 HIS 28 HB2 HIS 28 6.032 -8.456 11.563 212 HD1 HIS 28 HD1 HIS 28 3.463 -8.365 13.169 213 HD2 HIS 28 HD2 HIS 28 5.878 -11.737 12.927 214 HE1 HIS 28 HE1 HIS 28 2.924 -9.725 15.214 215 HE2 HIS 28 HE2 HIS 28 4.322 -11.809 14.992 216 H TYR 29 H TYR 29 5.653 -6.716 9.840 217 HA TYR 29 HA TYR 29 4.540 -4.839 11.612 218 HB2 TYR 29 HB3 TYR 29 6.790 -4.718 10.436 219 HB3 TYR 29 HB2 TYR 29 5.915 -4.170 9.010 220 HD1 TYR 29 HD1 TYR 29 5.912 -3.346 12.664 221 HD2 TYR 29 HD2 TYR 29 6.018 -1.900 8.664 222 HE1 TYR 29 HE1 TYR 29 6.003 -1.039 13.507 223 HE2 TYR 29 HE2 TYR 29 6.111 0.412 9.497 224 HH TYR 29 HH TYR 29 6.974 1.283 12.416 225 H PHE 30 H PHE 30 3.549 -5.938 8.482 226 HA PHE 30 HA PHE 30 1.946 -3.697 7.780 227 HB2 PHE 30 HB3 PHE 30 2.776 -6.015 6.509 228 HB3 PHE 30 HB2 PHE 30 1.042 -6.253 6.693 229 HD1 PHE 30 HD2 PHE 30 -0.482 -4.334 5.904 230 HD2 PHE 30 HD1 PHE 30 3.597 -4.741 4.762 231 HE1 PHE 30 HE2 PHE 30 -0.889 -2.890 3.954 232 HE2 PHE 30 HE1 PHE 30 3.198 -3.297 2.810 233 HZ PHE 30 HZ PHE 30 0.953 -2.370 2.404 234 H ARG 31 H ARG 31 1.181 -6.872 9.190 235 HA ARG 31 HA ARG 31 -1.582 -6.198 9.584 236 HB2 ARG 31 HB3 ARG 31 -0.543 -8.538 9.230 237 HB3 ARG 31 HB2 ARG 31 -0.156 -8.470 10.944 238 HG2 ARG 31 HG3 ARG 31 -2.656 -7.945 11.266 239 HG3 ARG 31 HG2 ARG 31 -2.837 -8.561 9.622 240 HD2 ARG 31 HD3 ARG 31 -3.219 -10.417 11.004 241 HD3 ARG 31 HD2 ARG 31 -1.564 -10.615 10.428 242 HE ARG 31 HE ARG 31 -1.345 -9.270 12.809 243 HH11 ARG 31 HH11 ARG 31 -2.704 -12.314 11.777 244 HH12 ARG 31 HH12 ARG 31 -2.417 -13.098 13.294 245 HH21 ARG 31 HH21 ARG 31 -0.968 -10.300 14.804 246 HH22 ARG 31 HH22 ARG 31 -1.432 -11.955 15.013 247 H ALA 32 H ALA 32 1.343 -6.149 11.506 248 HA ALA 32 HA ALA 32 0.150 -5.866 14.047 249 HB1 ALA 32 HB1 ALA 32 2.480 -4.632 14.434 250 HB2 ALA 32 HB2 ALA 32 2.846 -5.426 12.903 251 HB3 ALA 32 HB3 ALA 32 2.345 -6.385 14.296 252 H GLN 33 H GLN 33 1.026 -3.545 11.552 253 HA GLN 33 HA GLN 33 0.417 -1.260 13.201 254 HB2 GLN 33 HB3 GLN 33 1.153 -1.621 10.306 255 HB3 GLN 33 HB2 GLN 33 0.641 -0.059 10.932 256 HG2 GLN 33 HG3 GLN 33 2.490 -0.420 12.695 257 HG3 GLN 33 HG2 GLN 33 3.099 -1.634 11.570 258 HE21 GLN 33 HE21 GLN 33 2.777 -0.594 9.162 259 HE22 GLN 33 HE22 GLN 33 3.635 0.895 8.988 260 H THR 34 H THR 34 -1.165 -3.112 10.661 261 HA THR 34 HA THR 34 -3.481 -1.338 10.717 262 HB THR 34 HB THR 34 -4.299 -2.668 8.835 263 HG1 THR 34 HG1 THR 34 -1.935 -4.197 9.155 264 HG21 THR 34 HG21 THR 34 -1.774 -2.535 7.629 265 HG22 THR 34 HG22 THR 34 -1.847 -1.208 8.788 266 HG23 THR 34 HG23 THR 34 -3.084 -1.357 7.541 267 H VAL 35 H VAL 35 -2.970 -2.775 13.102 268 HA VAL 35 HA VAL 35 -4.861 -4.985 13.137 269 HB VAL 35 HB VAL 35 -2.776 -5.237 14.390 270 HG11 VAL 35 HG11 VAL 35 -3.092 -2.605 15.074 271 HG12 VAL 35 HG12 VAL 35 -1.934 -3.720 15.800 272 HG13 VAL 35 HG13 VAL 35 -3.492 -3.439 16.576 273 HG21 VAL 35 HG21 VAL 35 -3.745 -6.425 16.049 274 HG22 VAL 35 HG22 VAL 35 -5.228 -5.995 15.196 275 HG23 VAL 35 HG23 VAL 35 -4.718 -5.063 16.604 276 H GLY 36 H GLY 36 -6.712 -3.632 12.606 277 HA2 GLY 36 HA3 GLY 36 -8.752 -3.173 13.895 278 HA3 GLY 36 HA2 GLY 36 -7.751 -2.243 14.999 279 H LYS 37 H LYS 37 -7.178 -2.010 11.589 280 HA LYS 37 HA LYS 37 -8.602 0.562 11.514 281 HB2 LYS 37 HB3 LYS 37 -5.747 -0.031 10.917 282 HB3 LYS 37 HB2 LYS 37 -6.564 1.141 9.893 283 HG2 LYS 37 HG3 LYS 37 -7.076 2.525 11.785 284 HG3 LYS 37 HG2 LYS 37 -6.444 1.308 12.896 285 HD2 LYS 37 HD3 LYS 37 -4.229 1.570 11.658 286 HD3 LYS 37 HD2 LYS 37 -4.933 3.020 10.939 287 HE2 LYS 37 HE3 LYS 37 -5.484 3.377 13.590 288 HE3 LYS 37 HE2 LYS 37 -3.927 2.554 13.652 289 HZ1 LYS 37 HZ1 LYS 37 -2.870 4.277 12.622 290 HZ2 LYS 37 HZ2 LYS 37 -4.071 5.140 13.443 291 HZ3 LYS 37 HZ3 LYS 37 -4.251 4.801 11.796 292 H ILE 38 H ILE 38 -8.298 1.337 8.983 293 HA ILE 38 HA ILE 38 -9.402 -0.911 7.435 294 HB ILE 38 HB ILE 38 -9.931 1.602 6.157 295 HG12 ILE 38 HG13 ILE 38 -11.082 1.410 8.945 296 HG13 ILE 38 HG12 ILE 38 -9.751 2.477 8.511 297 HG21 ILE 38 HG21 ILE 38 -12.000 0.696 5.845 298 HG22 ILE 38 HG22 ILE 38 -12.062 -0.001 7.463 299 HG23 ILE 38 HG23 ILE 38 -11.089 -0.769 6.209 300 HD11 ILE 38 HD11 ILE 38 -11.368 3.978 8.172 301 HD12 ILE 38 HD12 ILE 38 -12.619 2.743 8.017 302 HD13 ILE 38 HD13 ILE 38 -11.594 3.139 6.638 303 H MET 39 H MET 39 -8.459 -1.519 5.581 304 HA MET 39 HA MET 39 -6.244 0.146 4.571 305 HB2 MET 39 HB3 MET 39 -5.275 -1.805 5.516 306 HB3 MET 39 HB2 MET 39 -6.489 -2.850 4.795 307 HG2 MET 39 HG3 MET 39 -4.737 -1.265 2.993 308 HG3 MET 39 HG2 MET 39 -4.056 -2.667 3.816 309 HE1 MET 39 HE1 MET 39 -6.011 -5.625 2.603 310 HE2 MET 39 HE2 MET 39 -7.083 -4.653 3.611 311 HE3 MET 39 HE3 MET 39 -5.376 -4.806 4.030 312 H VAL 40 H VAL 40 -6.358 0.786 2.521 313 HA VAL 40 HA VAL 40 -8.568 -0.156 0.871 314 HB VAL 40 HB VAL 40 -6.578 2.010 0.200 315 HG11 VAL 40 HG11 VAL 40 -7.645 1.931 -1.756 316 HG12 VAL 40 HG12 VAL 40 -9.036 2.613 -0.913 317 HG13 VAL 40 HG13 VAL 40 -8.898 0.867 -1.119 318 HG21 VAL 40 HG21 VAL 40 -8.683 3.439 0.933 319 HG22 VAL 40 HG22 VAL 40 -7.449 2.944 2.092 320 HG23 VAL 40 HG23 VAL 40 -8.960 2.044 1.975 321 H VAL 41 H VAL 41 -8.348 -1.302 -1.002 322 HA VAL 41 HA VAL 41 -5.647 -1.812 -2.006 323 HB VAL 41 HB VAL 41 -6.714 -3.628 -0.358 324 HG11 VAL 41 HG11 VAL 41 -7.976 -5.287 -1.329 325 HG12 VAL 41 HG12 VAL 41 -7.457 -4.876 -2.964 326 HG13 VAL 41 HG13 VAL 41 -8.624 -3.853 -2.126 327 HG21 VAL 41 HG21 VAL 41 -4.623 -4.224 -0.893 328 HG22 VAL 41 HG22 VAL 41 -4.803 -3.727 -2.576 329 HG23 VAL 41 HG23 VAL 41 -5.406 -5.299 -2.052 330 H GLY 42 H GLY 42 -5.516 -2.409 -4.191 331 HA2 GLY 42 HA3 GLY 42 -7.657 -1.411 -5.827 332 HA3 GLY 42 HA2 GLY 42 -6.132 -2.079 -6.397 333 H ARG 43 H ARG 43 -8.318 -2.720 -7.831 334 HA ARG 43 HA ARG 43 -9.784 -4.933 -6.994 335 HB2 ARG 43 HB3 ARG 43 -9.863 -5.355 -9.587 336 HB3 ARG 43 HB2 ARG 43 -10.713 -4.005 -8.860 337 HG2 ARG 43 HG3 ARG 43 -9.405 -2.476 -9.854 338 HG3 ARG 43 HG2 ARG 43 -7.949 -3.460 -9.706 339 HD2 ARG 43 HD3 ARG 43 -8.415 -3.319 -12.017 340 HD3 ARG 43 HD2 ARG 43 -8.921 -4.932 -11.515 341 HE ARG 43 HE ARG 43 -11.005 -2.945 -11.455 342 HH11 ARG 43 HH11 ARG 43 -9.380 -5.366 -13.374 343 HH12 ARG 43 HH12 ARG 43 -10.722 -5.599 -14.443 344 HH21 ARG 43 HH21 ARG 43 -12.772 -3.252 -12.860 345 HH22 ARG 43 HH22 ARG 43 -12.647 -4.398 -14.153 346 H ARG 44 H ARG 44 -7.009 -4.940 -9.242 347 HA ARG 44 HA ARG 44 -6.698 -7.703 -9.359 348 HB2 ARG 44 HB3 ARG 44 -5.029 -5.347 -9.995 349 HB3 ARG 44 HB2 ARG 44 -4.157 -6.854 -9.749 350 HG2 ARG 44 HG3 ARG 44 -4.722 -6.436 -12.108 351 HG3 ARG 44 HG2 ARG 44 -5.423 -7.932 -11.487 352 HD2 ARG 44 HD3 ARG 44 -6.987 -5.379 -11.453 353 HD3 ARG 44 HD2 ARG 44 -6.887 -6.350 -12.921 354 HE ARG 44 HE ARG 44 -8.431 -6.919 -10.588 355 HH11 ARG 44 HH11 ARG 44 -6.703 -8.391 -13.239 356 HH12 ARG 44 HH12 ARG 44 -7.642 -9.846 -13.207 357 HH21 ARG 44 HH21 ARG 44 -9.665 -8.832 -10.543 358 HH22 ARG 44 HH22 ARG 44 -9.324 -10.096 -11.677 359 H THR 45 H THR 45 -5.912 -5.511 -6.825 360 HA THR 45 HA THR 45 -3.877 -7.123 -5.620 361 HB THR 45 HB THR 45 -5.438 -5.109 -4.063 362 HG1 THR 45 HG1 THR 45 -5.170 -3.916 -5.843 363 HG21 THR 45 HG21 THR 45 -3.061 -4.433 -3.453 364 HG22 THR 45 HG22 THR 45 -2.567 -5.946 -4.213 365 HG23 THR 45 HG23 THR 45 -3.658 -5.970 -2.827 366 H TYR 46 H TYR 46 -7.298 -6.454 -4.766 367 HA TYR 46 HA TYR 46 -7.453 -8.071 -2.534 368 HB2 TYR 46 HB3 TYR 46 -9.829 -8.096 -2.796 369 HB3 TYR 46 HB2 TYR 46 -9.265 -6.537 -3.379 370 HD1 TYR 46 HD2 TYR 46 -9.924 -9.957 -4.775 371 HD2 TYR 46 HD1 TYR 46 -10.283 -5.744 -5.296 372 HE1 TYR 46 HE2 TYR 46 -11.090 -10.325 -6.892 373 HE2 TYR 46 HE1 TYR 46 -11.471 -6.113 -7.414 374 HH TYR 46 HH TYR 46 -11.389 -8.690 -9.152 375 H GLU 47 H GLU 47 -7.680 -8.984 -5.928 376 HA GLU 47 HA GLU 47 -8.259 -11.745 -5.337 377 HB2 GLU 47 HB3 GLU 47 -8.300 -10.051 -7.640 378 HB3 GLU 47 HB2 GLU 47 -7.292 -11.446 -7.998 379 HG2 GLU 47 HG3 GLU 47 -9.787 -12.135 -6.664 380 HG3 GLU 47 HG2 GLU 47 -10.014 -11.332 -8.217 381 H SER 48 H SER 48 -5.472 -9.777 -5.800 382 HA SER 48 HA SER 48 -3.743 -12.155 -5.929 383 HB2 SER 48 HB3 SER 48 -3.124 -9.264 -6.579 384 HB3 SER 48 HB2 SER 48 -1.963 -10.590 -6.665 385 HG SER 48 HG SER 48 -3.026 -11.431 -8.368 386 H PHE 49 H PHE 49 -5.065 -11.045 -3.501 387 HA PHE 49 HA PHE 49 -2.778 -10.080 -1.959 388 HB2 PHE 49 HB3 PHE 49 -5.356 -9.283 -1.903 389 HB3 PHE 49 HB2 PHE 49 -5.393 -10.498 -0.629 390 HD1 PHE 49 HD1 PHE 49 -3.162 -7.710 -1.729 391 HD2 PHE 49 HD2 PHE 49 -5.064 -9.728 1.498 392 HE1 PHE 49 HE1 PHE 49 -2.213 -6.077 -0.153 393 HE2 PHE 49 HE2 PHE 49 -4.120 -8.099 3.080 394 HZ PHE 49 HZ PHE 49 -2.692 -6.270 2.256 395 HA PRO 50 HA PRO 50 -2.112 -14.102 -0.218 396 HB2 PRO 50 HB3 PRO 50 -0.487 -13.459 1.814 397 HB3 PRO 50 HB2 PRO 50 0.029 -13.298 0.131 398 HG2 PRO 50 HG3 PRO 50 -0.943 -11.195 2.025 399 HG3 PRO 50 HG2 PRO 50 0.403 -11.127 0.873 400 HD2 PRO 50 HD3 PRO 50 -2.082 -10.060 0.397 401 HD3 PRO 50 HD2 PRO 50 -0.968 -10.589 -0.879 402 H LYS 51 H LYS 51 -3.286 -11.480 1.815 403 HA LYS 51 HA LYS 51 -4.740 -13.458 3.429 404 HB2 LYS 51 HB3 LYS 51 -3.291 -11.032 4.507 405 HB3 LYS 51 HB2 LYS 51 -4.330 -12.093 5.448 406 HG2 LYS 51 HG3 LYS 51 -1.995 -13.234 3.985 407 HG3 LYS 51 HG2 LYS 51 -1.750 -12.391 5.516 408 HD2 LYS 51 HD3 LYS 51 -2.613 -14.082 6.709 409 HD3 LYS 51 HD2 LYS 51 -3.951 -14.311 5.582 410 HE2 LYS 51 HE3 LYS 51 -2.877 -15.927 4.433 411 HE3 LYS 51 HE2 LYS 51 -1.309 -15.134 4.584 412 HZ1 LYS 51 HZ1 LYS 51 -2.592 -17.072 6.353 413 HZ2 LYS 51 HZ2 LYS 51 -1.643 -15.876 7.080 414 HZ3 LYS 51 HZ3 LYS 51 -0.962 -16.909 5.927 415 H ARG 52 H ARG 52 -6.498 -12.899 1.997 416 HA ARG 52 HA ARG 52 -7.717 -10.305 2.670 417 HB2 ARG 52 HB3 ARG 52 -8.876 -10.477 0.451 418 HB3 ARG 52 HB2 ARG 52 -7.134 -10.253 0.358 419 HG2 ARG 52 HG3 ARG 52 -6.892 -12.118 -0.810 420 HG3 ARG 52 HG2 ARG 52 -7.770 -13.052 0.402 421 HD2 ARG 52 HD3 ARG 52 -9.871 -12.521 -0.610 422 HD3 ARG 52 HD2 ARG 52 -9.112 -11.367 -1.703 423 HE ARG 52 HE ARG 52 -8.373 -13.120 -3.023 424 HH11 ARG 52 HH11 ARG 52 -9.846 -14.350 -0.102 425 HH12 ARG 52 HH12 ARG 52 -9.944 -15.975 -0.691 426 HH21 ARG 52 HH21 ARG 52 -8.501 -15.257 -3.792 427 HH22 ARG 52 HH22 ARG 52 -9.181 -16.490 -2.782 428 HA PRO 53 HA PRO 53 -8.974 -9.497 3.659 429 HB2 PRO 53 HB3 PRO 53 -10.636 -9.153 5.720 430 HB3 PRO 53 HB2 PRO 53 -11.221 -9.116 4.053 431 HG2 PRO 53 HG3 PRO 53 -11.488 -11.245 6.107 432 HG3 PRO 53 HG2 PRO 53 -12.595 -10.795 4.799 433 HD2 PRO 53 HD3 PRO 53 -10.737 -12.928 4.796 434 HD3 PRO 53 HD2 PRO 53 -11.672 -12.329 3.413 435 H LEU 54 H LEU 54 -7.800 -8.582 5.406 436 HA LEU 54 HA LEU 54 -6.189 -10.409 6.858 437 HB2 LEU 54 HB3 LEU 54 -6.493 -7.422 6.905 438 HB3 LEU 54 HB2 LEU 54 -5.427 -8.247 8.027 439 HG LEU 54 HG LEU 54 -5.063 -8.893 5.161 440 HD11 LEU 54 HD11 LEU 54 -3.885 -6.900 4.630 441 HD12 LEU 54 HD12 LEU 54 -4.059 -6.284 6.273 442 HD13 LEU 54 HD13 LEU 54 -5.473 -6.420 5.227 443 HD21 LEU 54 HD21 LEU 54 -3.174 -8.283 7.430 444 HD22 LEU 54 HD22 LEU 54 -2.711 -8.852 5.827 445 HD23 LEU 54 HD23 LEU 54 -3.663 -9.888 6.889 446 HA PRO 55 HA PRO 55 -8.722 -10.954 10.447 447 HB2 PRO 55 HB3 PRO 55 -6.330 -11.546 12.010 448 HB3 PRO 55 HB2 PRO 55 -7.624 -12.630 11.497 449 HG2 PRO 55 HG3 PRO 55 -5.116 -12.762 10.484 450 HG3 PRO 55 HG2 PRO 55 -6.556 -13.196 9.546 451 HD2 PRO 55 HD3 PRO 55 -4.943 -10.673 9.485 452 HD3 PRO 55 HD2 PRO 55 -5.652 -11.593 8.141 453 H GLU 56 H GLU 56 -9.302 -10.016 12.371 454 HA GLU 56 HA GLU 56 -9.595 -8.311 13.838 455 HB2 GLU 56 HB3 GLU 56 -6.870 -9.245 14.079 456 HB3 GLU 56 HB2 GLU 56 -6.998 -7.555 14.545 457 HG2 GLU 56 HG3 GLU 56 -8.449 -8.011 16.290 458 HG3 GLU 56 HG2 GLU 56 -8.923 -9.571 15.619 459 H ARG 57 H ARG 57 -9.294 -7.529 11.002 460 HA ARG 57 HA ARG 57 -8.920 -4.701 11.508 461 HB2 ARG 57 HB3 ARG 57 -7.248 -4.280 9.919 462 HB3 ARG 57 HB2 ARG 57 -6.675 -5.686 10.801 463 HG2 ARG 57 HG3 ARG 57 -6.224 -6.308 8.650 464 HG3 ARG 57 HG2 ARG 57 -7.826 -7.011 8.869 465 HD2 ARG 57 HD3 ARG 57 -7.301 -5.653 6.717 466 HD3 ARG 57 HD2 ARG 57 -8.847 -5.432 7.529 467 HE ARG 57 HE ARG 57 -8.248 -3.276 8.008 468 HH11 ARG 57 HH11 ARG 57 -5.401 -5.051 7.053 469 HH12 ARG 57 HH12 ARG 57 -4.393 -3.644 6.989 470 HH21 ARG 57 HH21 ARG 57 -6.929 -1.427 7.924 471 HH22 ARG 57 HH22 ARG 57 -5.261 -1.584 7.484 472 H THR 58 H THR 58 -9.522 -3.373 9.549 473 HA THR 58 HA THR 58 -11.819 -4.651 8.240 474 HB THR 58 HB THR 58 -11.188 -1.703 8.489 475 HG1 THR 58 HG1 THR 58 -13.044 -3.231 9.987 476 HG21 THR 58 HG21 THR 58 -13.547 -1.365 7.990 477 HG22 THR 58 HG22 THR 58 -13.745 -3.100 7.742 478 HG23 THR 58 HG23 THR 58 -12.711 -2.167 6.660 479 H ASN 59 H ASN 59 -11.663 -5.183 6.164 480 HA ASN 59 HA ASN 59 -9.436 -4.105 4.612 481 HB2 ASN 59 HB3 ASN 59 -11.266 -6.457 4.121 482 HB3 ASN 59 HB2 ASN 59 -9.997 -5.944 3.012 483 HD21 ASN 59 HD21 ASN 59 -10.461 -6.744 6.432 484 HD22 ASN 59 HD22 ASN 59 -8.974 -7.599 6.613 485 H VAL 60 H VAL 60 -9.649 -2.865 2.868 486 HA VAL 60 HA VAL 60 -12.371 -2.261 1.918 487 HB VAL 60 HB VAL 60 -10.032 -0.362 2.173 488 HG11 VAL 60 HG11 VAL 60 -12.146 1.203 1.535 489 HG12 VAL 60 HG12 VAL 60 -12.497 -0.235 0.575 490 HG13 VAL 60 HG13 VAL 60 -10.963 0.610 0.369 491 HG21 VAL 60 HG21 VAL 60 -12.122 -1.080 3.963 492 HG22 VAL 60 HG22 VAL 60 -12.388 0.581 3.434 493 HG23 VAL 60 HG23 VAL 60 -10.854 0.127 4.175 494 H VAL 61 H VAL 61 -12.705 -2.394 -0.237 495 HA VAL 61 HA VAL 61 -10.346 -2.925 -1.924 496 HB VAL 61 HB VAL 61 -13.125 -4.066 -2.238 497 HG11 VAL 61 HG11 VAL 61 -11.906 -5.546 -3.917 498 HG12 VAL 61 HG12 VAL 61 -10.616 -4.344 -3.866 499 HG13 VAL 61 HG13 VAL 61 -12.231 -3.882 -4.402 500 HG21 VAL 61 HG21 VAL 61 -10.558 -5.400 -1.382 501 HG22 VAL 61 HG22 VAL 61 -12.110 -6.200 -1.632 502 HG23 VAL 61 HG23 VAL 61 -11.925 -5.022 -0.333 503 H LEU 62 H LEU 62 -10.301 -2.123 -4.004 504 HA LEU 62 HA LEU 62 -12.412 -0.225 -4.758 505 HB2 LEU 62 HB3 LEU 62 -10.369 0.913 -3.780 506 HB3 LEU 62 HB2 LEU 62 -9.467 0.305 -5.155 507 HG LEU 62 HG LEU 62 -11.498 1.552 -6.441 508 HD11 LEU 62 HD11 LEU 62 -12.457 3.236 -5.321 509 HD12 LEU 62 HD12 LEU 62 -10.957 3.666 -4.494 510 HD13 LEU 62 HD13 LEU 62 -11.961 2.354 -3.875 511 HD21 LEU 62 HD21 LEU 62 -9.924 3.442 -6.734 512 HD22 LEU 62 HD22 LEU 62 -9.169 1.862 -6.958 513 HD23 LEU 62 HD23 LEU 62 -8.917 2.757 -5.458 514 H THR 63 H THR 63 -13.301 -1.217 -6.467 515 HA THR 63 HA THR 63 -11.531 -2.035 -8.661 516 HB THR 63 HB THR 63 -12.306 -4.069 -7.566 517 HG1 THR 63 HG1 THR 63 -13.390 -4.990 -9.363 518 HG21 THR 63 HG21 THR 63 -14.883 -4.493 -7.910 519 HG22 THR 63 HG22 THR 63 -14.953 -2.744 -7.691 520 HG23 THR 63 HG23 THR 63 -14.249 -3.763 -6.435 521 H HIS 64 H HIS 64 -12.459 -1.821 -10.778 522 HA HIS 64 HA HIS 64 -14.182 0.442 -11.013 523 HB2 HIS 64 HB3 HIS 64 -12.621 -1.268 -12.838 524 HB3 HIS 64 HB2 HIS 64 -14.074 -0.571 -13.543 525 HD1 HIS 64 HD1 HIS 64 -13.677 2.126 -11.712 526 HD2 HIS 64 HD2 HIS 64 -11.027 0.422 -14.416 527 HE1 HIS 64 HE1 HIS 64 -12.147 3.990 -12.420 528 HE2 HIS 64 HE2 HIS 64 -10.492 2.913 -13.983 529 H GLN 65 H GLN 65 -14.620 -3.016 -11.169 530 HA GLN 65 HA GLN 65 -17.015 -3.213 -12.544 531 HB2 GLN 65 HB3 GLN 65 -15.839 -4.817 -10.293 532 HB3 GLN 65 HB2 GLN 65 -17.417 -5.217 -10.958 533 HG2 GLN 65 HG3 GLN 65 -16.559 -6.008 -12.892 534 HG3 GLN 65 HG2 GLN 65 -15.215 -4.866 -12.894 535 HE21 GLN 65 HE21 GLN 65 -13.467 -5.282 -11.370 536 HE22 GLN 65 HE22 GLN 65 -13.067 -6.917 -10.983 537 H GLU 66 H GLU 66 -19.037 -2.603 -12.162 538 HA GLU 66 HA GLU 66 -19.646 -1.189 -9.712 539 HB2 GLU 66 HB3 GLU 66 -21.849 -0.768 -10.859 540 HB3 GLU 66 HB2 GLU 66 -20.435 -0.156 -11.706 541 HG2 GLU 66 HG3 GLU 66 -21.237 -2.869 -12.466 542 HG3 GLU 66 HG2 GLU 66 -22.416 -1.613 -12.841 543 H ASP 67 H ASP 67 -20.455 -4.232 -11.244 544 HA ASP 67 HA ASP 67 -22.381 -4.830 -9.122 545 HB2 ASP 67 HB3 ASP 67 -21.785 -6.186 -11.750 546 HB3 ASP 67 HB2 ASP 67 -22.894 -6.845 -10.552 547 H TYR 68 H TYR 68 -19.292 -4.912 -8.948 548 HA TYR 68 HA TYR 68 -18.811 -7.722 -8.441 549 HB2 TYR 68 HB3 TYR 68 -17.013 -6.293 -9.348 550 HB3 TYR 68 HB2 TYR 68 -17.038 -5.337 -7.869 551 HD1 TYR 68 HD2 TYR 68 -16.202 -6.286 -5.765 552 HD2 TYR 68 HD1 TYR 68 -15.992 -8.472 -9.408 553 HE1 TYR 68 HE2 TYR 68 -14.594 -7.836 -4.735 554 HE2 TYR 68 HE1 TYR 68 -14.386 -10.030 -8.388 555 HH TYR 68 HH TYR 68 -13.852 -10.220 -5.093 556 H GLN 69 H GLN 69 -18.541 -8.693 -6.454 557 HA GLN 69 HA GLN 69 -19.193 -7.062 -4.094 558 HB2 GLN 69 HB3 GLN 69 -20.199 -9.875 -4.506 559 HB3 GLN 69 HB2 GLN 69 -20.665 -8.738 -3.247 560 HG2 GLN 69 HG3 GLN 69 -21.197 -8.275 -6.168 561 HG3 GLN 69 HG2 GLN 69 -22.334 -9.076 -5.085 562 HE21 GLN 69 HE21 GLN 69 -21.922 -6.315 -6.567 563 HE22 GLN 69 HE22 GLN 69 -22.523 -5.195 -5.396 564 H ALA 70 H ALA 70 -17.513 -7.088 -2.781 565 HA ALA 70 HA ALA 70 -15.763 -9.438 -2.703 566 HB1 ALA 70 HB1 ALA 70 -14.998 -6.940 -3.013 567 HB2 ALA 70 HB2 ALA 70 -14.039 -8.073 -2.062 568 HB3 ALA 70 HB3 ALA 70 -15.103 -6.922 -1.253 569 H GLN 71 H GLN 71 -16.534 -10.887 -1.293 570 HA GLN 71 HA GLN 71 -17.971 -10.221 1.061 571 HB2 GLN 71 HB3 GLN 71 -16.716 -12.773 0.065 572 HB3 GLN 71 HB2 GLN 71 -17.544 -12.682 1.614 573 HG2 GLN 71 HG3 GLN 71 -19.062 -13.543 -0.008 574 HG3 GLN 71 HG2 GLN 71 -19.577 -11.913 0.425 575 HE21 GLN 71 HE21 GLN 71 -20.448 -11.032 -1.309 576 HE22 GLN 71 HE22 GLN 71 -19.773 -11.038 -2.899 577 H GLY 72 H GLY 72 -17.237 -9.622 2.984 578 HA2 GLY 72 HA3 GLY 72 -15.804 -9.955 4.873 579 HA3 GLY 72 HA2 GLY 72 -14.522 -10.429 3.770 580 H ALA 73 H ALA 73 -15.052 -8.120 1.954 581 HA ALA 73 HA ALA 73 -14.067 -5.963 3.709 582 HB1 ALA 73 HB1 ALA 73 -12.212 -6.974 2.466 583 HB2 ALA 73 HB2 ALA 73 -12.494 -5.304 1.976 584 HB3 ALA 73 HB3 ALA 73 -13.046 -6.629 0.951 585 H VAL 74 H VAL 74 -14.191 -3.783 2.622 586 HA VAL 74 HA VAL 74 -16.861 -3.440 1.556 587 HB VAL 74 HB VAL 74 -14.792 -1.287 1.999 588 HG11 VAL 74 HG11 VAL 74 -17.661 -1.355 1.324 589 HG12 VAL 74 HG12 VAL 74 -16.427 -0.160 0.926 590 HG13 VAL 74 HG13 VAL 74 -17.176 -0.157 2.523 591 HG21 VAL 74 HG21 VAL 74 -16.783 -2.423 3.960 592 HG22 VAL 74 HG22 VAL 74 -15.858 -0.941 4.206 593 HG23 VAL 74 HG23 VAL 74 -15.025 -2.491 4.079 594 H VAL 75 H VAL 75 -17.384 -2.560 -0.460 595 HA VAL 75 HA VAL 75 -15.163 -2.466 -2.396 596 HB VAL 75 HB VAL 75 -17.969 -3.402 -2.993 597 HG11 VAL 75 HG11 VAL 75 -16.658 -4.336 -5.032 598 HG12 VAL 75 HG12 VAL 75 -15.468 -3.106 -4.605 599 HG13 VAL 75 HG13 VAL 75 -17.119 -2.634 -5.004 600 HG21 VAL 75 HG21 VAL 75 -16.372 -5.572 -3.353 601 HG22 VAL 75 HG22 VAL 75 -17.331 -5.262 -1.906 602 HG23 VAL 75 HG23 VAL 75 -15.624 -4.820 -1.945 603 H VAL 76 H VAL 76 -15.084 -0.784 -3.778 604 HA VAL 76 HA VAL 76 -17.384 0.974 -4.084 605 HB VAL 76 HB VAL 76 -15.808 2.978 -3.725 606 HG11 VAL 76 HG11 VAL 76 -16.205 2.831 -1.191 607 HG12 VAL 76 HG12 VAL 76 -17.010 1.305 -1.555 608 HG13 VAL 76 HG13 VAL 76 -17.601 2.807 -2.267 609 HG21 VAL 76 HG21 VAL 76 -14.032 2.627 -2.081 610 HG22 VAL 76 HG22 VAL 76 -13.738 1.713 -3.560 611 HG23 VAL 76 HG23 VAL 76 -14.339 0.890 -2.120 612 H HIS 77 H HIS 77 -17.342 2.202 -5.945 613 HA HIS 77 HA HIS 77 -15.046 1.775 -7.733 614 HB2 HIS 77 HB3 HIS 77 -17.530 2.139 -9.192 615 HB3 HIS 77 HB2 HIS 77 -16.329 0.863 -9.337 616 HD1 HIS 77 HD1 HIS 77 -16.619 -1.123 -7.475 617 HD2 HIS 77 HD2 HIS 77 -19.905 1.321 -8.178 618 HE1 HIS 77 HE1 HIS 77 -18.602 -2.392 -6.591 619 HE2 HIS 77 HE2 HIS 77 -20.588 -0.929 -7.100 620 H ASP 78 H ASP 78 -14.784 3.937 -6.366 621 HA ASP 78 HA ASP 78 -15.029 6.018 -8.242 622 HB2 ASP 78 HB3 ASP 78 -17.190 5.760 -6.313 623 HB3 ASP 78 HB2 ASP 78 -16.370 7.311 -6.167 624 H VAL 79 H VAL 79 -13.683 7.759 -7.722 625 HA VAL 79 HA VAL 79 -11.684 7.201 -5.779 626 HB VAL 79 HB VAL 79 -11.196 9.799 -6.310 627 HG11 VAL 79 HG11 VAL 79 -10.396 8.062 -8.529 628 HG12 VAL 79 HG12 VAL 79 -10.060 7.411 -6.925 629 HG13 VAL 79 HG13 VAL 79 -9.412 8.984 -7.393 630 HG21 VAL 79 HG21 VAL 79 -12.454 8.834 -8.865 631 HG22 VAL 79 HG22 VAL 79 -11.813 10.436 -8.501 632 HG23 VAL 79 HG23 VAL 79 -13.294 9.881 -7.722 633 H ALA 80 H ALA 80 -14.166 9.695 -6.024 634 HA ALA 80 HA ALA 80 -13.709 10.740 -3.418 635 HB1 ALA 80 HB1 ALA 80 -16.171 11.037 -5.135 636 HB2 ALA 80 HB2 ALA 80 -14.727 12.042 -5.264 637 HB3 ALA 80 HB3 ALA 80 -15.689 12.065 -3.786 638 H ALA 81 H ALA 81 -15.521 8.065 -4.662 639 HA ALA 81 HA ALA 81 -17.495 7.800 -2.698 640 HB1 ALA 81 HB1 ALA 81 -17.759 6.373 -4.512 641 HB2 ALA 81 HB2 ALA 81 -17.213 5.280 -3.240 642 HB3 ALA 81 HB3 ALA 81 -16.077 5.842 -4.466 643 H VAL 82 H VAL 82 -14.549 5.806 -2.868 644 HA VAL 82 HA VAL 82 -14.557 4.823 -0.324 645 HB VAL 82 HB VAL 82 -12.973 4.300 -2.270 646 HG11 VAL 82 HG11 VAL 82 -11.259 6.383 -0.943 647 HG12 VAL 82 HG12 VAL 82 -12.129 6.640 -2.456 648 HG13 VAL 82 HG13 VAL 82 -10.872 5.410 -2.360 649 HG21 VAL 82 HG21 VAL 82 -12.881 3.238 -0.032 650 HG22 VAL 82 HG22 VAL 82 -11.735 4.480 0.471 651 HG23 VAL 82 HG23 VAL 82 -11.308 3.357 -0.820 652 H PHE 83 H PHE 83 -13.147 7.924 -1.404 653 HA PHE 83 HA PHE 83 -11.970 8.640 1.022 654 HB2 PHE 83 HB3 PHE 83 -12.799 10.049 -1.426 655 HB3 PHE 83 HB2 PHE 83 -12.753 11.061 0.015 656 HD1 PHE 83 HD2 PHE 83 -10.517 10.038 1.516 657 HD2 PHE 83 HD1 PHE 83 -10.936 10.543 -2.688 658 HE1 PHE 83 HE2 PHE 83 -8.075 10.236 1.302 659 HE2 PHE 83 HE1 PHE 83 -8.492 10.739 -2.911 660 HZ PHE 83 HZ PHE 83 -7.059 10.586 -0.913 661 H ALA 84 H ALA 84 -15.291 9.089 -0.114 662 HA ALA 84 HA ALA 84 -16.178 10.633 2.080 663 HB1 ALA 84 HB1 ALA 84 -18.382 10.202 1.330 664 HB2 ALA 84 HB2 ALA 84 -17.896 8.710 0.524 665 HB3 ALA 84 HB3 ALA 84 -17.387 10.268 -0.124 666 H TYR 85 H TYR 85 -15.903 7.205 1.476 667 HA TYR 85 HA TYR 85 -17.258 6.258 3.747 668 HB2 TYR 85 HB3 TYR 85 -16.747 4.273 2.837 669 HB3 TYR 85 HB2 TYR 85 -15.788 5.113 1.630 670 HD1 TYR 85 HD1 TYR 85 -15.459 3.867 5.149 671 HD2 TYR 85 HD2 TYR 85 -13.599 4.466 1.372 672 HE1 TYR 85 HE1 TYR 85 -13.435 2.736 5.971 673 HE2 TYR 85 HE2 TYR 85 -11.572 3.339 2.181 674 HH TYR 85 HH TYR 85 -10.700 2.076 3.837 675 H ALA 86 H ALA 86 -13.718 6.594 3.291 676 HA ALA 86 HA ALA 86 -12.836 6.142 5.808 677 HB1 ALA 86 HB1 ALA 86 -11.616 8.518 4.561 678 HB2 ALA 86 HB2 ALA 86 -11.665 7.060 3.571 679 HB3 ALA 86 HB3 ALA 86 -10.870 7.031 5.145 680 H LYS 87 H LYS 87 -14.513 9.022 4.714 681 HA LYS 87 HA LYS 87 -13.984 10.595 7.029 682 HB2 LYS 87 HB3 LYS 87 -15.226 11.005 4.567 683 HB3 LYS 87 HB2 LYS 87 -16.532 11.171 5.732 684 HG2 LYS 87 HG3 LYS 87 -15.842 13.303 5.811 685 HG3 LYS 87 HG2 LYS 87 -14.630 12.665 6.924 686 HD2 LYS 87 HD3 LYS 87 -13.346 12.214 4.635 687 HD3 LYS 87 HD2 LYS 87 -14.347 13.570 4.112 688 HE2 LYS 87 HE3 LYS 87 -12.310 14.495 4.892 689 HE3 LYS 87 HE2 LYS 87 -13.518 14.818 6.135 690 HZ1 LYS 87 HZ1 LYS 87 -11.426 12.714 6.178 691 HZ2 LYS 87 HZ2 LYS 87 -12.676 12.819 7.312 692 HZ3 LYS 87 HZ3 LYS 87 -11.539 14.065 7.191 693 H GLN 88 H GLN 88 -16.653 8.552 5.994 694 HA GLN 88 HA GLN 88 -18.344 8.896 8.188 695 HB2 GLN 88 HB3 GLN 88 -18.665 7.627 5.906 696 HB3 GLN 88 HB2 GLN 88 -18.161 6.230 6.847 697 HG2 GLN 88 HG3 GLN 88 -20.083 6.150 8.017 698 HG3 GLN 88 HG2 GLN 88 -20.265 7.904 8.049 699 HE21 GLN 88 HE21 GLN 88 -20.629 8.820 5.740 700 HE22 GLN 88 HE22 GLN 88 -21.849 8.011 4.822 701 H HIS 89 H HIS 89 -15.345 7.254 7.985 702 HA HIS 89 HA HIS 89 -15.881 5.824 10.496 703 HB2 HIS 89 HB3 HIS 89 -14.182 5.267 8.141 704 HB3 HIS 89 HB2 HIS 89 -13.473 4.868 9.703 705 HD1 HIS 89 HD1 HIS 89 -15.927 3.775 11.165 706 HD2 HIS 89 HD2 HIS 89 -14.966 2.832 7.234 707 HE1 HIS 89 HE1 HIS 89 -17.065 1.580 10.702 708 HE2 HIS 89 HE2 HIS 89 -16.544 1.075 8.291 709 HA PRO 90 HA PRO 90 -13.133 9.381 11.682 710 HB2 PRO 90 HB3 PRO 90 -14.508 10.124 13.876 711 HB3 PRO 90 HB2 PRO 90 -14.965 10.661 12.255 712 HG2 PRO 90 HG3 PRO 90 -16.119 8.447 13.911 713 HG3 PRO 90 HG2 PRO 90 -16.960 9.677 12.950 714 HD2 PRO 90 HD3 PRO 90 -16.546 7.141 12.066 715 HD3 PRO 90 HD2 PRO 90 -16.633 8.541 10.979 716 H ASP 91 H ASP 91 -13.953 6.374 12.919 717 HA ASP 91 HA ASP 91 -12.149 6.667 15.226 718 HB2 ASP 91 HB3 ASP 91 -14.525 5.823 15.573 719 HB3 ASP 91 HB2 ASP 91 -14.030 4.366 14.717 720 H GLN 92 H GLN 92 -11.868 5.899 12.131 721 HA GLN 92 HA GLN 92 -9.805 3.881 12.661 722 HB2 GLN 92 HB3 GLN 92 -12.221 3.350 11.351 723 HB3 GLN 92 HB2 GLN 92 -11.028 3.487 10.068 724 HG2 GLN 92 HG3 GLN 92 -10.029 1.566 10.619 725 HG3 GLN 92 HG2 GLN 92 -10.159 1.877 12.349 726 HE21 GLN 92 HE21 GLN 92 -10.949 -0.295 10.172 727 HE22 GLN 92 HE22 GLN 92 -12.467 -0.854 10.779 728 H GLU 93 H GLU 93 -8.411 3.595 10.596 729 HA GLU 93 HA GLU 93 -8.019 6.206 9.296 730 HB2 GLU 93 HB3 GLU 93 -6.152 4.659 10.956 731 HB3 GLU 93 HB2 GLU 93 -5.479 5.185 9.419 732 HG2 GLU 93 HG3 GLU 93 -6.792 7.422 10.416 733 HG3 GLU 93 HG2 GLU 93 -6.008 6.695 11.818 734 H LEU 94 H LEU 94 -7.014 6.141 7.218 735 HA LEU 94 HA LEU 94 -7.494 3.601 5.831 736 HB2 LEU 94 HB3 LEU 94 -7.850 6.410 5.157 737 HB3 LEU 94 HB2 LEU 94 -6.988 5.536 3.906 738 HG LEU 94 HG LEU 94 -8.826 3.924 3.747 739 HD11 LEU 94 HD11 LEU 94 -9.796 5.437 6.104 740 HD12 LEU 94 HD12 LEU 94 -9.908 3.716 5.734 741 HD13 LEU 94 HD13 LEU 94 -10.997 4.860 4.949 742 HD21 LEU 94 HD21 LEU 94 -9.534 6.837 3.490 743 HD22 LEU 94 HD22 LEU 94 -10.571 5.537 2.902 744 HD23 LEU 94 HD23 LEU 94 -8.951 5.742 2.236 745 H VAL 95 H VAL 95 -5.911 2.496 4.835 746 HA VAL 95 HA VAL 95 -3.289 3.767 4.495 747 HB VAL 95 HB VAL 95 -3.607 1.005 5.670 748 HG11 VAL 95 HG11 VAL 95 -1.172 2.773 5.478 749 HG12 VAL 95 HG12 VAL 95 -1.550 1.471 4.351 750 HG13 VAL 95 HG13 VAL 95 -1.238 1.105 6.047 751 HG21 VAL 95 HG21 VAL 95 -3.505 3.665 6.949 752 HG22 VAL 95 HG22 VAL 95 -2.479 2.417 7.657 753 HG23 VAL 95 HG23 VAL 95 -4.217 2.156 7.520 754 H ILE 96 H ILE 96 -3.038 3.709 2.351 755 HA ILE 96 HA ILE 96 -4.162 1.701 0.675 756 HB ILE 96 HB ILE 96 -1.910 3.536 -0.119 757 HG12 ILE 96 HG13 ILE 96 -3.524 4.977 0.934 758 HG13 ILE 96 HG12 ILE 96 -3.704 5.150 -0.808 759 HG21 ILE 96 HG21 ILE 96 -4.232 2.451 -1.703 760 HG22 ILE 96 HG22 ILE 96 -2.619 1.740 -1.673 761 HG23 ILE 96 HG23 ILE 96 -2.855 3.363 -2.321 762 HD11 ILE 96 HD11 ILE 96 -5.650 3.703 -0.767 763 HD12 ILE 96 HD12 ILE 96 -5.856 5.067 0.332 764 HD13 ILE 96 HD13 ILE 96 -5.457 3.472 0.970 765 H ALA 97 H ALA 97 -3.408 -0.265 0.264 766 HA ALA 97 HA ALA 97 -0.596 -0.848 0.900 767 HB1 ALA 97 HB1 ALA 97 -2.523 -2.071 2.073 768 HB2 ALA 97 HB2 ALA 97 -1.198 -3.039 1.427 769 HB3 ALA 97 HB3 ALA 97 -2.723 -2.932 0.547 770 H GLY 98 H GLY 98 -2.978 -0.884 -1.639 771 HA2 GLY 98 HA3 GLY 98 -1.191 -0.929 -3.738 772 HA3 GLY 98 HA2 GLY 98 -1.545 -2.617 -3.406 773 H GLY 99 H GLY 99 -3.899 -1.714 -6.015 774 HA2 GLY 99 HA3 GLY 99 -1.111 -2.239 -5.421 775 HA3 GLY 99 HA2 GLY 99 -1.916 -2.451 -6.964 776 H ALA 100 H ALA 100 -0.085 -1.478 -7.958 777 HA ALA 100 HA ALA 100 0.927 1.054 -7.379 778 HB1 ALA 100 HB1 ALA 100 0.852 0.102 -10.200 779 HB2 ALA 100 HB2 ALA 100 1.748 -0.830 -9.001 780 HB3 ALA 100 HB3 ALA 100 2.165 0.857 -9.297 781 H GLN 101 H GLN 101 -1.781 0.114 -9.459 782 HA GLN 101 HA GLN 101 -2.189 2.632 -10.649 783 HB2 GLN 101 HB3 GLN 101 -3.551 0.081 -10.543 784 HB3 GLN 101 HB2 GLN 101 -4.701 1.409 -10.470 785 HG2 GLN 101 HG3 GLN 101 -3.942 2.294 -12.533 786 HG3 GLN 101 HG2 GLN 101 -2.550 1.213 -12.557 787 HE21 GLN 101 HE21 GLN 101 -3.522 -1.196 -12.051 788 HE22 GLN 101 HE22 GLN 101 -4.694 -1.672 -13.227 789 H ILE 102 H ILE 102 -3.384 1.204 -7.658 790 HA ILE 102 HA ILE 102 -5.248 3.238 -7.040 791 HB ILE 102 HB ILE 102 -3.774 1.579 -5.001 792 HG12 ILE 102 HG13 ILE 102 -4.541 0.001 -6.634 793 HG13 ILE 102 HG12 ILE 102 -5.669 -0.059 -5.284 794 HG21 ILE 102 HG21 ILE 102 -6.633 2.493 -4.948 795 HG22 ILE 102 HG22 ILE 102 -5.314 3.499 -4.347 796 HG23 ILE 102 HG23 ILE 102 -5.631 1.928 -3.611 797 HD11 ILE 102 HD11 ILE 102 -7.103 1.553 -6.639 798 HD12 ILE 102 HD12 ILE 102 -7.004 -0.119 -7.193 799 HD13 ILE 102 HD13 ILE 102 -6.064 1.135 -8.001 800 H PHE 103 H PHE 103 -1.876 2.707 -6.054 801 HA PHE 103 HA PHE 103 -1.561 4.860 -4.345 802 HB2 PHE 103 HB3 PHE 103 0.426 3.621 -6.258 803 HB3 PHE 103 HB2 PHE 103 0.862 4.779 -5.007 804 HD1 PHE 103 HD2 PHE 103 -0.875 3.831 -2.789 805 HD2 PHE 103 HD1 PHE 103 1.511 1.680 -5.581 806 HE1 PHE 103 HE2 PHE 103 -0.645 1.992 -1.171 807 HE2 PHE 103 HE1 PHE 103 1.745 -0.162 -3.968 808 HZ PHE 103 HZ PHE 103 0.667 -0.007 -1.759 809 H THR 104 H THR 104 -1.590 4.769 -7.845 810 HA THR 104 HA THR 104 -0.532 7.324 -8.342 811 HB THR 104 HB THR 104 -2.570 5.838 -10.003 812 HG1 THR 104 HG1 THR 104 -0.870 4.803 -10.931 813 HG21 THR 104 HG21 THR 104 -2.202 7.258 -11.672 814 HG22 THR 104 HG22 THR 104 -0.468 7.324 -11.356 815 HG23 THR 104 HG23 THR 104 -1.572 8.341 -10.430 816 H ALA 105 H ALA 105 -3.938 6.258 -8.170 817 HA ALA 105 HA ALA 105 -5.130 8.724 -8.612 818 HB1 ALA 105 HB1 ALA 105 -7.115 7.775 -7.911 819 HB2 ALA 105 HB2 ALA 105 -6.333 6.811 -6.658 820 HB3 ALA 105 HB3 ALA 105 -6.166 6.355 -8.354 821 H PHE 106 H PHE 106 -4.558 7.247 -5.386 822 HA PHE 106 HA PHE 106 -5.231 9.629 -4.030 823 HB2 PHE 106 HB3 PHE 106 -3.684 7.221 -3.061 824 HB3 PHE 106 HB2 PHE 106 -4.356 8.480 -2.034 825 HD1 PHE 106 HD2 PHE 106 -5.191 5.708 -4.309 826 HD2 PHE 106 HD1 PHE 106 -6.650 8.488 -1.440 827 HE1 PHE 106 HE2 PHE 106 -7.311 4.463 -4.192 828 HE2 PHE 106 HE1 PHE 106 -8.772 7.245 -1.315 829 HZ PHE 106 HZ PHE 106 -9.098 5.230 -2.694 830 H LYS 107 H LYS 107 -2.402 8.747 -5.715 831 HA LYS 107 HA LYS 107 -0.295 9.709 -4.287 832 HB2 LYS 107 HB3 LYS 107 0.858 9.808 -6.251 833 HB3 LYS 107 HB2 LYS 107 -0.549 8.930 -6.826 834 HG2 LYS 107 HG3 LYS 107 -1.483 10.921 -7.780 835 HG3 LYS 107 HG2 LYS 107 -0.235 11.920 -7.036 836 HD2 LYS 107 HD3 LYS 107 1.417 10.450 -8.366 837 HD3 LYS 107 HD2 LYS 107 0.004 9.997 -9.321 838 HE2 LYS 107 HE3 LYS 107 0.143 12.859 -8.926 839 HE3 LYS 107 HE2 LYS 107 1.621 12.241 -9.662 840 HZ1 LYS 107 HZ1 LYS 107 0.423 12.466 -11.535 841 HZ2 LYS 107 HZ2 LYS 107 -1.069 12.381 -10.742 842 HZ3 LYS 107 HZ3 LYS 107 -0.219 10.963 -11.095 843 H ASP 108 H ASP 108 -2.748 11.618 -5.930 844 HA ASP 108 HA ASP 108 -1.497 14.119 -5.140 845 HB2 ASP 108 HB3 ASP 108 -3.068 13.400 -7.286 846 HB3 ASP 108 HB2 ASP 108 -4.203 14.270 -6.258 847 H ASP 109 H ASP 109 -4.381 12.216 -4.394 848 HA ASP 109 HA ASP 109 -5.288 14.157 -2.437 849 HB2 ASP 109 HB3 ASP 109 -6.648 12.474 -4.023 850 HB3 ASP 109 HB2 ASP 109 -6.544 11.474 -2.577 851 H VAL 110 H VAL 110 -2.813 12.142 -2.244 852 HA VAL 110 HA VAL 110 -3.439 10.826 0.260 853 HB VAL 110 HB VAL 110 -2.035 9.672 -1.383 854 HG11 VAL 110 HG11 VAL 110 -0.202 10.535 -2.349 855 HG12 VAL 110 HG12 VAL 110 0.362 11.276 -0.852 856 HG13 VAL 110 HG13 VAL 110 -0.864 12.084 -1.827 857 HG21 VAL 110 HG21 VAL 110 -0.385 8.843 0.123 858 HG22 VAL 110 HG22 VAL 110 -1.804 9.268 1.080 859 HG23 VAL 110 HG23 VAL 110 -0.402 10.338 1.059 860 H ASP 111 H ASP 111 -2.108 11.081 2.176 861 HA ASP 111 HA ASP 111 -1.038 13.811 2.468 862 HB2 ASP 111 HB3 ASP 111 -3.300 13.186 3.619 863 HB3 ASP 111 HB2 ASP 111 -2.272 12.341 4.772 864 H THR 112 H THR 112 -0.808 10.434 3.482 865 HA THR 112 HA THR 112 1.872 11.016 4.562 866 HB THR 112 HB THR 112 0.070 8.699 5.285 867 HG1 THR 112 HG1 THR 112 -0.857 10.449 6.193 868 HG21 THR 112 HG21 THR 112 1.634 8.689 7.317 869 HG22 THR 112 HG22 THR 112 2.743 9.591 6.283 870 HG23 THR 112 HG23 THR 112 2.208 7.978 5.808 871 H LEU 113 H LEU 113 3.537 9.446 4.186 872 HA LEU 113 HA LEU 113 3.035 7.513 2.053 873 HB2 LEU 113 HB3 LEU 113 4.180 9.984 1.564 874 HB3 LEU 113 HB2 LEU 113 5.561 8.917 1.712 875 HG LEU 113 HG LEU 113 4.798 7.550 -0.101 876 HD11 LEU 113 HD11 LEU 113 2.572 9.027 -1.088 877 HD12 LEU 113 HD12 LEU 113 2.246 8.562 0.580 878 HD13 LEU 113 HD13 LEU 113 2.652 7.331 -0.613 879 HD21 LEU 113 HD21 LEU 113 5.963 9.165 -1.149 880 HD22 LEU 113 HD22 LEU 113 5.035 10.465 -0.399 881 HD23 LEU 113 HD23 LEU 113 4.379 9.603 -1.793 882 H LEU 114 H LEU 114 3.677 5.634 2.859 883 HA LEU 114 HA LEU 114 6.207 5.536 4.371 884 HB2 LEU 114 HB3 LEU 114 3.818 3.715 4.708 885 HB3 LEU 114 HB2 LEU 114 5.321 3.619 5.603 886 HG LEU 114 HG LEU 114 3.838 6.186 5.747 887 HD11 LEU 114 HD11 LEU 114 2.423 5.278 7.575 888 HD12 LEU 114 HD12 LEU 114 2.922 3.654 7.099 889 HD13 LEU 114 HD13 LEU 114 2.004 4.659 5.977 890 HD21 LEU 114 HD21 LEU 114 4.802 6.323 7.871 891 HD22 LEU 114 HD22 LEU 114 6.052 5.570 6.880 892 HD23 LEU 114 HD23 LEU 114 5.071 4.582 7.963 893 H VAL 115 H VAL 115 7.722 4.672 3.096 894 HA VAL 115 HA VAL 115 6.923 2.422 1.364 895 HB VAL 115 HB VAL 115 8.517 3.143 -0.305 896 HG11 VAL 115 HG11 VAL 115 6.957 5.599 0.418 897 HG12 VAL 115 HG12 VAL 115 6.155 4.125 -0.126 898 HG13 VAL 115 HG13 VAL 115 7.311 4.941 -1.180 899 HG21 VAL 115 HG21 VAL 115 10.240 4.126 1.021 900 HG22 VAL 115 HG22 VAL 115 9.141 5.361 1.635 901 HG23 VAL 115 HG23 VAL 115 9.625 5.376 -0.060 902 H THR 116 H THR 116 8.254 0.695 1.171 903 HA THR 116 HA THR 116 10.543 0.584 3.020 904 HB THR 116 HB THR 116 8.715 -1.601 2.000 905 HG1 THR 116 HG1 THR 116 8.136 -1.761 4.152 906 HG21 THR 116 HG21 THR 116 9.922 -3.200 3.263 907 HG22 THR 116 HG22 THR 116 10.992 -1.964 3.924 908 HG23 THR 116 HG23 THR 116 11.076 -2.381 2.212 909 H ARG 117 H ARG 117 12.228 1.181 1.735 910 HA ARG 117 HA ARG 117 12.466 0.159 -0.960 911 HB2 ARG 117 HB3 ARG 117 14.427 1.838 0.607 912 HB3 ARG 117 HB2 ARG 117 14.426 1.571 -1.131 913 HG2 ARG 117 HG3 ARG 117 12.753 3.051 -1.500 914 HG3 ARG 117 HG2 ARG 117 11.968 2.719 0.046 915 HD2 ARG 117 HD3 ARG 117 13.588 4.036 1.221 916 HD3 ARG 117 HD2 ARG 117 14.561 4.228 -0.236 917 HE ARG 117 HE ARG 117 11.883 5.242 -0.489 918 HH11 ARG 117 HH11 ARG 117 15.137 5.977 0.534 919 HH12 ARG 117 HH12 ARG 117 14.945 7.687 0.341 920 HH21 ARG 117 HH21 ARG 117 11.629 7.491 -0.744 921 HH22 ARG 117 HH22 ARG 117 12.953 8.547 -0.384 922 H LEU 118 H LEU 118 13.071 -1.895 -1.171 923 HA LEU 118 HA LEU 118 14.756 -3.251 0.686 924 HB2 LEU 118 HB3 LEU 118 13.281 -3.894 -1.759 925 HB3 LEU 118 HB2 LEU 118 14.794 -4.768 -1.618 926 HG LEU 118 HG LEU 118 14.056 -5.543 0.646 927 HD11 LEU 118 HD11 LEU 118 12.108 -4.947 1.580 928 HD12 LEU 118 HD12 LEU 118 11.242 -4.993 0.044 929 HD13 LEU 118 HD13 LEU 118 12.195 -3.573 0.478 930 HD21 LEU 118 HD21 LEU 118 13.146 -7.387 -0.267 931 HD22 LEU 118 HD22 LEU 118 13.572 -6.598 -1.786 932 HD23 LEU 118 HD23 LEU 118 11.928 -6.475 -1.159 933 H ALA 119 H ALA 119 16.842 -4.209 0.177 934 HA ALA 119 HA ALA 119 18.558 -2.309 -1.176 935 HB1 ALA 119 HB1 ALA 119 19.982 -2.955 0.397 936 HB2 ALA 119 HB2 ALA 119 20.041 -4.563 -0.325 937 HB3 ALA 119 HB3 ALA 119 18.855 -4.203 0.930 938 H GLY 120 H GLY 120 17.582 -5.690 -1.546 939 HA2 GLY 120 HA3 GLY 120 19.290 -6.315 -3.697 940 HA3 GLY 120 HA2 GLY 120 17.801 -7.156 -3.296 941 H SER 121 H SER 121 18.948 -6.438 -5.902 942 HA SER 121 HA SER 121 16.962 -4.540 -6.924 943 HB2 SER 121 HB3 SER 121 19.608 -5.525 -7.902 944 HB3 SER 121 HB2 SER 121 18.423 -4.985 -9.091 945 HG SER 121 HG SER 121 19.726 -3.527 -7.080 946 H PHE 122 H PHE 122 15.115 -5.389 -7.603 947 HA PHE 122 HA PHE 122 15.173 -8.044 -8.881 948 HB2 PHE 122 HB3 PHE 122 12.889 -6.745 -7.382 949 HB3 PHE 122 HB2 PHE 122 12.857 -8.339 -8.129 950 HD1 PHE 122 HD2 PHE 122 14.821 -6.380 -5.637 951 HD2 PHE 122 HD1 PHE 122 13.301 -10.175 -6.822 952 HE1 PHE 122 HE2 PHE 122 15.671 -7.368 -3.550 953 HE2 PHE 122 HE1 PHE 122 14.148 -11.170 -4.737 954 HZ PHE 122 HZ PHE 122 15.335 -9.766 -3.098 955 H GLU 123 H GLU 123 13.425 -8.404 -10.488 956 HA GLU 123 HA GLU 123 12.681 -5.943 -11.914 957 HB2 GLU 123 HB3 GLU 123 13.250 -6.957 -14.047 958 HB3 GLU 123 HB2 GLU 123 14.661 -6.937 -12.999 959 HG2 GLU 123 HG3 GLU 123 13.480 -9.385 -12.483 960 HG3 GLU 123 HG2 GLU 123 13.289 -9.169 -14.223 961 H GLY 124 H GLY 124 10.647 -5.895 -12.702 962 HA2 GLY 124 HA3 GLY 124 9.149 -8.372 -13.036 963 HA3 GLY 124 HA2 GLY 124 8.565 -7.279 -11.791 964 H ASP 125 H ASP 125 6.735 -6.437 -12.584 965 HA ASP 125 HA ASP 125 6.922 -4.846 -15.015 966 HB2 ASP 125 HB3 ASP 125 5.939 -7.343 -15.291 967 HB3 ASP 125 HB2 ASP 125 4.463 -6.490 -14.846 968 H THR 126 H THR 126 6.578 -4.417 -12.075 969 HA THR 126 HA THR 126 4.352 -2.557 -12.296 970 HB THR 126 HB THR 126 4.349 -4.058 -9.753 971 HG1 THR 126 HG1 THR 126 3.301 -5.241 -12.105 972 HG21 THR 126 HG21 THR 126 2.211 -3.432 -9.632 973 HG22 THR 126 HG22 THR 126 1.893 -3.827 -11.321 974 HG23 THR 126 HG23 THR 126 2.649 -2.290 -10.902 975 H LYS 127 H LYS 127 5.452 -0.733 -11.944 976 HA LYS 127 HA LYS 127 7.180 -0.593 -9.559 977 HB2 LYS 127 HB3 LYS 127 7.406 0.803 -12.222 978 HB3 LYS 127 HB2 LYS 127 8.275 1.350 -10.795 979 HG2 LYS 127 HG3 LYS 127 9.722 -0.010 -12.143 980 HG3 LYS 127 HG2 LYS 127 9.354 -0.862 -10.642 981 HD2 LYS 127 HD3 LYS 127 8.162 -2.483 -11.696 982 HD3 LYS 127 HD2 LYS 127 7.564 -1.383 -12.939 983 HE2 LYS 127 HE3 LYS 127 9.081 -3.052 -13.880 984 HE3 LYS 127 HE2 LYS 127 9.738 -1.424 -14.039 985 HZ1 LYS 127 HZ1 LYS 127 10.944 -1.978 -11.861 986 HZ2 LYS 127 HZ2 LYS 127 11.527 -2.663 -13.294 987 HZ3 LYS 127 HZ3 LYS 127 10.594 -3.592 -12.232 988 H MET 128 H MET 128 7.344 1.644 -8.632 989 HA MET 128 HA MET 128 4.754 2.595 -7.985 990 HB2 MET 128 HB3 MET 128 6.738 2.689 -6.469 991 HB3 MET 128 HB2 MET 128 7.402 3.963 -7.483 992 HG2 MET 128 HG3 MET 128 6.322 4.852 -5.487 993 HG3 MET 128 HG2 MET 128 5.529 5.400 -6.960 994 HE1 MET 128 HE1 MET 128 2.888 5.940 -5.622 995 HE2 MET 128 HE2 MET 128 4.301 6.003 -4.569 996 HE3 MET 128 HE3 MET 128 2.874 5.093 -4.075 997 H ILE 129 H ILE 129 4.070 4.876 -8.186 998 HA ILE 129 HA ILE 129 4.609 5.844 -10.899 999 HB ILE 129 HB ILE 129 2.520 7.123 -10.673 1000 HG12 ILE 129 HG13 ILE 129 1.156 6.074 -8.555 1001 HG13 ILE 129 HG12 ILE 129 2.776 6.210 -7.880 1002 HG21 ILE 129 HG21 ILE 129 1.460 4.544 -9.885 1003 HG22 ILE 129 HG22 ILE 129 2.806 4.388 -11.015 1004 HG23 ILE 129 HG23 ILE 129 1.401 5.361 -11.447 1005 HD11 ILE 129 HD11 ILE 129 2.826 8.562 -8.365 1006 HD12 ILE 129 HD12 ILE 129 1.374 8.175 -7.443 1007 HD13 ILE 129 HD13 ILE 129 1.266 8.459 -9.180 1008 HA PRO 130 HA PRO 130 6.911 9.358 -9.516 1009 HB2 PRO 130 HB3 PRO 130 5.407 10.894 -11.565 1010 HB3 PRO 130 HB2 PRO 130 7.151 10.698 -11.359 1011 HG2 PRO 130 HG3 PRO 130 5.857 9.433 -13.316 1012 HG3 PRO 130 HG2 PRO 130 7.181 8.646 -12.436 1013 HD2 PRO 130 HD3 PRO 130 4.229 8.252 -12.172 1014 HD3 PRO 130 HD2 PRO 130 5.539 7.056 -12.094 1015 H LEU 131 H LEU 131 6.532 10.548 -7.762 1016 HA LEU 131 HA LEU 131 3.892 11.828 -7.461 1017 HB2 LEU 131 HB3 LEU 131 5.599 11.278 -5.088 1018 HB3 LEU 131 HB2 LEU 131 3.851 11.319 -5.220 1019 HG LEU 131 HG LEU 131 5.322 9.094 -6.560 1020 HD11 LEU 131 HD11 LEU 131 6.374 8.693 -4.593 1021 HD12 LEU 131 HD12 LEU 131 4.826 7.939 -4.213 1022 HD13 LEU 131 HD13 LEU 131 5.176 9.571 -3.643 1023 HD21 LEU 131 HD21 LEU 131 3.322 7.932 -6.295 1024 HD22 LEU 131 HD22 LEU 131 2.796 9.579 -6.644 1025 HD23 LEU 131 HD23 LEU 131 2.775 8.978 -4.985 1026 H ASN 132 H ASN 132 3.890 13.810 -6.121 1027 HA ASN 132 HA ASN 132 6.022 15.576 -6.933 1028 HB2 ASN 132 HB3 ASN 132 3.330 15.916 -6.384 1029 HB3 ASN 132 HB2 ASN 132 4.112 16.654 -4.990 1030 HD21 ASN 132 HD21 ASN 132 5.893 18.192 -5.517 1031 HD22 ASN 132 HD22 ASN 132 5.664 19.236 -6.874 1032 H TRP 133 H TRP 133 7.694 14.426 -5.769 1033 HA TRP 133 HA TRP 133 7.779 14.053 -3.024 1034 HB2 TRP 133 HB3 TRP 133 10.045 14.518 -4.964 1035 HB3 TRP 133 HB2 TRP 133 10.244 13.929 -3.314 1036 HD1 TRP 133 HD1 TRP 133 8.878 12.849 -6.729 1037 HE1 TRP 133 HE1 TRP 133 8.612 10.289 -6.738 1038 HE3 TRP 133 HE3 TRP 133 9.937 11.906 -1.818 1039 HZ2 TRP 133 HZ2 TRP 133 8.834 8.152 -4.908 1040 HZ3 TRP 133 HZ3 TRP 133 9.889 9.576 -1.028 1041 HH2 TRP 133 HH2 TRP 133 9.347 7.739 -2.543 1042 H ASP 134 H ASP 134 8.774 16.956 -4.888 1043 HA ASP 134 HA ASP 134 10.035 18.314 -2.830 1044 HB2 ASP 134 HB3 ASP 134 8.298 19.503 -5.004 1045 HB3 ASP 134 HB2 ASP 134 9.528 20.354 -4.076 1046 H ASP 135 H ASP 135 6.596 18.167 -3.651 1047 HA ASP 135 HA ASP 135 5.794 19.969 -1.585 1048 HB2 ASP 135 HB3 ASP 135 4.437 18.259 -3.591 1049 HB3 ASP 135 HB2 ASP 135 3.507 18.672 -2.154 1050 H PHE 136 H PHE 136 7.115 17.014 -1.273 1051 HA PHE 136 HA PHE 136 5.525 16.395 1.125 1052 HB2 PHE 136 HB3 PHE 136 6.621 14.604 -1.003 1053 HB3 PHE 136 HB2 PHE 136 6.532 13.996 0.647 1054 HD1 PHE 136 HD2 PHE 136 4.291 16.025 -1.548 1055 HD2 PHE 136 HD1 PHE 136 4.730 12.635 0.986 1056 HE1 PHE 136 HE2 PHE 136 1.918 15.470 -1.887 1057 HE2 PHE 136 HE1 PHE 136 2.358 12.072 0.651 1058 HZ PHE 136 HZ PHE 136 0.949 13.491 -0.787 1059 H THR 137 H THR 137 6.601 16.216 2.987 1060 HA THR 137 HA THR 137 9.544 16.364 2.882 1061 HB THR 137 HB THR 137 7.615 17.456 4.938 1062 HG1 THR 137 HG1 THR 137 7.867 18.691 3.020 1063 HG21 THR 137 HG21 THR 137 10.616 17.668 4.937 1064 HG22 THR 137 HG22 THR 137 9.661 16.674 6.038 1065 HG23 THR 137 HG23 THR 137 9.504 18.431 6.074 1066 H LYS 138 H LYS 138 10.723 14.875 3.910 1067 HA LYS 138 HA LYS 138 9.578 12.467 4.769 1068 HB2 LYS 138 HB3 LYS 138 11.915 12.764 3.926 1069 HB3 LYS 138 HB2 LYS 138 12.327 13.495 5.472 1070 HG2 LYS 138 HG3 LYS 138 12.488 11.521 6.489 1071 HG3 LYS 138 HG2 LYS 138 11.009 10.915 5.747 1072 HD2 LYS 138 HD3 LYS 138 12.940 9.587 5.067 1073 HD3 LYS 138 HD2 LYS 138 12.235 10.432 3.689 1074 HE2 LYS 138 HE3 LYS 138 14.349 11.059 3.269 1075 HE3 LYS 138 HE2 LYS 138 14.070 12.244 4.543 1076 HZ1 LYS 138 HZ1 LYS 138 15.007 10.667 6.138 1077 HZ2 LYS 138 HZ2 LYS 138 16.120 11.058 4.926 1078 HZ3 LYS 138 HZ3 LYS 138 15.316 9.570 4.887 1079 H VAL 139 H VAL 139 8.561 11.989 6.574 1080 HA VAL 139 HA VAL 139 8.722 13.772 8.861 1081 HB VAL 139 HB VAL 139 7.096 11.257 8.860 1082 HG11 VAL 139 HG11 VAL 139 5.733 12.379 10.377 1083 HG12 VAL 139 HG12 VAL 139 6.307 13.967 9.866 1084 HG13 VAL 139 HG13 VAL 139 7.358 12.911 10.810 1085 HG21 VAL 139 HG21 VAL 139 6.392 12.004 6.786 1086 HG22 VAL 139 HG22 VAL 139 6.596 13.703 7.213 1087 HG23 VAL 139 HG23 VAL 139 5.244 12.784 7.874 1088 H SER 140 H SER 140 9.688 10.538 7.921 1089 HA SER 140 HA SER 140 11.476 10.397 10.183 1090 HB2 SER 140 HB3 SER 140 9.758 7.987 10.002 1091 HB3 SER 140 HB2 SER 140 10.494 8.747 11.413 1092 HG SER 140 HG SER 140 8.490 9.364 11.721 1093 H SER 141 H SER 141 12.912 8.526 10.083 1094 HA SER 141 HA SER 141 12.952 7.029 7.595 1095 HB2 SER 141 HB3 SER 141 15.259 7.703 7.044 1096 HB3 SER 141 HB2 SER 141 14.160 9.082 7.005 1097 HG SER 141 HG SER 141 15.782 8.397 9.230 1098 H ARG 142 H ARG 142 13.488 5.001 8.042 1099 HA ARG 142 HA ARG 142 15.419 4.456 10.176 1100 HB2 ARG 142 HB3 ARG 142 13.071 4.273 11.073 1101 HB3 ARG 142 HB2 ARG 142 12.807 2.958 9.936 1102 HG2 ARG 142 HG3 ARG 142 14.527 1.639 11.000 1103 HG3 ARG 142 HG2 ARG 142 14.916 2.976 12.085 1104 HD2 ARG 142 HD3 ARG 142 13.551 1.471 13.312 1105 HD3 ARG 142 HD2 ARG 142 12.544 2.861 12.907 1106 HE ARG 142 HE ARG 142 12.359 0.699 11.019 1107 HH11 ARG 142 HH11 ARG 142 11.121 2.006 14.009 1108 HH12 ARG 142 HH12 ARG 142 9.603 1.181 13.887 1109 HH21 ARG 142 HH21 ARG 142 10.363 -0.388 10.857 1110 HH22 ARG 142 HH22 ARG 142 9.173 -0.179 12.099 1111 H THR 143 H THR 143 16.935 3.101 9.489 1112 HA THR 143 HA THR 143 16.402 1.508 7.085 1113 HB THR 143 HB THR 143 19.117 1.945 8.299 1114 HG1 THR 143 HG1 THR 143 18.257 4.000 8.008 1115 HG21 THR 143 HG21 THR 143 18.484 0.396 6.240 1116 HG22 THR 143 HG22 THR 143 19.992 1.308 6.318 1117 HG23 THR 143 HG23 THR 143 18.630 1.932 5.386 1118 H VAL 144 H VAL 144 15.835 -0.525 7.439 1119 HA VAL 144 HA VAL 144 16.933 -1.921 9.784 1120 HB VAL 144 HB VAL 144 14.480 -1.815 9.705 1121 HG11 VAL 144 HG11 VAL 144 13.220 -2.965 7.982 1122 HG12 VAL 144 HG12 VAL 144 14.714 -3.412 7.157 1123 HG13 VAL 144 HG13 VAL 144 14.236 -1.717 7.261 1124 HG21 VAL 144 HG21 VAL 144 16.000 -3.966 10.318 1125 HG22 VAL 144 HG22 VAL 144 14.908 -4.668 9.124 1126 HG23 VAL 144 HG23 VAL 144 14.255 -3.886 10.563 1127 H GLU 145 H GLU 145 18.308 -3.565 9.509 1128 HA GLU 145 HA GLU 145 18.559 -4.721 6.811 1129 HB2 GLU 145 HB3 GLU 145 21.005 -5.121 7.538 1130 HB3 GLU 145 HB2 GLU 145 20.532 -3.503 7.037 1131 HG2 GLU 145 HG3 GLU 145 20.683 -2.651 9.156 1132 HG3 GLU 145 HG2 GLU 145 20.390 -4.211 9.922 1133 H ASP 146 H ASP 146 18.920 -6.910 6.633 1134 HA ASP 146 HA ASP 146 18.507 -8.461 9.104 1135 HB2 ASP 146 HB3 ASP 146 17.546 -8.858 6.286 1136 HB3 ASP 146 HB2 ASP 146 17.695 -10.237 7.368 1137 H THR 147 H THR 147 19.162 -10.963 8.306 1138 HA THR 147 HA THR 147 21.953 -10.998 8.462 1139 HB THR 147 HB THR 147 20.627 -12.894 9.187 1140 HG1 THR 147 HG1 THR 147 22.231 -13.612 6.962 1141 HG21 THR 147 HG21 THR 147 18.818 -12.866 7.594 1142 HG22 THR 147 HG22 THR 147 19.610 -14.442 7.580 1143 HG23 THR 147 HG23 THR 147 19.926 -13.284 6.288 1144 H ASN 148 H ASN 148 19.786 -11.323 5.693 1145 HA ASN 148 HA ASN 148 22.004 -11.633 3.852 1146 HB2 ASN 148 HB3 ASN 148 19.078 -11.922 3.736 1147 HB3 ASN 148 HB2 ASN 148 19.795 -11.245 2.277 1148 HD21 ASN 148 HD21 ASN 148 18.989 -13.248 1.333 1149 HD22 ASN 148 HD22 ASN 148 19.972 -14.666 1.425 1150 HA PRO 149 HA PRO 149 22.553 -7.293 3.130 1151 HB2 PRO 149 HB3 PRO 149 23.615 -7.421 0.610 1152 HB3 PRO 149 HB2 PRO 149 24.533 -7.760 2.081 1153 HG2 PRO 149 HG3 PRO 149 23.244 -9.668 0.170 1154 HG3 PRO 149 HG2 PRO 149 24.831 -9.770 0.956 1155 HD2 PRO 149 HD3 PRO 149 22.712 -11.175 1.841 1156 HD3 PRO 149 HD2 PRO 149 23.934 -10.521 2.952 1157 H ALA 150 H ALA 150 20.782 -9.333 0.910 1158 HA ALA 150 HA ALA 150 19.656 -7.100 -0.545 1159 HB1 ALA 150 HB1 ALA 150 19.591 -10.043 -0.773 1160 HB2 ALA 150 HB2 ALA 150 19.775 -8.808 -2.019 1161 HB3 ALA 150 HB3 ALA 150 18.176 -9.176 -1.371 1162 H LEU 151 H LEU 151 18.935 -8.803 2.324 1163 HA LEU 151 HA LEU 151 16.086 -8.289 2.214 1164 HB2 LEU 151 HB3 LEU 151 17.859 -9.460 4.351 1165 HB3 LEU 151 HB2 LEU 151 16.134 -9.223 4.552 1166 HG LEU 151 HG LEU 151 17.551 -11.134 2.714 1167 HD11 LEU 151 HD11 LEU 151 16.306 -12.798 3.853 1168 HD12 LEU 151 HD12 LEU 151 15.287 -11.593 4.641 1169 HD13 LEU 151 HD13 LEU 151 16.988 -11.740 5.088 1170 HD21 LEU 151 HD21 LEU 151 15.003 -11.632 2.124 1171 HD22 LEU 151 HD22 LEU 151 15.989 -10.510 1.186 1172 HD23 LEU 151 HD23 LEU 151 14.876 -9.895 2.408 1173 H THR 152 H THR 152 18.539 -6.258 2.606 1174 HA THR 152 HA THR 152 17.772 -4.894 5.013 1175 HB THR 152 HB THR 152 19.410 -3.709 2.780 1176 HG1 THR 152 HG1 THR 152 21.210 -4.704 3.776 1177 HG21 THR 152 HG21 THR 152 19.076 -3.173 5.668 1178 HG22 THR 152 HG22 THR 152 19.354 -2.061 4.328 1179 HG23 THR 152 HG23 THR 152 20.693 -3.001 4.986 1180 H HIS 153 H HIS 153 16.082 -3.589 5.230 1181 HA HIS 153 HA HIS 153 14.979 -2.316 2.811 1182 HB2 HIS 153 HB3 HIS 153 13.331 -2.673 5.279 1183 HB3 HIS 153 HB2 HIS 153 12.824 -2.607 3.597 1184 HD1 HIS 153 HD1 HIS 153 12.410 -4.872 6.004 1185 HD2 HIS 153 HD2 HIS 153 14.549 -5.145 2.452 1186 HE1 HIS 153 HE1 HIS 153 12.552 -7.329 5.491 1187 HE2 HIS 153 HE2 HIS 153 13.769 -7.464 3.290 1188 H THR 154 H THR 154 13.758 -0.276 3.261 1189 HA THR 154 HA THR 154 14.917 1.265 5.474 1190 HB THR 154 HB THR 154 14.662 2.336 2.661 1191 HG1 THR 154 HG1 THR 154 16.512 1.472 2.265 1192 HG21 THR 154 HG21 THR 154 14.727 3.874 4.762 1193 HG22 THR 154 HG22 THR 154 15.713 4.248 3.348 1194 HG23 THR 154 HG23 THR 154 16.445 3.473 4.753 1195 H TYR 155 H TYR 155 13.220 1.805 6.683 1196 HA TYR 155 HA TYR 155 10.638 2.333 5.436 1197 HB2 TYR 155 HB3 TYR 155 11.583 1.656 8.164 1198 HB3 TYR 155 HB2 TYR 155 10.163 2.691 8.068 1199 HD1 TYR 155 HD1 TYR 155 8.320 1.830 6.350 1200 HD2 TYR 155 HD2 TYR 155 11.252 -0.627 8.211 1201 HE1 TYR 155 HE1 TYR 155 6.902 -0.143 5.967 1202 HE2 TYR 155 HE2 TYR 155 9.843 -2.606 7.833 1203 HH TYR 155 HH TYR 155 8.048 -3.346 6.419 1204 H GLU 156 H GLU 156 10.162 4.330 4.810 1205 HA GLU 156 HA GLU 156 11.173 6.577 6.425 1206 HB2 GLU 156 HB3 GLU 156 11.091 6.250 3.440 1207 HB3 GLU 156 HB2 GLU 156 11.100 7.848 4.174 1208 HG2 GLU 156 HG3 GLU 156 13.238 7.596 5.016 1209 HG3 GLU 156 HG2 GLU 156 13.174 5.836 4.928 1210 H VAL 157 H VAL 157 9.829 8.329 6.714 1211 HA VAL 157 HA VAL 157 7.019 7.902 5.945 1212 HB VAL 157 HB VAL 157 7.994 9.582 8.255 1213 HG11 VAL 157 HG11 VAL 157 5.300 8.639 7.324 1214 HG12 VAL 157 HG12 VAL 157 5.842 10.285 7.649 1215 HG13 VAL 157 HG13 VAL 157 5.582 9.163 8.984 1216 HG21 VAL 157 HG21 VAL 157 8.495 7.048 8.353 1217 HG22 VAL 157 HG22 VAL 157 6.753 6.875 8.568 1218 HG23 VAL 157 HG23 VAL 157 7.696 7.809 9.729 1219 H TRP 158 H TRP 158 5.818 9.649 5.226 1220 HA TRP 158 HA TRP 158 7.179 12.187 4.751 1221 HB2 TRP 158 HB3 TRP 158 5.973 10.598 2.484 1222 HB3 TRP 158 HB2 TRP 158 6.618 12.227 2.362 1223 HD1 TRP 158 HD1 TRP 158 7.886 8.665 3.238 1224 HE1 TRP 158 HE1 TRP 158 10.330 8.484 2.450 1225 HE3 TRP 158 HE3 TRP 158 8.569 13.459 1.596 1226 HZ2 TRP 158 HZ2 TRP 158 12.288 10.152 1.286 1227 HZ3 TRP 158 HZ3 TRP 158 10.757 14.085 0.659 1228 HH2 TRP 158 HH2 TRP 158 12.577 12.464 0.508 1229 H GLN 159 H GLN 159 5.874 13.917 4.769 1230 HA GLN 159 HA GLN 159 2.975 13.510 4.583 1231 HB2 GLN 159 HB3 GLN 159 4.512 14.496 6.914 1232 HB3 GLN 159 HB2 GLN 159 3.072 15.417 6.501 1233 HG2 GLN 159 HG3 GLN 159 2.472 12.619 6.450 1234 HG3 GLN 159 HG2 GLN 159 3.243 13.040 7.979 1235 HE21 GLN 159 HE21 GLN 159 1.880 13.580 9.510 1236 HE22 GLN 159 HE22 GLN 159 0.344 14.340 9.295 1237 H LYS 160 H LYS 160 2.106 14.903 3.174 1238 HA LYS 160 HA LYS 160 3.585 16.812 1.794 1239 HB2 LYS 160 HB3 LYS 160 1.353 15.700 1.168 1240 HB3 LYS 160 HB2 LYS 160 0.598 16.975 2.114 1241 HG2 LYS 160 HG3 LYS 160 1.984 18.571 0.624 1242 HG3 LYS 160 HG2 LYS 160 2.121 17.175 -0.447 1243 HD2 LYS 160 HD3 LYS 160 -0.567 17.945 0.591 1244 HD3 LYS 160 HD2 LYS 160 0.150 18.893 -0.714 1245 HE2 LYS 160 HE3 LYS 160 0.202 15.943 -0.990 1246 HE3 LYS 160 HE2 LYS 160 -1.362 16.739 -1.156 1247 HZ1 LYS 160 HZ1 LYS 160 -0.369 18.180 -2.857 1248 HZ2 LYS 160 HZ2 LYS 160 -0.309 16.547 -3.293 1249 HZ3 LYS 160 HZ3 LYS 160 1.085 17.324 -2.734 1250 H LYS 161 H LYS 161 3.756 19.022 1.898 1251 HA LYS 161 HA LYS 161 3.520 20.176 4.514 1252 HB2 LYS 161 HB3 LYS 161 4.382 21.331 1.860 1253 HB3 LYS 161 HB2 LYS 161 4.410 22.231 3.370 1254 HG2 LYS 161 HG3 LYS 161 6.072 20.826 4.289 1255 HG3 LYS 161 HG2 LYS 161 5.879 19.638 2.999 1256 HD2 LYS 161 HD3 LYS 161 7.680 20.672 2.122 1257 HD3 LYS 161 HD2 LYS 161 6.487 21.842 1.556 1258 HE2 LYS 161 HE3 LYS 161 7.387 23.445 2.806 1259 HE3 LYS 161 HE2 LYS 161 7.260 22.448 4.255 1260 HZ1 LYS 161 HZ1 LYS 161 9.377 21.578 3.933 1261 HZ2 LYS 161 HZ2 LYS 161 9.565 23.210 3.529 1262 HZ3 LYS 161 HZ3 LYS 161 9.445 22.046 2.308 1263 H ALA 162 H ALA 162 1.898 21.335 5.317 1264 HA ALA 162 HA ALA 162 -0.082 22.440 5.503 1265 HB1 ALA 162 HB1 ALA 162 0.764 24.306 4.444 1266 HB2 ALA 162 HB2 ALA 162 -0.636 23.930 3.439 1267 HB3 ALA 162 HB3 ALA 162 0.980 23.467 2.907 1268 H51A NDP 170 H51A NDP 170 -5.611 -0.024 -9.378 1269 H52A NDP 170 H52A NDP 170 -5.991 -1.553 -8.575 1270 H4B NDP 170 H4B NDP 170 -7.347 -2.178 -10.633 1271 H3B NDP 170 H3B NDP 170 -6.715 0.664 -11.438 1272 HO3A NDP 170 HO3A NDP 170 -7.042 -1.856 -12.750 1273 H2B NDP 170 H2B NDP 170 -8.951 0.821 -12.295 1274 H1B NDP 170 H1B NDP 170 -10.180 -0.303 -10.105 1275 H8A NDP 170 H8A NDP 170 -7.047 1.718 -9.294 1276 H61A NDP 170 H61A NDP 170 -10.964 6.450 -8.407 1277 H62A NDP 170 H62A NDP 170 -9.322 5.889 -8.185 1278 H2A NDP 170 H2A NDP 170 -13.314 2.988 -10.016 1279 H51N NDP 170 H51N NDP 170 -1.363 -4.226 -7.973 1280 H52N NDP 170 H52N NDP 170 -0.605 -3.263 -9.252 1281 H4D NDP 170 H4D NDP 170 0.914 -5.203 -9.748 1282 H3D NDP 170 H3D NDP 170 -0.496 -6.489 -7.399 1283 HO3N NDP 170 HO3N NDP 170 -0.966 -7.214 -9.553 1284 H2D NDP 170 H2D NDP 170 1.619 -7.486 -6.836 1285 HO2N NDP 170 HO2N NDP 170 2.393 -6.728 -9.446 1286 H1D NDP 170 H1D NDP 170 3.101 -5.180 -7.190 1287 H2N NDP 170 H2N NDP 170 3.573 -5.099 -4.827 1288 H71N NDP 170 H71N NDP 170 5.317 -4.552 -2.170 1289 H72N NDP 170 H72N NDP 170 4.911 -5.177 -3.747 1290 H41N NDP 170 H41N NDP 170 0.513 -3.676 -2.706 1291 H42N NDP 170 H42N NDP 170 0.432 -5.447 -2.405 1292 H5N NDP 170 H5N NDP 170 -1.314 -4.718 -4.027 1293 H6N NDP 170 H6N NDP 170 -0.518 -5.163 -6.355 Start of MODEL 24 1 H1 THR 1 HT1 THR 1 -4.557 9.513 5.071 2 H2 THR 1 HT2 THR 1 -5.178 7.915 5.139 3 H3 THR 1 HT3 THR 1 -6.139 9.185 4.500 4 HA THR 1 HA THR 1 -5.095 7.649 2.872 5 HB THR 1 HB THR 1 -4.507 9.574 1.387 6 HG1 THR 1 HG1 THR 1 -4.848 11.057 3.779 7 HG21 THR 1 HG21 THR 1 -6.863 10.583 2.843 8 HG22 THR 1 HG22 THR 1 -6.951 8.931 2.234 9 HG23 THR 1 HG23 THR 1 -6.634 10.264 1.124 10 H ALA 2 H ALA 2 -3.362 6.368 3.536 11 HA ALA 2 HA ALA 2 -0.725 7.621 3.185 12 HB1 ALA 2 HB1 ALA 2 -1.313 5.517 5.261 13 HB2 ALA 2 HB2 ALA 2 -1.215 7.245 5.600 14 HB3 ALA 2 HB3 ALA 2 0.204 6.380 5.010 15 H PHE 3 H PHE 3 0.833 6.366 2.179 16 HA PHE 3 HA PHE 3 -0.196 3.951 0.856 17 HB2 PHE 3 HB3 PHE 3 2.003 5.882 0.133 18 HB3 PHE 3 HB2 PHE 3 1.820 4.324 -0.662 19 HD1 PHE 3 HD1 PHE 3 -0.935 3.991 -1.179 20 HD2 PHE 3 HD2 PHE 3 1.344 7.580 -1.233 21 HE1 PHE 3 HE1 PHE 3 -2.534 4.980 -2.769 22 HE2 PHE 3 HE2 PHE 3 -0.246 8.575 -2.819 23 HZ PHE 3 HZ PHE 3 -2.185 7.277 -3.590 24 H LEU 4 H LEU 4 0.519 2.034 1.526 25 HA LEU 4 HA LEU 4 3.196 1.881 2.741 26 HB2 LEU 4 HB3 LEU 4 1.539 1.700 4.501 27 HB3 LEU 4 HB2 LEU 4 0.686 0.453 3.612 28 HG LEU 4 HG LEU 4 2.535 -1.090 3.916 29 HD11 LEU 4 HD11 LEU 4 3.879 1.316 5.083 30 HD12 LEU 4 HD12 LEU 4 4.481 0.173 3.882 31 HD13 LEU 4 HD13 LEU 4 4.354 -0.311 5.573 32 HD21 LEU 4 HD21 LEU 4 1.943 -1.662 6.017 33 HD22 LEU 4 HD22 LEU 4 0.762 -0.370 5.800 34 HD23 LEU 4 HD23 LEU 4 2.267 -0.053 6.663 35 H TRP 5 H TRP 5 4.466 0.743 1.421 36 HA TRP 5 HA TRP 5 3.674 -1.880 0.554 37 HB2 TRP 5 HB3 TRP 5 3.600 -1.570 -1.761 38 HB3 TRP 5 HB2 TRP 5 2.731 -0.168 -1.150 39 HD1 TRP 5 HD1 TRP 5 5.868 -1.157 -3.035 40 HE1 TRP 5 HE1 TRP 5 7.023 0.960 -3.930 41 HE3 TRP 5 HE3 TRP 5 3.083 2.383 -0.609 42 HZ2 TRP 5 HZ2 TRP 5 6.795 3.756 -3.641 43 HZ3 TRP 5 HZ3 TRP 5 3.620 4.757 -0.979 44 HH2 TRP 5 HH2 TRP 5 5.434 5.426 -2.465 45 H ALA 6 H ALA 6 5.430 -3.029 -0.557 46 HA ALA 6 HA ALA 6 8.043 -2.053 0.368 47 HB1 ALA 6 HB1 ALA 6 8.782 -4.313 0.377 48 HB2 ALA 6 HB2 ALA 6 7.367 -4.849 -0.529 49 HB3 ALA 6 HB3 ALA 6 7.191 -4.296 1.136 50 H GLN 7 H GLN 7 9.764 -1.805 -1.036 51 HA GLN 7 HA GLN 7 9.388 -2.557 -3.832 52 HB2 GLN 7 HB3 GLN 7 10.091 -0.271 -4.569 53 HB3 GLN 7 HB2 GLN 7 8.499 -0.338 -3.825 54 HG2 GLN 7 HG3 GLN 7 10.439 0.169 -1.802 55 HG3 GLN 7 HG2 GLN 7 10.691 1.294 -3.135 56 HE21 GLN 7 HE21 GLN 7 8.219 0.007 -0.964 57 HE22 GLN 7 HE22 GLN 7 7.249 1.436 -0.934 58 H ASP 8 H ASP 8 11.349 -2.374 -5.120 59 HA ASP 8 HA ASP 8 13.717 -2.901 -3.482 60 HB2 ASP 8 HB3 ASP 8 14.649 -3.957 -5.466 61 HB3 ASP 8 HB2 ASP 8 13.037 -4.593 -5.163 62 H ARG 9 H ARG 9 15.733 -2.358 -5.270 63 HA ARG 9 HA ARG 9 16.086 0.424 -4.926 64 HB2 ARG 9 HB3 ARG 9 17.602 -1.754 -6.291 65 HB3 ARG 9 HB2 ARG 9 18.037 -0.086 -6.637 66 HG2 ARG 9 HG3 ARG 9 17.833 -0.234 -3.856 67 HG3 ARG 9 HG2 ARG 9 18.669 -1.707 -4.350 68 HD2 ARG 9 HD3 ARG 9 20.446 -0.552 -5.261 69 HD3 ARG 9 HD2 ARG 9 19.497 0.912 -5.517 70 HE ARG 9 HE ARG 9 20.031 1.592 -3.396 71 HH11 ARG 9 HH11 ARG 9 20.801 -1.796 -3.727 72 HH12 ARG 9 HH12 ARG 9 21.623 -1.886 -2.206 73 HH21 ARG 9 HH21 ARG 9 21.112 1.475 -1.395 74 HH22 ARG 9 HH22 ARG 9 21.799 -0.029 -0.881 75 H ASP 10 H ASP 10 14.677 -1.436 -7.471 76 HA ASP 10 HA ASP 10 14.885 0.749 -9.391 77 HB2 ASP 10 HB3 ASP 10 14.092 -2.125 -9.537 78 HB3 ASP 10 HB2 ASP 10 13.479 -1.021 -10.764 79 H GLY 11 H GLY 11 12.902 0.129 -6.869 80 HA2 GLY 11 HA3 GLY 11 10.961 1.339 -6.338 81 HA3 GLY 11 HA2 GLY 11 10.765 1.726 -8.041 82 H LEU 12 H LEU 12 11.368 -1.463 -8.028 83 HA LEU 12 HA LEU 12 8.947 -2.360 -8.911 84 HB2 LEU 12 HB3 LEU 12 11.301 -3.496 -8.683 85 HB3 LEU 12 HB2 LEU 12 10.636 -4.134 -7.193 86 HG LEU 12 HG LEU 12 8.775 -5.140 -8.529 87 HD11 LEU 12 HD11 LEU 12 8.590 -4.931 -10.761 88 HD12 LEU 12 HD12 LEU 12 10.335 -4.914 -11.011 89 HD13 LEU 12 HD13 LEU 12 9.505 -3.447 -10.495 90 HD21 LEU 12 HD21 LEU 12 10.584 -6.691 -9.804 91 HD22 LEU 12 HD22 LEU 12 10.209 -6.810 -8.084 92 HD23 LEU 12 HD23 LEU 12 11.613 -5.887 -8.618 93 H ILE 13 H ILE 13 7.630 -4.149 -7.746 94 HA ILE 13 HA ILE 13 7.218 -3.698 -4.921 95 HB ILE 13 HB ILE 13 4.899 -3.126 -5.031 96 HG12 ILE 13 HG13 ILE 13 4.968 -2.872 -8.027 97 HG13 ILE 13 HG12 ILE 13 4.582 -4.418 -7.284 98 HG21 ILE 13 HG21 ILE 13 6.642 -1.330 -5.273 99 HG22 ILE 13 HG22 ILE 13 5.020 -0.899 -5.817 100 HG23 ILE 13 HG23 ILE 13 6.266 -1.308 -6.996 101 HD11 ILE 13 HD11 ILE 13 3.111 -1.931 -6.524 102 HD12 ILE 13 HD12 ILE 13 2.623 -3.616 -6.334 103 HD13 ILE 13 HD13 ILE 13 2.658 -2.881 -7.938 104 H GLY 14 H GLY 14 6.248 -5.320 -7.896 105 HA2 GLY 14 HA3 GLY 14 6.568 -7.900 -7.051 106 HA3 GLY 14 HA2 GLY 14 4.931 -7.489 -6.558 107 H LYS 15 H LYS 15 5.787 -9.470 -8.508 108 HA LYS 15 HA LYS 15 4.555 -8.321 -10.928 109 HB2 LYS 15 HB3 LYS 15 5.763 -10.100 -12.185 110 HB3 LYS 15 HB2 LYS 15 6.829 -8.947 -11.395 111 HG2 LYS 15 HG3 LYS 15 7.890 -10.629 -10.431 112 HG3 LYS 15 HG2 LYS 15 6.412 -11.037 -9.558 113 HD2 LYS 15 HD3 LYS 15 5.996 -12.067 -12.097 114 HD3 LYS 15 HD2 LYS 15 7.700 -12.398 -11.779 115 HE2 LYS 15 HE3 LYS 15 6.598 -13.109 -9.413 116 HE3 LYS 15 HE2 LYS 15 5.282 -13.506 -10.516 117 HZ1 LYS 15 HZ1 LYS 15 6.406 -15.419 -10.729 118 HZ2 LYS 15 HZ2 LYS 15 7.871 -14.762 -10.199 119 HZ3 LYS 15 HZ3 LYS 15 7.380 -14.547 -11.803 120 H ASP 16 H ASP 16 2.444 -8.806 -10.426 121 HA ASP 16 HA ASP 16 0.550 -10.074 -10.521 122 HB2 ASP 16 HB3 ASP 16 2.275 -12.501 -11.017 123 HB3 ASP 16 HB2 ASP 16 0.585 -12.267 -11.453 124 H GLY 17 H GLY 17 0.131 -9.735 -8.343 125 HA2 GLY 17 HA3 GLY 17 -0.708 -11.237 -6.545 126 HA3 GLY 17 HA2 GLY 17 0.886 -11.974 -6.567 127 H HIS 18 H HIS 18 2.715 -10.623 -5.950 128 HA HIS 18 HA HIS 18 2.422 -8.097 -4.746 129 HB2 HIS 18 HB3 HIS 18 2.517 -8.633 -2.399 130 HB3 HIS 18 HB2 HIS 18 1.141 -9.483 -3.091 131 HD1 HIS 18 HD1 HIS 18 2.395 -10.444 -0.463 132 HD2 HIS 18 HD2 HIS 18 3.458 -11.892 -4.210 133 HE1 HIS 18 HE1 HIS 18 3.378 -12.722 -0.049 134 HE2 HIS 18 HE2 HIS 18 3.933 -13.614 -2.339 135 H LEU 19 H LEU 19 4.419 -8.463 -2.681 136 HA LEU 19 HA LEU 19 6.747 -8.291 -4.267 137 HB2 LEU 19 HB3 LEU 19 7.929 -8.357 -2.033 138 HB3 LEU 19 HB2 LEU 19 6.756 -7.074 -2.256 139 HG LEU 19 HG LEU 19 5.319 -9.183 -1.094 140 HD11 LEU 19 HD11 LEU 19 7.546 -8.740 0.782 141 HD12 LEU 19 HD12 LEU 19 7.878 -9.818 -0.573 142 HD13 LEU 19 HD13 LEU 19 6.541 -10.165 0.522 143 HD21 LEU 19 HD21 LEU 19 6.409 -7.011 0.610 144 HD22 LEU 19 HD22 LEU 19 4.756 -7.604 0.446 145 HD23 LEU 19 HD23 LEU 19 5.442 -6.551 -0.791 146 HA PRO 20 HA PRO 20 7.583 -12.686 -4.394 147 HB2 PRO 20 HB3 PRO 20 9.615 -12.629 -6.119 148 HB3 PRO 20 HB2 PRO 20 7.970 -12.239 -6.635 149 HG2 PRO 20 HG3 PRO 20 10.248 -10.406 -6.018 150 HG3 PRO 20 HG2 PRO 20 9.044 -10.301 -7.314 151 HD2 PRO 20 HD3 PRO 20 8.944 -8.891 -4.926 152 HD3 PRO 20 HD2 PRO 20 7.556 -9.204 -5.985 153 H TRP 21 H TRP 21 9.262 -10.444 -2.686 154 HA TRP 21 HA TRP 21 11.558 -12.195 -2.165 155 HB2 TRP 21 HB3 TRP 21 12.417 -10.185 -0.874 156 HB3 TRP 21 HB2 TRP 21 12.282 -9.982 -2.617 157 HD1 TRP 21 HD1 TRP 21 9.943 -9.290 0.421 158 HE1 TRP 21 HE1 TRP 21 8.836 -6.997 0.046 159 HE3 TRP 21 HE3 TRP 21 12.019 -8.117 -4.101 160 HZ2 TRP 21 HZ2 TRP 21 8.838 -4.963 -1.911 161 HZ3 TRP 21 HZ3 TRP 21 11.412 -5.980 -5.158 162 HH2 TRP 21 HH2 TRP 21 9.855 -4.437 -4.085 163 H HIS 22 H HIS 22 12.077 -12.886 -0.090 164 HA HIS 22 HA HIS 22 9.799 -13.202 1.669 165 HB2 HIS 22 HB3 HIS 22 11.586 -14.988 1.053 166 HB3 HIS 22 HB2 HIS 22 12.571 -14.192 2.276 167 HD1 HIS 22 HD1 HIS 22 12.023 -14.660 4.704 168 HD2 HIS 22 HD2 HIS 22 9.241 -16.265 2.068 169 HE1 HIS 22 HE1 HIS 22 10.559 -16.154 6.100 170 HE2 HIS 22 HE2 HIS 22 8.943 -17.188 4.466 171 H LEU 23 H LEU 23 9.358 -11.396 2.810 172 HA LEU 23 HA LEU 23 11.556 -10.159 4.323 173 HB2 LEU 23 HB3 LEU 23 9.280 -9.068 2.834 174 HB3 LEU 23 HB2 LEU 23 9.477 -8.373 4.432 175 HG LEU 23 HG LEU 23 11.761 -7.728 3.895 176 HD11 LEU 23 HD11 LEU 23 12.868 -8.838 2.330 177 HD12 LEU 23 HD12 LEU 23 11.910 -7.982 1.122 178 HD13 LEU 23 HD13 LEU 23 11.382 -9.558 1.711 179 HD21 LEU 23 HD21 LEU 23 9.458 -6.556 2.970 180 HD22 LEU 23 HD22 LEU 23 10.470 -6.627 1.527 181 HD23 LEU 23 HD23 LEU 23 11.058 -5.816 2.978 182 HA PRO 24 HA PRO 24 9.022 -12.375 7.505 183 HB2 PRO 24 HB3 PRO 24 11.570 -11.958 8.966 184 HB3 PRO 24 HB2 PRO 24 10.595 -13.422 8.799 185 HG2 PRO 24 HG3 PRO 24 12.895 -13.151 7.477 186 HG3 PRO 24 HG2 PRO 24 11.496 -13.946 6.730 187 HD2 PRO 24 HD3 PRO 24 12.569 -11.188 6.294 188 HD3 PRO 24 HD2 PRO 24 11.890 -12.336 5.121 189 H ASP 25 H ASP 25 11.003 -9.474 7.662 190 HA ASP 25 HA ASP 25 9.855 -8.554 10.121 191 HB2 ASP 25 HB3 ASP 25 11.087 -6.417 9.446 192 HB3 ASP 25 HB2 ASP 25 12.065 -7.839 9.763 193 H ASP 26 H ASP 26 9.368 -7.925 6.684 194 HA ASP 26 HA ASP 26 7.679 -5.678 7.008 195 HB2 ASP 26 HB3 ASP 26 8.893 -6.551 4.883 196 HB3 ASP 26 HB2 ASP 26 7.458 -7.550 4.671 197 H LEU 27 H LEU 27 7.022 -9.145 6.725 198 HA LEU 27 HA LEU 27 4.250 -9.052 6.504 199 HB2 LEU 27 HB3 LEU 27 5.773 -11.121 8.078 200 HB3 LEU 27 HB2 LEU 27 4.227 -11.319 7.276 201 HG LEU 27 HG LEU 27 6.500 -10.570 5.536 202 HD11 LEU 27 HD11 LEU 27 7.759 -12.410 5.772 203 HD12 LEU 27 HD12 LEU 27 6.365 -13.448 6.071 204 HD13 LEU 27 HD13 LEU 27 7.044 -12.483 7.383 205 HD21 LEU 27 HD21 LEU 27 5.297 -12.620 4.343 206 HD22 LEU 27 HD22 LEU 27 4.667 -10.975 4.263 207 HD23 LEU 27 HD23 LEU 27 3.984 -12.126 5.411 208 H HIS 28 H HIS 28 6.092 -9.649 9.501 209 HA HIS 28 HA HIS 28 3.953 -9.421 11.264 210 HB2 HIS 28 HB3 HIS 28 6.913 -9.148 11.520 211 HB3 HIS 28 HB2 HIS 28 5.912 -8.621 12.869 212 HD1 HIS 28 HD1 HIS 28 4.221 -10.541 13.805 213 HD2 HIS 28 HD2 HIS 28 7.419 -11.816 11.478 214 HE1 HIS 28 HE1 HIS 28 4.461 -12.998 14.281 215 HE2 HIS 28 HE2 HIS 28 6.457 -13.729 12.928 216 H TYR 29 H TYR 29 6.111 -6.932 9.987 217 HA TYR 29 HA TYR 29 5.126 -4.815 11.591 218 HB2 TYR 29 HB3 TYR 29 7.303 -4.958 10.180 219 HB3 TYR 29 HB2 TYR 29 6.290 -4.400 8.852 220 HD1 TYR 29 HD2 TYR 29 5.366 -2.144 8.854 221 HD2 TYR 29 HD1 TYR 29 7.861 -3.492 12.026 222 HE1 TYR 29 HE2 TYR 29 5.665 0.180 9.599 223 HE2 TYR 29 HE1 TYR 29 8.166 -1.172 12.780 224 HH TYR 29 HH TYR 29 8.040 1.147 11.700 225 H PHE 30 H PHE 30 4.102 -6.221 8.561 226 HA PHE 30 HA PHE 30 2.451 -4.150 7.637 227 HB2 PHE 30 HB3 PHE 30 3.206 -6.442 6.549 228 HB3 PHE 30 HB2 PHE 30 1.665 -6.998 7.194 229 HD1 PHE 30 HD1 PHE 30 2.949 -4.004 5.364 230 HD2 PHE 30 HD2 PHE 30 -0.073 -6.980 5.713 231 HE1 PHE 30 HE1 PHE 30 1.795 -3.057 3.408 232 HE2 PHE 30 HE2 PHE 30 -1.232 -6.039 3.757 233 HZ PHE 30 HZ PHE 30 -0.297 -4.075 2.601 234 H ARG 31 H ARG 31 1.429 -7.156 9.271 235 HA ARG 31 HA ARG 31 -1.193 -6.215 9.785 236 HB2 ARG 31 HB3 ARG 31 -0.016 -8.656 9.833 237 HB3 ARG 31 HB2 ARG 31 -0.112 -8.319 11.556 238 HG2 ARG 31 HG3 ARG 31 -2.480 -8.087 11.457 239 HG3 ARG 31 HG2 ARG 31 -2.466 -8.138 9.693 240 HD2 ARG 31 HD3 ARG 31 -1.369 -10.423 11.283 241 HD3 ARG 31 HD2 ARG 31 -3.107 -10.268 11.031 242 HE ARG 31 HE ARG 31 -1.693 -10.044 8.579 243 HH11 ARG 31 HH11 ARG 31 -2.779 -12.372 10.941 244 HH12 ARG 31 HH12 ARG 31 -2.855 -13.676 9.805 245 HH21 ARG 31 HH21 ARG 31 -1.791 -11.758 7.083 246 HH22 ARG 31 HH22 ARG 31 -2.293 -13.328 7.615 247 H ALA 32 H ALA 32 1.797 -6.151 11.616 248 HA ALA 32 HA ALA 32 0.779 -5.530 14.143 249 HB1 ALA 32 HB1 ALA 32 3.060 -4.385 14.436 250 HB2 ALA 32 HB2 ALA 32 3.398 -4.958 12.803 251 HB3 ALA 32 HB3 ALA 32 3.034 -6.113 14.084 252 H GLN 33 H GLN 33 1.194 -3.556 11.304 253 HA GLN 33 HA GLN 33 0.614 -1.120 12.817 254 HB2 GLN 33 HB3 GLN 33 1.810 -1.718 10.169 255 HB3 GLN 33 HB2 GLN 33 0.875 -0.234 10.293 256 HG2 GLN 33 HG3 GLN 33 2.397 -0.018 12.501 257 HG3 GLN 33 HG2 GLN 33 3.482 -0.936 11.457 258 HE21 GLN 33 HE21 GLN 33 2.989 0.052 9.007 259 HE22 GLN 33 HE22 GLN 33 3.383 1.732 8.933 260 H THR 34 H THR 34 -0.728 -3.195 10.309 261 HA THR 34 HA THR 34 -3.062 -1.480 10.018 262 HB THR 34 HB THR 34 -3.760 -3.159 8.313 263 HG1 THR 34 HG1 THR 34 -1.219 -4.323 8.752 264 HG21 THR 34 HG21 THR 34 -2.280 -2.525 6.637 265 HG22 THR 34 HG22 THR 34 -0.921 -2.403 7.755 266 HG23 THR 34 HG23 THR 34 -2.209 -1.199 7.799 267 H VAL 35 H VAL 35 -2.581 -2.803 12.579 268 HA VAL 35 HA VAL 35 -4.660 -4.845 12.694 269 HB VAL 35 HB VAL 35 -2.584 -5.279 13.914 270 HG11 VAL 35 HG11 VAL 35 -1.566 -3.818 15.263 271 HG12 VAL 35 HG12 VAL 35 -3.068 -3.389 16.081 272 HG13 VAL 35 HG13 VAL 35 -2.641 -2.612 14.557 273 HG21 VAL 35 HG21 VAL 35 -4.708 -4.811 15.979 274 HG22 VAL 35 HG22 VAL 35 -3.561 -6.144 15.848 275 HG23 VAL 35 HG23 VAL 35 -4.907 -6.025 14.715 276 H GLY 36 H GLY 36 -6.615 -3.859 12.537 277 HA2 GLY 36 HA3 GLY 36 -8.467 -3.012 13.761 278 HA3 GLY 36 HA2 GLY 36 -7.351 -2.106 14.770 279 H LYS 37 H LYS 37 -6.639 -1.906 11.448 280 HA LYS 37 HA LYS 37 -7.952 0.729 11.317 281 HB2 LYS 37 HB3 LYS 37 -5.227 -0.176 10.612 282 HB3 LYS 37 HB2 LYS 37 -5.982 0.921 9.464 283 HG2 LYS 37 HG3 LYS 37 -6.228 2.612 11.110 284 HG3 LYS 37 HG2 LYS 37 -5.786 1.500 12.407 285 HD2 LYS 37 HD3 LYS 37 -3.874 2.836 11.994 286 HD3 LYS 37 HD2 LYS 37 -3.542 1.262 11.269 287 HE2 LYS 37 HE3 LYS 37 -3.811 2.061 9.105 288 HE3 LYS 37 HE2 LYS 37 -4.746 3.459 9.634 289 HZ1 LYS 37 HZ1 LYS 37 -1.861 3.092 9.516 290 HZ2 LYS 37 HZ2 LYS 37 -2.449 3.960 10.843 291 HZ3 LYS 37 HZ3 LYS 37 -2.787 4.487 9.272 292 H ILE 38 H ILE 38 -7.760 1.373 8.736 293 HA ILE 38 HA ILE 38 -9.184 -0.803 7.349 294 HB ILE 38 HB ILE 38 -9.705 1.748 6.126 295 HG12 ILE 38 HG13 ILE 38 -10.730 1.589 8.958 296 HG13 ILE 38 HG12 ILE 38 -9.276 2.490 8.545 297 HG21 ILE 38 HG21 ILE 38 -11.838 0.311 7.567 298 HG22 ILE 38 HG22 ILE 38 -10.955 -0.613 6.352 299 HG23 ILE 38 HG23 ILE 38 -11.776 0.880 5.900 300 HD11 ILE 38 HD11 ILE 38 -12.015 3.266 8.311 301 HD12 ILE 38 HD12 ILE 38 -11.233 3.327 6.732 302 HD13 ILE 38 HD13 ILE 38 -10.555 4.228 8.087 303 H MET 39 H MET 39 -8.104 -1.650 5.715 304 HA MET 39 HA MET 39 -6.058 -0.016 4.373 305 HB2 MET 39 HB3 MET 39 -5.086 -1.961 5.359 306 HB3 MET 39 HB2 MET 39 -6.345 -3.000 4.709 307 HG2 MET 39 HG3 MET 39 -4.645 -1.478 2.807 308 HG3 MET 39 HG2 MET 39 -3.953 -2.877 3.625 309 HE1 MET 39 HE1 MET 39 -7.059 -4.796 3.560 310 HE2 MET 39 HE2 MET 39 -5.349 -4.973 3.955 311 HE3 MET 39 HE3 MET 39 -6.024 -5.817 2.561 312 H VAL 40 H VAL 40 -6.343 0.572 2.328 313 HA VAL 40 HA VAL 40 -8.656 -0.434 0.868 314 HB VAL 40 HB VAL 40 -6.727 1.730 0.024 315 HG11 VAL 40 HG11 VAL 40 -9.094 2.358 -1.095 316 HG12 VAL 40 HG12 VAL 40 -9.218 0.599 -1.074 317 HG13 VAL 40 HG13 VAL 40 -7.864 1.377 -1.893 318 HG21 VAL 40 HG21 VAL 40 -8.953 1.759 1.959 319 HG22 VAL 40 HG22 VAL 40 -8.927 3.080 0.791 320 HG23 VAL 40 HG23 VAL 40 -7.537 2.802 1.840 321 H VAL 41 H VAL 41 -8.546 -1.428 -1.153 322 HA VAL 41 HA VAL 41 -5.905 -2.064 -2.222 323 HB VAL 41 HB VAL 41 -6.993 -3.863 -0.550 324 HG11 VAL 41 HG11 VAL 41 -7.818 -5.038 -3.170 325 HG12 VAL 41 HG12 VAL 41 -8.943 -4.035 -2.255 326 HG13 VAL 41 HG13 VAL 41 -8.285 -5.502 -1.533 327 HG21 VAL 41 HG21 VAL 41 -4.986 -3.847 -2.577 328 HG22 VAL 41 HG22 VAL 41 -5.759 -5.432 -2.539 329 HG23 VAL 41 HG23 VAL 41 -5.041 -4.765 -1.073 330 H GLY 42 H GLY 42 -5.852 -2.417 -4.417 331 HA2 GLY 42 HA3 GLY 42 -8.089 -1.452 -5.922 332 HA3 GLY 42 HA2 GLY 42 -6.569 -2.043 -6.580 333 H ARG 43 H ARG 43 -8.655 -2.713 -8.035 334 HA ARG 43 HA ARG 43 -10.149 -4.941 -7.308 335 HB2 ARG 43 HB3 ARG 43 -10.755 -3.660 -9.242 336 HB3 ARG 43 HB2 ARG 43 -9.217 -4.011 -10.018 337 HG2 ARG 43 HG3 ARG 43 -9.967 -6.480 -9.871 338 HG3 ARG 43 HG2 ARG 43 -11.575 -5.804 -9.610 339 HD2 ARG 43 HD3 ARG 43 -9.788 -5.156 -11.949 340 HD3 ARG 43 HD2 ARG 43 -11.103 -6.330 -11.979 341 HE ARG 43 HE ARG 43 -11.764 -3.606 -11.188 342 HH11 ARG 43 HH11 ARG 43 -11.739 -6.030 -13.710 343 HH12 ARG 43 HH12 ARG 43 -12.987 -5.262 -14.630 344 HH21 ARG 43 HH21 ARG 43 -13.411 -2.612 -12.399 345 HH22 ARG 43 HH22 ARG 43 -13.933 -3.320 -13.889 346 H ARG 44 H ARG 44 -7.313 -4.927 -9.460 347 HA ARG 44 HA ARG 44 -6.984 -7.704 -9.516 348 HB2 ARG 44 HB3 ARG 44 -5.124 -5.410 -10.075 349 HB3 ARG 44 HB2 ARG 44 -4.575 -7.077 -10.190 350 HG2 ARG 44 HG3 ARG 44 -6.907 -5.947 -11.720 351 HG3 ARG 44 HG2 ARG 44 -5.266 -6.095 -12.353 352 HD2 ARG 44 HD3 ARG 44 -6.187 -8.037 -13.142 353 HD3 ARG 44 HD2 ARG 44 -5.548 -8.594 -11.596 354 HE ARG 44 HE ARG 44 -8.253 -7.675 -11.414 355 HH11 ARG 44 HH11 ARG 44 -6.240 -10.400 -12.252 356 HH12 ARG 44 HH12 ARG 44 -7.477 -11.570 -11.939 357 HH21 ARG 44 HH21 ARG 44 -9.881 -9.213 -11.001 358 HH22 ARG 44 HH22 ARG 44 -9.545 -10.897 -11.229 359 H THR 45 H THR 45 -6.230 -5.439 -7.059 360 HA THR 45 HA THR 45 -4.149 -7.024 -5.858 361 HB THR 45 HB THR 45 -5.591 -4.826 -4.424 362 HG1 THR 45 HG1 THR 45 -5.023 -3.449 -5.878 363 HG21 THR 45 HG21 THR 45 -3.286 -4.263 -3.705 364 HG22 THR 45 HG22 THR 45 -2.720 -5.710 -4.539 365 HG23 THR 45 HG23 THR 45 -3.832 -5.855 -3.178 366 H TYR 46 H TYR 46 -7.562 -6.279 -5.050 367 HA TYR 46 HA TYR 46 -7.681 -7.696 -2.667 368 HB2 TYR 46 HB3 TYR 46 -10.057 -7.716 -2.875 369 HB3 TYR 46 HB2 TYR 46 -9.501 -6.219 -3.606 370 HD1 TYR 46 HD2 TYR 46 -10.208 -9.743 -4.684 371 HD2 TYR 46 HD1 TYR 46 -10.562 -5.589 -5.554 372 HE1 TYR 46 HE2 TYR 46 -11.429 -10.283 -6.733 373 HE2 TYR 46 HE1 TYR 46 -11.801 -6.130 -7.605 374 HH TYR 46 HH TYR 46 -13.024 -7.851 -8.629 375 H GLU 47 H GLU 47 -7.988 -8.866 -5.981 376 HA GLU 47 HA GLU 47 -8.504 -11.580 -5.124 377 HB2 GLU 47 HB3 GLU 47 -8.746 -10.087 -7.552 378 HB3 GLU 47 HB2 GLU 47 -7.748 -11.502 -7.862 379 HG2 GLU 47 HG3 GLU 47 -10.274 -11.858 -6.348 380 HG3 GLU 47 HG2 GLU 47 -10.363 -11.576 -8.085 381 H SER 48 H SER 48 -5.786 -9.617 -5.796 382 HA SER 48 HA SER 48 -4.019 -11.909 -6.206 383 HB2 SER 48 HB3 SER 48 -3.588 -8.930 -6.388 384 HB3 SER 48 HB2 SER 48 -2.257 -10.082 -6.460 385 HG SER 48 HG SER 48 -3.470 -11.082 -8.230 386 H PHE 49 H PHE 49 -5.367 -10.754 -3.566 387 HA PHE 49 HA PHE 49 -2.939 -10.536 -1.955 388 HB2 PHE 49 HB3 PHE 49 -5.434 -9.284 -1.816 389 HB3 PHE 49 HB2 PHE 49 -5.418 -10.399 -0.454 390 HD1 PHE 49 HD1 PHE 49 -3.309 -7.796 -2.088 391 HD2 PHE 49 HD2 PHE 49 -4.434 -9.747 1.524 392 HE1 PHE 49 HE1 PHE 49 -1.940 -6.205 -0.806 393 HE2 PHE 49 HE2 PHE 49 -3.067 -8.158 2.812 394 HZ PHE 49 HZ PHE 49 -1.818 -6.384 1.647 395 HA PRO 50 HA PRO 50 -3.327 -14.766 -0.664 396 HB2 PRO 50 HB3 PRO 50 -1.557 -14.766 1.359 397 HB3 PRO 50 HB2 PRO 50 -1.046 -14.621 -0.327 398 HG2 PRO 50 HG3 PRO 50 -1.373 -12.484 1.743 399 HG3 PRO 50 HG2 PRO 50 -0.071 -12.705 0.560 400 HD2 PRO 50 HD3 PRO 50 -2.138 -10.949 0.222 401 HD3 PRO 50 HD2 PRO 50 -1.267 -11.709 -1.124 402 H LYS 51 H LYS 51 -3.877 -12.097 1.520 403 HA LYS 51 HA LYS 51 -5.562 -13.858 3.173 404 HB2 LYS 51 HB3 LYS 51 -3.535 -11.830 3.996 405 HB3 LYS 51 HB2 LYS 51 -4.977 -12.014 4.986 406 HG2 LYS 51 HG3 LYS 51 -3.152 -14.287 4.244 407 HG3 LYS 51 HG2 LYS 51 -3.016 -13.353 5.735 408 HD2 LYS 51 HD3 LYS 51 -5.727 -14.183 5.423 409 HD3 LYS 51 HD2 LYS 51 -4.680 -15.585 5.199 410 HE2 LYS 51 HE3 LYS 51 -3.512 -14.896 7.330 411 HE3 LYS 51 HE2 LYS 51 -4.820 -13.739 7.572 412 HZ1 LYS 51 HZ1 LYS 51 -6.213 -15.953 7.129 413 HZ2 LYS 51 HZ2 LYS 51 -5.722 -15.467 8.673 414 HZ3 LYS 51 HZ3 LYS 51 -4.832 -16.633 7.832 415 H ARG 52 H ARG 52 -7.274 -13.189 1.720 416 HA ARG 52 HA ARG 52 -8.259 -10.482 2.328 417 HB2 ARG 52 HB3 ARG 52 -9.490 -10.683 0.117 418 HB3 ARG 52 HB2 ARG 52 -7.746 -10.480 0.023 419 HG2 ARG 52 HG3 ARG 52 -7.459 -12.446 -0.987 420 HG3 ARG 52 HG2 ARG 52 -8.571 -13.273 0.105 421 HD2 ARG 52 HD3 ARG 52 -10.443 -12.690 -1.186 422 HD3 ARG 52 HD2 ARG 52 -9.553 -11.450 -2.069 423 HE ARG 52 HE ARG 52 -8.800 -13.064 -3.508 424 HH11 ARG 52 HH11 ARG 52 -10.112 -14.609 -0.668 425 HH12 ARG 52 HH12 ARG 52 -10.017 -16.202 -1.337 426 HH21 ARG 52 HH21 ARG 52 -8.674 -15.159 -4.391 427 HH22 ARG 52 HH22 ARG 52 -9.199 -16.516 -3.451 428 HA PRO 53 HA PRO 53 -9.414 -9.562 3.368 429 HB2 PRO 53 HB3 PRO 53 -10.928 -9.084 5.501 430 HB3 PRO 53 HB2 PRO 53 -11.622 -9.042 3.875 431 HG2 PRO 53 HG3 PRO 53 -11.804 -11.171 5.959 432 HG3 PRO 53 HG2 PRO 53 -13.041 -10.602 4.825 433 HD2 PRO 53 HD3 PRO 53 -11.450 -12.876 4.500 434 HD3 PRO 53 HD2 PRO 53 -12.373 -12.066 3.220 435 H LEU 54 H LEU 54 -8.118 -8.740 5.086 436 HA LEU 54 HA LEU 54 -6.551 -10.690 6.422 437 HB2 LEU 54 HB3 LEU 54 -6.673 -7.691 6.548 438 HB3 LEU 54 HB2 LEU 54 -5.598 -8.607 7.586 439 HG LEU 54 HG LEU 54 -5.474 -9.101 4.650 440 HD11 LEU 54 HD11 LEU 54 -4.175 -7.220 4.179 441 HD12 LEU 54 HD12 LEU 54 -3.962 -6.825 5.885 442 HD13 LEU 54 HD13 LEU 54 -5.530 -6.585 5.112 443 HD21 LEU 54 HD21 LEU 54 -4.152 -10.228 6.621 444 HD22 LEU 54 HD22 LEU 54 -3.147 -8.786 6.480 445 HD23 LEU 54 HD23 LEU 54 -3.357 -9.854 5.092 446 HA PRO 55 HA PRO 55 -8.971 -11.167 10.104 447 HB2 PRO 55 HB3 PRO 55 -6.556 -12.008 11.516 448 HB3 PRO 55 HB2 PRO 55 -7.969 -12.959 11.055 449 HG2 PRO 55 HG3 PRO 55 -5.550 -13.285 9.889 450 HG3 PRO 55 HG2 PRO 55 -7.075 -13.549 9.024 451 HD2 PRO 55 HD3 PRO 55 -5.236 -11.185 8.948 452 HD3 PRO 55 HD2 PRO 55 -6.097 -11.988 7.618 453 H GLU 56 H GLU 56 -9.340 -10.293 12.126 454 HA GLU 56 HA GLU 56 -9.429 -8.603 13.642 455 HB2 GLU 56 HB3 GLU 56 -6.526 -9.346 13.571 456 HB3 GLU 56 HB2 GLU 56 -7.090 -8.062 14.631 457 HG2 GLU 56 HG3 GLU 56 -7.327 -9.744 16.093 458 HG3 GLU 56 HG2 GLU 56 -8.860 -9.981 15.256 459 H ARG 57 H ARG 57 -9.183 -7.746 10.820 460 HA ARG 57 HA ARG 57 -8.541 -4.982 11.400 461 HB2 ARG 57 HB3 ARG 57 -6.884 -4.648 9.789 462 HB3 ARG 57 HB2 ARG 57 -6.425 -6.161 10.551 463 HG2 ARG 57 HG3 ARG 57 -6.119 -6.661 8.339 464 HG3 ARG 57 HG2 ARG 57 -7.766 -7.238 8.594 465 HD2 ARG 57 HD3 ARG 57 -7.206 -5.777 6.511 466 HD3 ARG 57 HD2 ARG 57 -8.701 -5.504 7.399 467 HE ARG 57 HE ARG 57 -7.905 -3.455 8.074 468 HH11 ARG 57 HH11 ARG 57 -5.313 -5.281 6.612 469 HH12 ARG 57 HH12 ARG 57 -4.234 -3.929 6.544 470 HH21 ARG 57 HH21 ARG 57 -6.488 -1.680 7.986 471 HH22 ARG 57 HH22 ARG 57 -4.900 -1.883 7.326 472 H THR 58 H THR 58 -9.223 -3.503 9.664 473 HA THR 58 HA THR 58 -11.628 -4.545 8.360 474 HB THR 58 HB THR 58 -10.871 -1.643 8.415 475 HG1 THR 58 HG1 THR 58 -12.139 -3.018 10.544 476 HG21 THR 58 HG21 THR 58 -13.026 -2.833 7.366 477 HG22 THR 58 HG22 THR 58 -13.042 -1.203 8.040 478 HG23 THR 58 HG23 THR 58 -13.601 -2.564 9.012 479 H ASN 59 H ASN 59 -11.617 -4.992 6.258 480 HA ASN 59 HA ASN 59 -9.399 -3.987 4.633 481 HB2 ASN 59 HB3 ASN 59 -11.325 -6.270 4.195 482 HB3 ASN 59 HB2 ASN 59 -10.113 -5.768 3.020 483 HD21 ASN 59 HD21 ASN 59 -10.490 -6.810 6.371 484 HD22 ASN 59 HD22 ASN 59 -8.980 -7.642 6.469 485 H VAL 60 H VAL 60 -9.671 -2.968 2.699 486 HA VAL 60 HA VAL 60 -12.396 -2.195 1.919 487 HB VAL 60 HB VAL 60 -10.034 -0.326 2.198 488 HG11 VAL 60 HG11 VAL 60 -12.059 1.307 1.540 489 HG12 VAL 60 HG12 VAL 60 -12.515 -0.120 0.608 490 HG13 VAL 60 HG13 VAL 60 -10.938 0.630 0.358 491 HG21 VAL 60 HG21 VAL 60 -12.202 0.784 3.477 492 HG22 VAL 60 HG22 VAL 60 -10.871 -0.075 4.252 493 HG23 VAL 60 HG23 VAL 60 -12.356 -0.934 3.845 494 H VAL 61 H VAL 61 -12.747 -2.185 -0.266 495 HA VAL 61 HA VAL 61 -10.404 -2.731 -1.973 496 HB VAL 61 HB VAL 61 -13.179 -3.861 -2.346 497 HG11 VAL 61 HG11 VAL 61 -11.836 -5.379 -3.938 498 HG12 VAL 61 HG12 VAL 61 -10.617 -4.106 -3.880 499 HG13 VAL 61 HG13 VAL 61 -12.239 -3.747 -4.472 500 HG21 VAL 61 HG21 VAL 61 -12.479 -5.868 -1.432 501 HG22 VAL 61 HG22 VAL 61 -11.706 -4.688 -0.373 502 HG23 VAL 61 HG23 VAL 61 -10.770 -5.486 -1.638 503 H LEU 62 H LEU 62 -10.560 -2.097 -4.184 504 HA LEU 62 HA LEU 62 -12.616 -0.122 -4.839 505 HB2 LEU 62 HB3 LEU 62 -10.553 1.011 -3.895 506 HB3 LEU 62 HB2 LEU 62 -9.685 0.418 -5.297 507 HG LEU 62 HG LEU 62 -11.558 1.653 -6.644 508 HD11 LEU 62 HD11 LEU 62 -12.367 3.662 -5.502 509 HD12 LEU 62 HD12 LEU 62 -11.648 3.090 -3.997 510 HD13 LEU 62 HD13 LEU 62 -12.967 2.188 -4.744 511 HD21 LEU 62 HD21 LEU 62 -9.305 2.330 -6.862 512 HD22 LEU 62 HD22 LEU 62 -9.256 2.962 -5.217 513 HD23 LEU 62 HD23 LEU 62 -10.211 3.788 -6.450 514 H THR 63 H THR 63 -13.531 -0.997 -6.579 515 HA THR 63 HA THR 63 -11.797 -1.868 -8.783 516 HB THR 63 HB THR 63 -12.620 -3.906 -7.845 517 HG1 THR 63 HG1 THR 63 -13.057 -4.498 -9.792 518 HG21 THR 63 HG21 THR 63 -15.239 -2.485 -7.670 519 HG22 THR 63 HG22 THR 63 -14.392 -3.436 -6.450 520 HG23 THR 63 HG23 THR 63 -15.180 -4.243 -7.806 521 H HIS 64 H HIS 64 -12.666 -1.530 -10.894 522 HA HIS 64 HA HIS 64 -14.257 0.818 -11.113 523 HB2 HIS 64 HB3 HIS 64 -12.910 -1.032 -13.006 524 HB3 HIS 64 HB2 HIS 64 -14.240 -0.076 -13.646 525 HD1 HIS 64 HD1 HIS 64 -13.702 2.571 -12.146 526 HD2 HIS 64 HD2 HIS 64 -10.778 0.303 -14.037 527 HE1 HIS 64 HE1 HIS 64 -11.828 4.171 -12.648 528 HE2 HIS 64 HE2 HIS 64 -10.110 2.796 -13.874 529 H GLN 65 H GLN 65 -14.933 -2.598 -11.285 530 HA GLN 65 HA GLN 65 -17.377 -2.579 -12.618 531 HB2 GLN 65 HB3 GLN 65 -16.177 -4.381 -10.544 532 HB3 GLN 65 HB2 GLN 65 -17.832 -4.636 -11.080 533 HG2 GLN 65 HG3 GLN 65 -17.195 -5.233 -13.210 534 HG3 GLN 65 HG2 GLN 65 -15.653 -4.386 -13.099 535 HE21 GLN 65 HE21 GLN 65 -14.458 -5.324 -10.951 536 HE22 GLN 65 HE22 GLN 65 -14.228 -7.034 -11.032 537 H GLU 66 H GLU 66 -19.351 -1.884 -12.114 538 HA GLU 66 HA GLU 66 -19.768 -0.566 -9.576 539 HB2 GLU 66 HB3 GLU 66 -21.847 0.228 -10.536 540 HB3 GLU 66 HB2 GLU 66 -20.537 0.458 -11.685 541 HG2 GLU 66 HG3 GLU 66 -22.171 -0.366 -13.049 542 HG3 GLU 66 HG2 GLU 66 -21.332 -1.852 -12.607 543 H ASP 67 H ASP 67 -20.751 -3.525 -11.145 544 HA ASP 67 HA ASP 67 -22.638 -4.087 -8.974 545 HB2 ASP 67 HB3 ASP 67 -22.970 -4.428 -11.627 546 HB3 ASP 67 HB2 ASP 67 -22.343 -6.017 -11.199 547 H TYR 68 H TYR 68 -19.583 -4.288 -8.868 548 HA TYR 68 HA TYR 68 -19.179 -7.134 -8.492 549 HB2 TYR 68 HB3 TYR 68 -17.393 -5.616 -9.403 550 HB3 TYR 68 HB2 TYR 68 -17.272 -4.894 -7.801 551 HD1 TYR 68 HD1 TYR 68 -17.215 -8.270 -9.405 552 HD2 TYR 68 HD2 TYR 68 -15.659 -5.727 -6.370 553 HE1 TYR 68 HE1 TYR 68 -15.646 -10.040 -8.735 554 HE2 TYR 68 HE2 TYR 68 -14.083 -7.490 -5.693 555 HH TYR 68 HH TYR 68 -13.556 -10.308 -7.577 556 H GLN 69 H GLN 69 -18.912 -8.190 -6.560 557 HA GLN 69 HA GLN 69 -19.421 -6.625 -4.119 558 HB2 GLN 69 HB3 GLN 69 -20.657 -9.246 -4.953 559 HB3 GLN 69 HB2 GLN 69 -20.682 -8.670 -3.292 560 HG2 GLN 69 HG3 GLN 69 -21.919 -7.329 -5.684 561 HG3 GLN 69 HG2 GLN 69 -22.764 -8.141 -4.367 562 HE21 GLN 69 HE21 GLN 69 -21.488 -5.230 -5.502 563 HE22 GLN 69 HE22 GLN 69 -21.712 -4.286 -4.073 564 H ALA 70 H ALA 70 -17.656 -6.716 -2.911 565 HA ALA 70 HA ALA 70 -15.966 -9.104 -2.982 566 HB1 ALA 70 HB1 ALA 70 -15.330 -6.530 -1.566 567 HB2 ALA 70 HB2 ALA 70 -15.025 -6.764 -3.288 568 HB3 ALA 70 HB3 ALA 70 -14.220 -7.792 -2.102 569 H GLN 71 H GLN 71 -16.644 -10.611 -1.610 570 HA GLN 71 HA GLN 71 -18.045 -10.082 0.795 571 HB2 GLN 71 HB3 GLN 71 -16.606 -12.634 0.065 572 HB3 GLN 71 HB2 GLN 71 -17.953 -12.450 1.181 573 HG2 GLN 71 HG3 GLN 71 -19.449 -12.628 -0.447 574 HG3 GLN 71 HG2 GLN 71 -18.600 -11.461 -1.460 575 HE21 GLN 71 HE21 GLN 71 -17.447 -12.169 -3.150 576 HE22 GLN 71 HE22 GLN 71 -17.203 -13.832 -3.551 577 H GLY 72 H GLY 72 -17.293 -9.555 2.728 578 HA2 GLY 72 HA3 GLY 72 -15.809 -9.929 4.569 579 HA3 GLY 72 HA2 GLY 72 -14.537 -10.307 3.418 580 H ALA 73 H ALA 73 -15.125 -7.940 1.711 581 HA ALA 73 HA ALA 73 -14.270 -5.821 3.573 582 HB1 ALA 73 HB1 ALA 73 -12.287 -6.631 2.485 583 HB2 ALA 73 HB2 ALA 73 -12.684 -5.040 1.837 584 HB3 ALA 73 HB3 ALA 73 -13.050 -6.489 0.901 585 H VAL 74 H VAL 74 -14.367 -3.619 2.507 586 HA VAL 74 HA VAL 74 -16.998 -3.298 1.341 587 HB VAL 74 HB VAL 74 -15.026 -1.077 1.843 588 HG11 VAL 74 HG11 VAL 74 -18.026 -1.058 2.066 589 HG12 VAL 74 HG12 VAL 74 -17.172 -0.704 0.564 590 HG13 VAL 74 HG13 VAL 74 -16.928 0.320 1.979 591 HG21 VAL 74 HG21 VAL 74 -15.883 -0.854 4.098 592 HG22 VAL 74 HG22 VAL 74 -15.187 -2.460 3.880 593 HG23 VAL 74 HG23 VAL 74 -16.937 -2.249 3.864 594 H VAL 75 H VAL 75 -17.452 -2.382 -0.684 595 HA VAL 75 HA VAL 75 -15.150 -2.181 -2.509 596 HB VAL 75 HB VAL 75 -17.893 -3.191 -3.261 597 HG11 VAL 75 HG11 VAL 75 -15.299 -2.897 -4.749 598 HG12 VAL 75 HG12 VAL 75 -16.886 -2.251 -5.167 599 HG13 VAL 75 HG13 VAL 75 -16.578 -3.983 -5.292 600 HG21 VAL 75 HG21 VAL 75 -15.461 -4.590 -2.293 601 HG22 VAL 75 HG22 VAL 75 -16.383 -5.341 -3.596 602 HG23 VAL 75 HG23 VAL 75 -17.164 -4.982 -2.056 603 H VAL 76 H VAL 76 -15.031 -0.388 -3.730 604 HA VAL 76 HA VAL 76 -17.418 1.281 -4.032 605 HB VAL 76 HB VAL 76 -15.907 3.314 -3.639 606 HG11 VAL 76 HG11 VAL 76 -17.538 3.145 -2.056 607 HG12 VAL 76 HG12 VAL 76 -16.122 2.878 -1.039 608 HG13 VAL 76 HG13 VAL 76 -17.079 1.505 -1.596 609 HG21 VAL 76 HG21 VAL 76 -14.027 1.234 -3.153 610 HG22 VAL 76 HG22 VAL 76 -14.283 2.115 -1.647 611 HG23 VAL 76 HG23 VAL 76 -13.780 2.979 -3.100 612 H HIS 77 H HIS 77 -17.477 2.518 -5.880 613 HA HIS 77 HA HIS 77 -15.247 2.147 -7.768 614 HB2 HIS 77 HB3 HIS 77 -17.776 2.530 -9.123 615 HB3 HIS 77 HB2 HIS 77 -16.607 1.226 -9.297 616 HD1 HIS 77 HD1 HIS 77 -16.888 -0.786 -7.527 617 HD2 HIS 77 HD2 HIS 77 -20.102 1.823 -7.881 618 HE1 HIS 77 HE1 HIS 77 -18.846 -1.993 -6.514 619 HE2 HIS 77 HE2 HIS 77 -20.759 -0.359 -6.656 620 H ASP 78 H ASP 78 -15.052 4.280 -6.283 621 HA ASP 78 HA ASP 78 -15.222 6.426 -8.098 622 HB2 ASP 78 HB3 ASP 78 -17.454 6.093 -6.260 623 HB3 ASP 78 HB2 ASP 78 -16.631 7.628 -6.003 624 H VAL 79 H VAL 79 -13.846 8.118 -7.436 625 HA VAL 79 HA VAL 79 -11.986 7.412 -5.392 626 HB VAL 79 HB VAL 79 -12.265 10.032 -6.873 627 HG11 VAL 79 HG11 VAL 79 -9.872 8.940 -5.398 628 HG12 VAL 79 HG12 VAL 79 -10.984 10.137 -4.732 629 HG13 VAL 79 HG13 VAL 79 -10.028 10.522 -6.164 630 HG21 VAL 79 HG21 VAL 79 -11.842 7.848 -8.180 631 HG22 VAL 79 HG22 VAL 79 -10.239 7.894 -7.444 632 HG23 VAL 79 HG23 VAL 79 -10.776 9.223 -8.474 633 H ALA 80 H ALA 80 -14.384 9.974 -5.742 634 HA ALA 80 HA ALA 80 -14.052 11.021 -3.126 635 HB1 ALA 80 HB1 ALA 80 -16.477 11.251 -4.906 636 HB2 ALA 80 HB2 ALA 80 -15.050 12.281 -5.021 637 HB3 ALA 80 HB3 ALA 80 -16.040 12.306 -3.562 638 H ALA 81 H ALA 81 -15.815 8.340 -4.443 639 HA ALA 81 HA ALA 81 -17.814 8.016 -2.517 640 HB1 ALA 81 HB1 ALA 81 -16.332 6.052 -4.243 641 HB2 ALA 81 HB2 ALA 81 -17.977 6.661 -4.428 642 HB3 ALA 81 HB3 ALA 81 -17.593 5.540 -3.121 643 H VAL 82 H VAL 82 -14.848 6.045 -2.673 644 HA VAL 82 HA VAL 82 -14.902 4.979 -0.169 645 HB VAL 82 HB VAL 82 -13.228 4.592 -2.088 646 HG11 VAL 82 HG11 VAL 82 -11.514 6.509 -0.550 647 HG12 VAL 82 HG12 VAL 82 -12.441 7.016 -1.962 648 HG13 VAL 82 HG13 VAL 82 -11.210 5.766 -2.119 649 HG21 VAL 82 HG21 VAL 82 -13.255 3.425 0.121 650 HG22 VAL 82 HG22 VAL 82 -12.096 4.622 0.701 651 HG23 VAL 82 HG23 VAL 82 -11.661 3.544 -0.626 652 H PHE 83 H PHE 83 -13.702 8.188 -1.091 653 HA PHE 83 HA PHE 83 -12.502 8.887 1.328 654 HB2 PHE 83 HB3 PHE 83 -13.492 10.301 -1.036 655 HB3 PHE 83 HB2 PHE 83 -13.592 11.263 0.435 656 HD1 PHE 83 HD2 PHE 83 -11.278 10.598 1.950 657 HD2 PHE 83 HD1 PHE 83 -11.679 10.963 -2.271 658 HE1 PHE 83 HE2 PHE 83 -8.881 11.122 1.772 659 HE2 PHE 83 HE1 PHE 83 -9.283 11.486 -2.457 660 HZ PHE 83 HZ PHE 83 -7.880 11.567 -0.434 661 H ALA 84 H ALA 84 -15.892 9.090 0.339 662 HA ALA 84 HA ALA 84 -16.822 10.489 2.601 663 HB1 ALA 84 HB1 ALA 84 -18.167 10.227 0.567 664 HB2 ALA 84 HB2 ALA 84 -19.040 9.660 1.990 665 HB3 ALA 84 HB3 ALA 84 -18.309 8.498 0.884 666 H TYR 85 H TYR 85 -16.250 7.095 1.962 667 HA TYR 85 HA TYR 85 -17.446 6.076 4.305 668 HB2 TYR 85 HB3 TYR 85 -16.858 4.113 3.392 669 HB3 TYR 85 HB2 TYR 85 -16.067 5.002 2.102 670 HD1 TYR 85 HD1 TYR 85 -15.360 3.812 5.584 671 HD2 TYR 85 HD2 TYR 85 -13.864 4.525 1.669 672 HE1 TYR 85 HE1 TYR 85 -13.204 2.821 6.232 673 HE2 TYR 85 HE2 TYR 85 -11.705 3.542 2.305 674 HH TYR 85 HH TYR 85 -10.406 3.011 4.186 675 H ALA 86 H ALA 86 -13.984 6.650 3.610 676 HA ALA 86 HA ALA 86 -12.867 6.270 6.030 677 HB1 ALA 86 HB1 ALA 86 -11.928 7.288 3.767 678 HB2 ALA 86 HB2 ALA 86 -11.061 7.440 5.295 679 HB3 ALA 86 HB3 ALA 86 -12.034 8.784 4.696 680 H LYS 87 H LYS 87 -14.759 9.137 5.118 681 HA LYS 87 HA LYS 87 -14.241 10.629 7.463 682 HB2 LYS 87 HB3 LYS 87 -15.565 11.149 5.162 683 HB3 LYS 87 HB2 LYS 87 -16.930 10.859 6.231 684 HG2 LYS 87 HG3 LYS 87 -16.517 13.185 6.254 685 HG3 LYS 87 HG2 LYS 87 -15.936 12.551 7.796 686 HD2 LYS 87 HD3 LYS 87 -14.069 13.708 7.316 687 HD3 LYS 87 HD2 LYS 87 -13.703 12.345 6.255 688 HE2 LYS 87 HE3 LYS 87 -15.399 14.531 5.175 689 HE3 LYS 87 HE2 LYS 87 -13.680 14.858 5.394 690 HZ1 LYS 87 HZ1 LYS 87 -13.112 13.455 3.744 691 HZ2 LYS 87 HZ2 LYS 87 -14.685 13.758 3.202 692 HZ3 LYS 87 HZ3 LYS 87 -14.351 12.353 4.080 693 H GLN 88 H GLN 88 -16.805 8.395 6.579 694 HA GLN 88 HA GLN 88 -18.314 8.496 8.931 695 HB2 GLN 88 HB3 GLN 88 -18.465 7.103 6.554 696 HB3 GLN 88 HB2 GLN 88 -18.183 5.827 7.730 697 HG2 GLN 88 HG3 GLN 88 -20.168 6.209 8.827 698 HG3 GLN 88 HG2 GLN 88 -20.281 7.875 8.262 699 HE21 GLN 88 HE21 GLN 88 -20.112 7.764 5.635 700 HE22 GLN 88 HE22 GLN 88 -21.359 6.786 4.949 701 H HIS 89 H HIS 89 -15.255 7.069 8.297 702 HA HIS 89 HA HIS 89 -15.318 5.655 10.878 703 HB2 HIS 89 HB3 HIS 89 -14.020 5.083 8.270 704 HB3 HIS 89 HB2 HIS 89 -13.092 4.685 9.714 705 HD1 HIS 89 HD1 HIS 89 -15.305 3.591 11.518 706 HD2 HIS 89 HD2 HIS 89 -14.939 2.653 7.486 707 HE1 HIS 89 HE1 HIS 89 -16.507 1.401 11.225 708 HE2 HIS 89 HE2 HIS 89 -16.349 0.899 8.761 709 HA PRO 90 HA PRO 90 -12.601 9.361 11.465 710 HB2 PRO 90 HB3 PRO 90 -13.362 9.833 14.026 711 HB3 PRO 90 HB2 PRO 90 -14.254 10.442 12.628 712 HG2 PRO 90 HG3 PRO 90 -14.807 8.039 14.326 713 HG3 PRO 90 HG2 PRO 90 -15.940 9.255 13.708 714 HD2 PRO 90 HD3 PRO 90 -15.638 6.831 12.547 715 HD3 PRO 90 HD2 PRO 90 -16.028 8.291 11.614 716 H ASP 91 H ASP 91 -13.215 6.784 13.873 717 HA ASP 91 HA ASP 91 -10.712 7.091 15.162 718 HB2 ASP 91 HB3 ASP 91 -12.939 5.911 15.931 719 HB3 ASP 91 HB2 ASP 91 -12.183 4.490 15.217 720 H GLN 92 H GLN 92 -11.648 5.489 12.263 721 HA GLN 92 HA GLN 92 -9.162 3.928 12.254 722 HB2 GLN 92 HB3 GLN 92 -11.392 3.698 10.244 723 HB3 GLN 92 HB2 GLN 92 -10.123 2.534 10.601 724 HG2 GLN 92 HG3 GLN 92 -11.221 2.516 12.972 725 HG3 GLN 92 HG2 GLN 92 -12.622 3.134 12.099 726 HE21 GLN 92 HE21 GLN 92 -13.989 1.519 11.855 727 HE22 GLN 92 HE22 GLN 92 -13.598 -0.068 11.296 728 H GLU 93 H GLU 93 -7.632 4.160 10.670 729 HA GLU 93 HA GLU 93 -7.854 6.596 9.048 730 HB2 GLU 93 HB3 GLU 93 -5.603 5.157 10.341 731 HB3 GLU 93 HB2 GLU 93 -5.261 5.943 8.806 732 HG2 GLU 93 HG3 GLU 93 -4.761 7.647 10.211 733 HG3 GLU 93 HG2 GLU 93 -6.478 7.970 9.979 734 H LEU 94 H LEU 94 -6.861 6.551 6.879 735 HA LEU 94 HA LEU 94 -7.511 4.024 5.539 736 HB2 LEU 94 HB3 LEU 94 -7.767 6.854 4.856 737 HB3 LEU 94 HB2 LEU 94 -7.076 5.897 3.559 738 HG LEU 94 HG LEU 94 -9.014 4.441 3.536 739 HD11 LEU 94 HD11 LEU 94 -11.008 5.274 4.974 740 HD12 LEU 94 HD12 LEU 94 -9.750 5.988 5.983 741 HD13 LEU 94 HD13 LEU 94 -9.776 4.246 5.706 742 HD21 LEU 94 HD21 LEU 94 -9.093 6.480 2.194 743 HD22 LEU 94 HD22 LEU 94 -9.802 7.353 3.552 744 HD23 LEU 94 HD23 LEU 94 -10.696 6.042 2.783 745 H VAL 95 H VAL 95 -5.988 2.796 4.653 746 HA VAL 95 HA VAL 95 -3.390 3.983 3.983 747 HB VAL 95 HB VAL 95 -3.641 1.362 5.458 748 HG11 VAL 95 HG11 VAL 95 -1.633 2.185 3.857 749 HG12 VAL 95 HG12 VAL 95 -1.408 1.133 5.255 750 HG13 VAL 95 HG13 VAL 95 -1.110 2.866 5.398 751 HG21 VAL 95 HG21 VAL 95 -4.239 2.904 7.095 752 HG22 VAL 95 HG22 VAL 95 -3.154 4.142 6.462 753 HG23 VAL 95 HG23 VAL 95 -2.496 2.744 7.311 754 H ILE 96 H ILE 96 -3.306 3.697 1.842 755 HA ILE 96 HA ILE 96 -4.543 1.473 0.523 756 HB ILE 96 HB ILE 96 -2.733 3.669 -0.488 757 HG12 ILE 96 HG13 ILE 96 -4.773 4.471 -1.589 758 HG13 ILE 96 HG12 ILE 96 -5.674 3.110 -0.933 759 HG21 ILE 96 HG21 ILE 96 -3.323 2.895 -2.765 760 HG22 ILE 96 HG22 ILE 96 -4.063 1.461 -2.053 761 HG23 ILE 96 HG23 ILE 96 -2.331 1.739 -1.875 762 HD11 ILE 96 HD11 ILE 96 -4.292 5.112 0.819 763 HD12 ILE 96 HD12 ILE 96 -5.543 3.948 1.255 764 HD13 ILE 96 HD13 ILE 96 -5.943 5.331 0.236 765 H ALA 97 H ALA 97 -3.696 -0.454 0.094 766 HA ALA 97 HA ALA 97 -0.846 -0.878 0.649 767 HB1 ALA 97 HB1 ALA 97 -2.068 -2.352 1.965 768 HB2 ALA 97 HB2 ALA 97 -1.600 -3.343 0.583 769 HB3 ALA 97 HB3 ALA 97 -3.234 -2.685 0.684 770 H GLY 98 H GLY 98 -3.233 -1.043 -1.882 771 HA2 GLY 98 HA3 GLY 98 -1.413 -0.993 -3.975 772 HA3 GLY 98 HA2 GLY 98 -1.765 -2.688 -3.675 773 H GLY 99 H GLY 99 -4.113 -1.591 -6.287 774 HA2 GLY 99 HA3 GLY 99 -1.277 -2.098 -5.665 775 HA3 GLY 99 HA2 GLY 99 -2.099 -2.565 -7.142 776 H ALA 100 H ALA 100 -0.737 -1.576 -8.571 777 HA ALA 100 HA ALA 100 0.340 0.993 -8.328 778 HB1 ALA 100 HB1 ALA 100 0.964 -0.882 -9.961 779 HB2 ALA 100 HB2 ALA 100 1.045 0.780 -10.545 780 HB3 ALA 100 HB3 ALA 100 -0.326 -0.242 -10.980 781 H GLN 101 H GLN 101 -2.534 -0.083 -10.140 782 HA GLN 101 HA GLN 101 -3.329 2.373 -11.148 783 HB2 GLN 101 HB3 GLN 101 -4.558 -0.236 -10.707 784 HB3 GLN 101 HB2 GLN 101 -5.717 1.081 -10.590 785 HG2 GLN 101 HG3 GLN 101 -3.889 0.532 -12.917 786 HG3 GLN 101 HG2 GLN 101 -5.618 0.194 -12.845 787 HE21 GLN 101 HE21 GLN 101 -6.645 2.423 -11.740 788 HE22 GLN 101 HE22 GLN 101 -6.358 3.794 -12.752 789 H ILE 102 H ILE 102 -3.774 1.013 -7.950 790 HA ILE 102 HA ILE 102 -5.624 3.028 -7.077 791 HB ILE 102 HB ILE 102 -3.956 1.223 -5.329 792 HG12 ILE 102 HG13 ILE 102 -5.174 -0.093 -7.031 793 HG13 ILE 102 HG12 ILE 102 -5.798 -0.375 -5.408 794 HG21 ILE 102 HG21 ILE 102 -6.473 2.807 -4.922 795 HG22 ILE 102 HG22 ILE 102 -4.969 2.873 -4.005 796 HG23 ILE 102 HG23 ILE 102 -6.027 1.469 -3.863 797 HD11 ILE 102 HD11 ILE 102 -7.372 0.049 -7.498 798 HD12 ILE 102 HD12 ILE 102 -7.118 1.726 -7.015 799 HD13 ILE 102 HD13 ILE 102 -7.799 0.572 -5.869 800 H PHE 103 H PHE 103 -2.153 2.468 -6.792 801 HA PHE 103 HA PHE 103 -1.580 4.549 -4.989 802 HB2 PHE 103 HB3 PHE 103 0.125 3.241 -7.116 803 HB3 PHE 103 HB2 PHE 103 0.748 4.391 -5.938 804 HD1 PHE 103 HD2 PHE 103 -0.723 3.520 -3.515 805 HD2 PHE 103 HD1 PHE 103 1.205 1.262 -6.561 806 HE1 PHE 103 HE2 PHE 103 -0.356 1.686 -1.917 807 HE2 PHE 103 HE1 PHE 103 1.574 -0.577 -4.970 808 HZ PHE 103 HZ PHE 103 0.794 -0.366 -2.644 809 H THR 104 H THR 104 -2.069 4.489 -8.446 810 HA THR 104 HA THR 104 -0.979 7.049 -8.999 811 HB THR 104 HB THR 104 -3.019 5.445 -10.547 812 HG1 THR 104 HG1 THR 104 -1.366 4.447 -11.432 813 HG21 THR 104 HG21 THR 104 -1.234 7.147 -12.067 814 HG22 THR 104 HG22 THR 104 -2.308 8.058 -11.005 815 HG23 THR 104 HG23 THR 104 -2.981 6.936 -12.188 816 H ALA 105 H ALA 105 -4.362 5.946 -8.604 817 HA ALA 105 HA ALA 105 -5.565 8.438 -8.981 818 HB1 ALA 105 HB1 ALA 105 -6.893 6.439 -8.988 819 HB2 ALA 105 HB2 ALA 105 -7.479 7.493 -7.700 820 HB3 ALA 105 HB3 ALA 105 -6.471 6.099 -7.309 821 H PHE 106 H PHE 106 -4.897 6.859 -5.824 822 HA PHE 106 HA PHE 106 -5.485 9.175 -4.342 823 HB2 PHE 106 HB3 PHE 106 -3.967 6.654 -3.679 824 HB3 PHE 106 HB2 PHE 106 -4.268 7.922 -2.497 825 HD1 PHE 106 HD2 PHE 106 -5.974 5.577 -4.813 826 HD2 PHE 106 HD1 PHE 106 -6.273 7.982 -1.313 827 HE1 PHE 106 HE2 PHE 106 -8.167 4.576 -4.317 828 HE2 PHE 106 HE1 PHE 106 -8.464 6.982 -0.811 829 HZ PHE 106 HZ PHE 106 -9.411 5.277 -2.314 830 H LYS 107 H LYS 107 -2.767 8.400 -6.240 831 HA LYS 107 HA LYS 107 -0.570 9.326 -4.939 832 HB2 LYS 107 HB3 LYS 107 0.431 9.591 -6.989 833 HB3 LYS 107 HB2 LYS 107 -0.949 8.604 -7.443 834 HG2 LYS 107 HG3 LYS 107 -2.145 10.713 -8.067 835 HG3 LYS 107 HG2 LYS 107 -0.631 11.576 -7.795 836 HD2 LYS 107 HD3 LYS 107 -0.151 9.300 -9.470 837 HD3 LYS 107 HD2 LYS 107 -1.481 10.249 -10.134 838 HE2 LYS 107 HE3 LYS 107 0.775 11.860 -9.204 839 HE3 LYS 107 HE2 LYS 107 1.182 10.756 -10.517 840 HZ1 LYS 107 HZ1 LYS 107 -1.282 12.246 -10.859 841 HZ2 LYS 107 HZ2 LYS 107 -0.059 11.901 -11.977 842 HZ3 LYS 107 HZ3 LYS 107 0.131 13.177 -10.883 843 H ASP 108 H ASP 108 -3.076 11.328 -6.433 844 HA ASP 108 HA ASP 108 -1.775 13.771 -5.559 845 HB2 ASP 108 HB3 ASP 108 -3.250 13.278 -7.736 846 HB3 ASP 108 HB2 ASP 108 -4.538 13.809 -6.660 847 H ASP 109 H ASP 109 -4.504 11.749 -4.689 848 HA ASP 109 HA ASP 109 -5.461 13.642 -2.707 849 HB2 ASP 109 HB3 ASP 109 -6.401 11.032 -3.792 850 HB3 ASP 109 HB2 ASP 109 -6.959 11.512 -2.193 851 H VAL 110 H VAL 110 -2.830 11.830 -2.659 852 HA VAL 110 HA VAL 110 -3.178 10.496 -0.113 853 HB VAL 110 HB VAL 110 -1.800 9.511 -1.933 854 HG11 VAL 110 HG11 VAL 110 0.558 11.127 -1.344 855 HG12 VAL 110 HG12 VAL 110 -0.721 12.016 -2.171 856 HG13 VAL 110 HG13 VAL 110 -0.064 10.545 -2.888 857 HG21 VAL 110 HG21 VAL 110 0.333 9.408 -0.211 858 HG22 VAL 110 HG22 VAL 110 -1.106 8.394 -0.125 859 HG23 VAL 110 HG23 VAL 110 -1.000 9.858 0.851 860 H ASP 111 H ASP 111 -2.201 11.042 1.819 861 HA ASP 111 HA ASP 111 -1.040 13.747 1.939 862 HB2 ASP 111 HB3 ASP 111 -2.956 12.329 3.756 863 HB3 ASP 111 HB2 ASP 111 -1.897 13.576 4.406 864 H THR 112 H THR 112 -0.851 10.438 3.127 865 HA THR 112 HA THR 112 1.758 11.085 4.338 866 HB THR 112 HB THR 112 -0.106 8.816 5.057 867 HG1 THR 112 HG1 THR 112 -1.050 10.390 6.090 868 HG21 THR 112 HG21 THR 112 2.465 9.730 6.323 869 HG22 THR 112 HG22 THR 112 2.148 8.177 5.550 870 HG23 THR 112 HG23 THR 112 1.330 8.596 7.055 871 H LEU 113 H LEU 113 3.414 9.431 4.203 872 HA LEU 113 HA LEU 113 3.071 7.529 1.999 873 HB2 LEU 113 HB3 LEU 113 4.348 9.877 1.625 874 HB3 LEU 113 HB2 LEU 113 5.682 8.894 2.192 875 HG LEU 113 HG LEU 113 5.413 7.354 0.363 876 HD11 LEU 113 HD11 LEU 113 3.527 8.627 -1.304 877 HD12 LEU 113 HD12 LEU 113 2.766 8.422 0.273 878 HD13 LEU 113 HD13 LEU 113 3.431 7.026 -0.574 879 HD21 LEU 113 HD21 LEU 113 5.391 9.296 -1.527 880 HD22 LEU 113 HD22 LEU 113 6.783 8.897 -0.520 881 HD23 LEU 113 HD23 LEU 113 5.727 10.237 -0.073 882 H LEU 114 H LEU 114 3.873 5.575 2.413 883 HA LEU 114 HA LEU 114 5.972 5.258 4.435 884 HB2 LEU 114 HB3 LEU 114 3.368 3.727 4.353 885 HB3 LEU 114 HB2 LEU 114 4.755 3.249 5.313 886 HG LEU 114 HG LEU 114 3.467 5.943 5.658 887 HD11 LEU 114 HD11 LEU 114 2.516 3.291 6.553 888 HD12 LEU 114 HD12 LEU 114 1.617 4.774 6.231 889 HD13 LEU 114 HD13 LEU 114 2.500 4.590 7.747 890 HD21 LEU 114 HD21 LEU 114 5.804 5.060 6.595 891 HD22 LEU 114 HD22 LEU 114 4.744 4.418 7.850 892 HD23 LEU 114 HD23 LEU 114 4.760 6.149 7.509 893 H VAL 115 H VAL 115 7.606 4.388 3.290 894 HA VAL 115 HA VAL 115 6.939 2.147 1.498 895 HB VAL 115 HB VAL 115 8.517 2.887 -0.147 896 HG11 VAL 115 HG11 VAL 115 6.160 3.875 -0.001 897 HG12 VAL 115 HG12 VAL 115 7.329 4.685 -1.044 898 HG13 VAL 115 HG13 VAL 115 6.956 5.350 0.547 899 HG21 VAL 115 HG21 VAL 115 9.697 5.036 0.051 900 HG22 VAL 115 HG22 VAL 115 10.200 3.882 1.286 901 HG23 VAL 115 HG23 VAL 115 9.100 5.196 1.703 902 H THR 116 H THR 116 8.470 0.555 1.201 903 HA THR 116 HA THR 116 10.666 0.503 3.167 904 HB THR 116 HB THR 116 8.921 -1.745 2.138 905 HG1 THR 116 HG1 THR 116 8.429 -1.963 4.340 906 HG21 THR 116 HG21 THR 116 10.213 -3.182 3.732 907 HG22 THR 116 HG22 THR 116 11.430 -1.906 3.778 908 HG23 THR 116 HG23 THR 116 11.065 -2.723 2.258 909 H ARG 117 H ARG 117 12.346 1.158 1.897 910 HA ARG 117 HA ARG 117 12.642 0.186 -0.799 911 HB2 ARG 117 HB3 ARG 117 13.709 2.334 0.784 912 HB3 ARG 117 HB2 ARG 117 15.028 1.453 0.025 913 HG2 ARG 117 HG3 ARG 117 13.845 1.711 -2.157 914 HG3 ARG 117 HG2 ARG 117 12.687 2.761 -1.337 915 HD2 ARG 117 HD3 ARG 117 15.047 3.860 -0.559 916 HD3 ARG 117 HD2 ARG 117 15.454 3.282 -2.174 917 HE ARG 117 HE ARG 117 14.252 5.024 -2.998 918 HH11 ARG 117 HH11 ARG 117 13.004 4.266 0.172 919 HH12 ARG 117 HH12 ARG 117 11.856 5.563 0.167 920 HH21 ARG 117 HH21 ARG 117 12.743 6.731 -3.006 921 HH22 ARG 117 HH22 ARG 117 11.707 6.962 -1.637 922 H LEU 118 H LEU 118 13.262 -1.839 -1.100 923 HA LEU 118 HA LEU 118 14.945 -3.260 0.731 924 HB2 LEU 118 HB3 LEU 118 13.275 -3.870 -1.528 925 HB3 LEU 118 HB2 LEU 118 14.843 -4.626 -1.742 926 HG LEU 118 HG LEU 118 14.522 -5.549 0.631 927 HD11 LEU 118 HD11 LEU 118 12.517 -5.430 1.675 928 HD12 LEU 118 HD12 LEU 118 11.609 -5.357 0.166 929 HD13 LEU 118 HD13 LEU 118 12.419 -3.915 0.778 930 HD21 LEU 118 HD21 LEU 118 13.443 -6.416 -1.926 931 HD22 LEU 118 HD22 LEU 118 12.596 -7.120 -0.548 932 HD23 LEU 118 HD23 LEU 118 14.341 -7.320 -0.707 933 H ALA 119 H ALA 119 17.079 -3.886 0.465 934 HA ALA 119 HA ALA 119 18.748 -2.101 -0.992 935 HB1 ALA 119 HB1 ALA 119 20.033 -4.566 -0.120 936 HB2 ALA 119 HB2 ALA 119 19.097 -3.782 1.152 937 HB3 ALA 119 HB3 ALA 119 20.372 -2.892 0.320 938 H GLY 120 H GLY 120 17.756 -5.463 -1.459 939 HA2 GLY 120 HA3 GLY 120 19.440 -6.010 -3.657 940 HA3 GLY 120 HA2 GLY 120 17.972 -6.883 -3.247 941 H SER 121 H SER 121 19.068 -6.055 -5.852 942 HA SER 121 HA SER 121 17.034 -4.163 -6.783 943 HB2 SER 121 HB3 SER 121 19.688 -5.054 -7.790 944 HB3 SER 121 HB2 SER 121 18.479 -4.621 -8.998 945 HG SER 121 HG SER 121 19.942 -2.910 -8.056 946 H PHE 122 H PHE 122 15.220 -4.906 -7.652 947 HA PHE 122 HA PHE 122 15.255 -7.565 -8.920 948 HB2 PHE 122 HB3 PHE 122 13.039 -6.317 -7.282 949 HB3 PHE 122 HB2 PHE 122 12.904 -7.834 -8.164 950 HD1 PHE 122 HD2 PHE 122 14.585 -6.144 -5.353 951 HD2 PHE 122 HD1 PHE 122 13.782 -9.848 -7.287 952 HE1 PHE 122 HE2 PHE 122 15.471 -7.351 -3.400 953 HE2 PHE 122 HE1 PHE 122 14.666 -11.062 -5.338 954 HZ PHE 122 HZ PHE 122 15.512 -9.813 -3.392 955 H GLU 123 H GLU 123 13.473 -7.890 -10.500 956 HA GLU 123 HA GLU 123 12.528 -5.437 -11.774 957 HB2 GLU 123 HB3 GLU 123 13.315 -6.097 -13.969 958 HB3 GLU 123 HB2 GLU 123 14.676 -5.996 -12.862 959 HG2 GLU 123 HG3 GLU 123 13.978 -8.614 -12.628 960 HG3 GLU 123 HG2 GLU 123 13.597 -8.288 -14.318 961 H GLY 124 H GLY 124 10.598 -5.649 -12.844 962 HA2 GLY 124 HA3 GLY 124 9.507 -8.270 -13.420 963 HA3 GLY 124 HA2 GLY 124 8.712 -7.424 -12.100 964 H ASP 125 H ASP 125 6.879 -6.529 -12.751 965 HA ASP 125 HA ASP 125 6.878 -4.890 -15.160 966 HB2 ASP 125 HB3 ASP 125 6.127 -7.243 -15.761 967 HB3 ASP 125 HB2 ASP 125 4.718 -6.957 -14.744 968 H THR 126 H THR 126 6.638 -4.560 -12.179 969 HA THR 126 HA THR 126 4.354 -2.763 -12.268 970 HB THR 126 HB THR 126 4.496 -4.391 -9.796 971 HG1 THR 126 HG1 THR 126 3.264 -6.049 -10.769 972 HG21 THR 126 HG21 THR 126 2.284 -3.935 -9.579 973 HG22 THR 126 HG22 THR 126 2.000 -3.914 -11.319 974 HG23 THR 126 HG23 THR 126 2.776 -2.538 -10.535 975 H LYS 127 H LYS 127 5.410 -0.923 -11.889 976 HA LYS 127 HA LYS 127 7.173 -0.794 -9.528 977 HB2 LYS 127 HB3 LYS 127 7.371 0.915 -12.013 978 HB3 LYS 127 HB2 LYS 127 8.477 0.910 -10.646 979 HG2 LYS 127 HG3 LYS 127 9.397 -1.139 -11.233 980 HG3 LYS 127 HG2 LYS 127 8.020 -1.575 -12.247 981 HD2 LYS 127 HD3 LYS 127 9.431 0.866 -13.070 982 HD3 LYS 127 HD2 LYS 127 10.388 -0.612 -13.178 983 HE2 LYS 127 HE3 LYS 127 9.091 -1.496 -14.821 984 HE3 LYS 127 HE2 LYS 127 7.622 -0.725 -14.225 985 HZ1 LYS 127 HZ1 LYS 127 9.634 0.290 -16.078 986 HZ2 LYS 127 HZ2 LYS 127 8.935 1.411 -15.022 987 HZ3 LYS 127 HZ3 LYS 127 7.957 0.515 -16.071 988 H MET 128 H MET 128 7.323 1.444 -8.595 989 HA MET 128 HA MET 128 4.715 2.383 -7.970 990 HB2 MET 128 HB3 MET 128 6.748 2.420 -6.456 991 HB3 MET 128 HB2 MET 128 7.313 3.802 -7.386 992 HG2 MET 128 HG3 MET 128 6.206 4.486 -5.329 993 HG3 MET 128 HG2 MET 128 5.349 5.068 -6.752 994 HE1 MET 128 HE1 MET 128 2.687 5.317 -5.335 995 HE2 MET 128 HE2 MET 128 4.126 5.434 -4.322 996 HE3 MET 128 HE3 MET 128 2.793 4.384 -3.842 997 H ILE 129 H ILE 129 4.050 4.674 -8.134 998 HA ILE 129 HA ILE 129 4.627 5.690 -10.822 999 HB ILE 129 HB ILE 129 2.577 7.059 -10.514 1000 HG12 ILE 129 HG13 ILE 129 1.216 5.794 -8.466 1001 HG13 ILE 129 HG12 ILE 129 2.830 6.000 -7.797 1002 HG21 ILE 129 HG21 ILE 129 1.914 5.262 -11.691 1003 HG22 ILE 129 HG22 ILE 129 1.096 4.813 -10.195 1004 HG23 ILE 129 HG23 ILE 129 2.674 4.124 -10.579 1005 HD11 ILE 129 HD11 ILE 129 2.351 8.446 -8.896 1006 HD12 ILE 129 HD12 ILE 129 2.114 8.014 -7.202 1007 HD13 ILE 129 HD13 ILE 129 0.754 7.965 -8.324 1008 HA PRO 130 HA PRO 130 6.809 9.303 -9.557 1009 HB2 PRO 130 HB3 PRO 130 4.903 10.952 -11.123 1010 HB3 PRO 130 HB2 PRO 130 6.659 10.815 -11.270 1011 HG2 PRO 130 HG3 PRO 130 5.044 9.693 -13.071 1012 HG3 PRO 130 HG2 PRO 130 6.534 8.886 -12.549 1013 HD2 PRO 130 HD3 PRO 130 3.701 8.335 -11.760 1014 HD3 PRO 130 HD2 PRO 130 5.024 7.195 -12.081 1015 H LEU 131 H LEU 131 6.760 10.922 -8.029 1016 HA LEU 131 HA LEU 131 4.150 11.797 -7.015 1017 HB2 LEU 131 HB3 LEU 131 6.206 11.197 -4.970 1018 HB3 LEU 131 HB2 LEU 131 4.461 11.066 -4.879 1019 HG LEU 131 HG LEU 131 6.006 9.105 -6.534 1020 HD11 LEU 131 HD11 LEU 131 6.767 7.898 -4.787 1021 HD12 LEU 131 HD12 LEU 131 5.429 8.367 -3.738 1022 HD13 LEU 131 HD13 LEU 131 6.779 9.473 -3.992 1023 HD21 LEU 131 HD21 LEU 131 3.595 8.598 -4.834 1024 HD22 LEU 131 HD22 LEU 131 4.140 7.748 -6.280 1025 HD23 LEU 131 HD23 LEU 131 3.436 9.359 -6.417 1026 H ASN 132 H ASN 132 4.145 13.815 -5.987 1027 HA ASN 132 HA ASN 132 6.245 15.599 -6.786 1028 HB2 ASN 132 HB3 ASN 132 3.603 15.958 -6.328 1029 HB3 ASN 132 HB2 ASN 132 4.252 16.514 -4.789 1030 HD21 ASN 132 HD21 ASN 132 6.592 17.685 -5.550 1031 HD22 ASN 132 HD22 ASN 132 6.265 19.055 -6.550 1032 H TRP 133 H TRP 133 7.981 14.521 -5.666 1033 HA TRP 133 HA TRP 133 8.157 14.092 -2.948 1034 HB2 TRP 133 HB3 TRP 133 10.341 14.785 -4.911 1035 HB3 TRP 133 HB2 TRP 133 10.624 14.178 -3.280 1036 HD1 TRP 133 HD1 TRP 133 9.287 13.068 -6.694 1037 HE1 TRP 133 HE1 TRP 133 9.216 10.495 -6.755 1038 HE3 TRP 133 HE3 TRP 133 10.483 12.104 -1.817 1039 HZ2 TRP 133 HZ2 TRP 133 9.624 8.343 -4.976 1040 HZ3 TRP 133 HZ3 TRP 133 10.622 9.761 -1.078 1041 HH2 TRP 133 HH2 TRP 133 10.199 7.921 -2.626 1042 H ASP 134 H ASP 134 9.073 17.104 -4.709 1043 HA ASP 134 HA ASP 134 10.146 18.450 -2.537 1044 HB2 ASP 134 HB3 ASP 134 10.164 19.194 -4.943 1045 HB3 ASP 134 HB2 ASP 134 8.493 19.709 -4.733 1046 H ASP 135 H ASP 135 6.780 18.204 -3.602 1047 HA ASP 135 HA ASP 135 5.768 19.935 -1.572 1048 HB2 ASP 135 HB3 ASP 135 4.617 18.186 -3.675 1049 HB3 ASP 135 HB2 ASP 135 3.579 18.555 -2.301 1050 H PHE 136 H PHE 136 7.150 16.988 -1.248 1051 HA PHE 136 HA PHE 136 5.476 16.319 1.079 1052 HB2 PHE 136 HB3 PHE 136 6.660 14.569 -1.033 1053 HB3 PHE 136 HB2 PHE 136 6.541 13.938 0.606 1054 HD1 PHE 136 HD2 PHE 136 4.317 15.966 -1.608 1055 HD2 PHE 136 HD1 PHE 136 4.756 12.539 0.877 1056 HE1 PHE 136 HE2 PHE 136 1.963 15.377 -2.012 1057 HE2 PHE 136 HE1 PHE 136 2.402 11.943 0.476 1058 HZ PHE 136 HZ PHE 136 1.003 13.363 -0.969 1059 H THR 137 H THR 137 6.479 16.144 2.975 1060 HA THR 137 HA THR 137 9.421 16.333 2.989 1061 HB THR 137 HB THR 137 7.412 17.349 5.008 1062 HG1 THR 137 HG1 THR 137 7.450 18.933 3.624 1063 HG21 THR 137 HG21 THR 137 9.281 16.805 6.306 1064 HG22 THR 137 HG22 THR 137 9.438 18.527 5.961 1065 HG23 THR 137 HG23 THR 137 10.408 17.356 5.067 1066 H LYS 138 H LYS 138 10.604 14.935 4.165 1067 HA LYS 138 HA LYS 138 9.500 12.459 4.893 1068 HB2 LYS 138 HB3 LYS 138 11.905 12.973 4.234 1069 HB3 LYS 138 HB2 LYS 138 12.135 13.519 5.890 1070 HG2 LYS 138 HG3 LYS 138 12.382 11.443 6.618 1071 HG3 LYS 138 HG2 LYS 138 10.886 10.927 5.841 1072 HD2 LYS 138 HD3 LYS 138 12.346 9.625 4.679 1073 HD3 LYS 138 HD2 LYS 138 12.423 11.075 3.677 1074 HE2 LYS 138 HE3 LYS 138 14.467 11.751 4.625 1075 HE3 LYS 138 HE2 LYS 138 14.304 10.628 5.974 1076 HZ1 LYS 138 HZ1 LYS 138 14.350 8.867 4.081 1077 HZ2 LYS 138 HZ2 LYS 138 15.796 9.538 4.645 1078 HZ3 LYS 138 HZ3 LYS 138 15.112 10.095 3.202 1079 H VAL 139 H VAL 139 8.337 11.953 6.599 1080 HA VAL 139 HA VAL 139 8.297 13.684 8.928 1081 HB VAL 139 HB VAL 139 6.756 11.120 8.769 1082 HG11 VAL 139 HG11 VAL 139 5.983 13.829 9.835 1083 HG12 VAL 139 HG12 VAL 139 6.757 12.573 10.801 1084 HG13 VAL 139 HG13 VAL 139 5.161 12.292 10.104 1085 HG21 VAL 139 HG21 VAL 139 6.163 11.882 6.669 1086 HG22 VAL 139 HG22 VAL 139 6.297 13.579 7.130 1087 HG23 VAL 139 HG23 VAL 139 4.927 12.619 7.688 1088 H SER 140 H SER 140 9.414 10.503 7.987 1089 HA SER 140 HA SER 140 11.076 10.357 10.340 1090 HB2 SER 140 HB3 SER 140 8.556 8.881 10.190 1091 HB3 SER 140 HB2 SER 140 9.947 7.836 10.478 1092 HG SER 140 HG SER 140 9.282 10.153 11.979 1093 H SER 141 H SER 141 12.558 8.505 10.272 1094 HA SER 141 HA SER 141 12.736 7.017 7.800 1095 HB2 SER 141 HB3 SER 141 15.065 7.828 7.329 1096 HB3 SER 141 HB2 SER 141 13.816 9.046 7.075 1097 HG SER 141 HG SER 141 15.333 8.799 9.459 1098 H ARG 142 H ARG 142 13.412 5.043 8.278 1099 HA ARG 142 HA ARG 142 15.355 4.669 10.441 1100 HB2 ARG 142 HB3 ARG 142 13.034 4.272 11.304 1101 HB3 ARG 142 HB2 ARG 142 12.875 2.969 10.134 1102 HG2 ARG 142 HG3 ARG 142 13.433 1.959 12.187 1103 HG3 ARG 142 HG2 ARG 142 14.898 1.916 11.204 1104 HD2 ARG 142 HD3 ARG 142 15.327 4.231 12.428 1105 HD3 ARG 142 HD2 ARG 142 14.283 3.496 13.644 1106 HE ARG 142 HE ARG 142 16.155 1.582 13.064 1107 HH11 ARG 142 HH11 ARG 142 16.245 4.881 14.199 1108 HH12 ARG 142 HH12 ARG 142 17.706 4.662 15.102 1109 HH21 ARG 142 HH21 ARG 142 18.076 1.292 14.252 1110 HH22 ARG 142 HH22 ARG 142 18.746 2.625 15.132 1111 H THR 143 H THR 143 16.816 3.042 10.106 1112 HA THR 143 HA THR 143 16.592 1.625 7.534 1113 HB THR 143 HB THR 143 19.172 2.104 9.007 1114 HG1 THR 143 HG1 THR 143 18.479 4.144 8.665 1115 HG21 THR 143 HG21 THR 143 19.218 2.213 6.120 1116 HG22 THR 143 HG22 THR 143 18.603 0.672 6.718 1117 HG23 THR 143 HG23 THR 143 20.188 1.250 7.235 1118 H VAL 144 H VAL 144 15.953 -0.401 7.842 1119 HA VAL 144 HA VAL 144 16.985 -1.874 10.169 1120 HB VAL 144 HB VAL 144 15.041 -3.498 9.241 1121 HG11 VAL 144 HG11 VAL 144 14.057 -3.079 11.222 1122 HG12 VAL 144 HG12 VAL 144 14.013 -1.337 10.952 1123 HG13 VAL 144 HG13 VAL 144 15.501 -2.107 11.502 1124 HG21 VAL 144 HG21 VAL 144 13.150 -2.350 8.451 1125 HG22 VAL 144 HG22 VAL 144 14.495 -1.725 7.497 1126 HG23 VAL 144 HG23 VAL 144 13.845 -0.774 8.832 1127 H GLU 145 H GLU 145 18.317 -3.549 9.857 1128 HA GLU 145 HA GLU 145 18.558 -4.635 7.131 1129 HB2 GLU 145 HB3 GLU 145 21.008 -5.059 7.813 1130 HB3 GLU 145 HB2 GLU 145 20.538 -3.425 7.365 1131 HG2 GLU 145 HG3 GLU 145 20.829 -2.615 9.451 1132 HG3 GLU 145 HG2 GLU 145 20.343 -4.123 10.225 1133 H ASP 146 H ASP 146 18.915 -6.820 6.910 1134 HA ASP 146 HA ASP 146 18.425 -8.411 9.336 1135 HB2 ASP 146 HB3 ASP 146 17.446 -8.571 6.568 1136 HB3 ASP 146 HB2 ASP 146 17.955 -10.117 7.240 1137 H THR 147 H THR 147 19.178 -10.881 8.600 1138 HA THR 147 HA THR 147 21.956 -10.871 8.937 1139 HB THR 147 HB THR 147 21.562 -13.350 7.966 1140 HG1 THR 147 HG1 THR 147 19.480 -13.980 8.206 1141 HG21 THR 147 HG21 THR 147 20.683 -13.985 10.265 1142 HG22 THR 147 HG22 THR 147 20.798 -12.268 10.651 1143 HG23 THR 147 HG23 THR 147 22.243 -13.167 10.188 1144 H ASN 148 H ASN 148 19.979 -11.306 6.037 1145 HA ASN 148 HA ASN 148 22.314 -11.590 4.349 1146 HB2 ASN 148 HB3 ASN 148 19.380 -11.837 4.007 1147 HB3 ASN 148 HB2 ASN 148 20.286 -11.319 2.588 1148 HD21 ASN 148 HD21 ASN 148 18.844 -13.791 3.043 1149 HD22 ASN 148 HD22 ASN 148 19.993 -15.067 2.853 1150 HA PRO 149 HA PRO 149 22.883 -7.263 3.586 1151 HB2 PRO 149 HB3 PRO 149 23.989 -7.438 1.075 1152 HB3 PRO 149 HB2 PRO 149 24.883 -7.705 2.575 1153 HG2 PRO 149 HG3 PRO 149 23.680 -9.704 0.703 1154 HG3 PRO 149 HG2 PRO 149 25.246 -9.749 1.536 1155 HD2 PRO 149 HD3 PRO 149 23.142 -11.169 2.414 1156 HD3 PRO 149 HD2 PRO 149 24.301 -10.431 3.540 1157 H ALA 150 H ALA 150 21.211 -9.326 1.302 1158 HA ALA 150 HA ALA 150 20.105 -7.128 -0.201 1159 HB1 ALA 150 HB1 ALA 150 20.587 -9.256 -1.295 1160 HB2 ALA 150 HB2 ALA 150 18.875 -8.848 -1.419 1161 HB3 ALA 150 HB3 ALA 150 19.411 -10.062 -0.257 1162 H LEU 151 H LEU 151 19.324 -8.709 2.712 1163 HA LEU 151 HA LEU 151 16.479 -8.170 2.526 1164 HB2 LEU 151 HB3 LEU 151 18.193 -9.345 4.706 1165 HB3 LEU 151 HB2 LEU 151 16.473 -9.056 4.889 1166 HG LEU 151 HG LEU 151 17.837 -11.014 3.056 1167 HD11 LEU 151 HD11 LEU 151 17.495 -12.185 4.960 1168 HD12 LEU 151 HD12 LEU 151 15.881 -12.366 4.270 1169 HD13 LEU 151 HD13 LEU 151 16.182 -11.139 5.501 1170 HD21 LEU 151 HD21 LEU 151 15.227 -11.450 2.583 1171 HD22 LEU 151 HD22 LEU 151 16.248 -10.441 1.558 1172 HD23 LEU 151 HD23 LEU 151 15.213 -9.696 2.775 1173 H THR 152 H THR 152 18.909 -6.151 2.866 1174 HA THR 152 HA THR 152 18.161 -4.733 5.251 1175 HB THR 152 HB THR 152 19.814 -3.590 3.012 1176 HG1 THR 152 HG1 THR 152 21.607 -4.602 4.065 1177 HG21 THR 152 HG21 THR 152 21.066 -3.016 5.358 1178 HG22 THR 152 HG22 THR 152 19.367 -2.949 5.823 1179 HG23 THR 152 HG23 THR 152 19.961 -1.941 4.503 1180 H HIS 153 H HIS 153 16.494 -3.397 5.438 1181 HA HIS 153 HA HIS 153 15.502 -2.042 3.014 1182 HB2 HIS 153 HB3 HIS 153 13.608 -2.639 5.236 1183 HB3 HIS 153 HB2 HIS 153 13.310 -2.528 3.505 1184 HD1 HIS 153 HD1 HIS 153 13.070 -4.925 5.975 1185 HD2 HIS 153 HD2 HIS 153 14.964 -4.909 2.279 1186 HE1 HIS 153 HE1 HIS 153 13.340 -7.345 5.348 1187 HE2 HIS 153 HE2 HIS 153 14.560 -7.312 3.145 1188 H THR 154 H THR 154 14.185 -0.082 3.510 1189 HA THR 154 HA THR 154 15.023 1.259 5.982 1190 HB THR 154 HB THR 154 15.091 2.629 3.295 1191 HG1 THR 154 HG1 THR 154 17.152 1.321 4.718 1192 HG21 THR 154 HG21 THR 154 16.171 3.381 5.996 1193 HG22 THR 154 HG22 THR 154 14.920 4.208 5.067 1194 HG23 THR 154 HG23 THR 154 16.588 4.207 4.495 1195 H TYR 155 H TYR 155 13.282 1.948 7.018 1196 HA TYR 155 HA TYR 155 10.788 2.351 5.562 1197 HB2 TYR 155 HB3 TYR 155 11.540 1.869 8.401 1198 HB3 TYR 155 HB2 TYR 155 10.073 2.795 8.105 1199 HD1 TYR 155 HD1 TYR 155 8.361 1.729 6.458 1200 HD2 TYR 155 HD2 TYR 155 11.451 -0.451 8.407 1201 HE1 TYR 155 HE1 TYR 155 7.113 -0.358 6.090 1202 HE2 TYR 155 HE2 TYR 155 10.213 -2.544 8.042 1203 HH TYR 155 HH TYR 155 8.319 -3.257 6.146 1204 H GLU 156 H GLU 156 10.188 4.311 4.903 1205 HA GLU 156 HA GLU 156 11.114 6.644 6.445 1206 HB2 GLU 156 HB3 GLU 156 11.074 6.275 3.454 1207 HB3 GLU 156 HB2 GLU 156 11.180 7.859 4.211 1208 HG2 GLU 156 HG3 GLU 156 13.299 7.469 5.041 1209 HG3 GLU 156 HG2 GLU 156 13.125 5.718 4.946 1210 H VAL 157 H VAL 157 9.699 8.309 6.717 1211 HA VAL 157 HA VAL 157 6.951 7.846 5.770 1212 HB VAL 157 HB VAL 157 7.735 9.495 8.172 1213 HG11 VAL 157 HG11 VAL 157 5.598 10.135 7.437 1214 HG12 VAL 157 HG12 VAL 157 5.302 8.994 8.748 1215 HG13 VAL 157 HG13 VAL 157 5.131 8.475 7.071 1216 HG21 VAL 157 HG21 VAL 157 8.415 7.133 8.462 1217 HG22 VAL 157 HG22 VAL 157 6.748 6.644 8.156 1218 HG23 VAL 157 HG23 VAL 157 7.134 7.622 9.572 1219 H TRP 158 H TRP 158 5.764 9.588 5.011 1220 HA TRP 158 HA TRP 158 7.095 12.165 4.702 1221 HB2 TRP 158 HB3 TRP 158 5.985 10.819 2.248 1222 HB3 TRP 158 HB2 TRP 158 6.937 12.292 2.338 1223 HD1 TRP 158 HD1 TRP 158 7.433 8.510 3.089 1224 HE1 TRP 158 HE1 TRP 158 9.862 7.907 2.485 1225 HE3 TRP 158 HE3 TRP 158 9.113 13.148 1.751 1226 HZ2 TRP 158 HZ2 TRP 158 12.182 9.223 1.559 1227 HZ3 TRP 158 HZ3 TRP 158 11.449 13.391 1.016 1228 HH2 TRP 158 HH2 TRP 158 12.951 11.468 0.923 1229 H GLN 159 H GLN 159 5.755 13.868 4.661 1230 HA GLN 159 HA GLN 159 2.887 13.401 4.261 1231 HB2 GLN 159 HB3 GLN 159 4.231 14.408 6.708 1232 HB3 GLN 159 HB2 GLN 159 2.762 15.240 6.216 1233 HG2 GLN 159 HG3 GLN 159 2.472 12.355 6.150 1234 HG3 GLN 159 HG2 GLN 159 2.920 12.955 7.746 1235 HE21 GLN 159 HE21 GLN 159 1.659 15.330 7.896 1236 HE22 GLN 159 HE22 GLN 159 -0.053 15.117 7.811 1237 H LYS 160 H LYS 160 2.105 14.783 2.804 1238 HA LYS 160 HA LYS 160 3.613 16.791 1.602 1239 HB2 LYS 160 HB3 LYS 160 1.531 15.608 0.718 1240 HB3 LYS 160 HB2 LYS 160 0.601 16.761 1.665 1241 HG2 LYS 160 HG3 LYS 160 2.186 18.464 0.341 1242 HG3 LYS 160 HG2 LYS 160 2.124 17.146 -0.830 1243 HD2 LYS 160 HD3 LYS 160 -0.121 17.400 -1.202 1244 HD3 LYS 160 HD2 LYS 160 -0.425 18.044 0.413 1245 HE2 LYS 160 HE3 LYS 160 -0.721 19.776 -1.266 1246 HE3 LYS 160 HE2 LYS 160 0.656 20.147 -0.230 1247 HZ1 LYS 160 HZ1 LYS 160 0.686 20.144 -2.935 1248 HZ2 LYS 160 HZ2 LYS 160 1.359 18.635 -2.573 1249 HZ3 LYS 160 HZ3 LYS 160 2.055 20.043 -1.946 1250 H LYS 161 H LYS 161 3.635 19.015 1.751 1251 HA LYS 161 HA LYS 161 3.245 20.101 4.352 1252 HB2 LYS 161 HB3 LYS 161 4.024 21.284 1.698 1253 HB3 LYS 161 HB2 LYS 161 3.776 22.298 3.113 1254 HG2 LYS 161 HG3 LYS 161 5.579 21.329 4.259 1255 HG3 LYS 161 HG2 LYS 161 5.663 19.966 3.142 1256 HD2 LYS 161 HD3 LYS 161 6.916 21.104 1.663 1257 HD3 LYS 161 HD2 LYS 161 5.980 22.586 1.867 1258 HE2 LYS 161 HE3 LYS 161 7.840 23.351 2.867 1259 HE3 LYS 161 HE2 LYS 161 7.251 22.442 4.258 1260 HZ1 LYS 161 HZ1 LYS 161 8.607 20.562 3.538 1261 HZ2 LYS 161 HZ2 LYS 161 9.557 21.932 3.818 1262 HZ3 LYS 161 HZ3 LYS 161 9.193 21.466 2.234 1263 H ALA 162 H ALA 162 1.762 21.618 5.076 1264 HA ALA 162 HA ALA 162 -0.276 22.607 5.296 1265 HB1 ALA 162 HB1 ALA 162 0.338 24.101 3.582 1266 HB2 ALA 162 HB2 ALA 162 -1.281 23.542 3.161 1267 HB3 ALA 162 HB3 ALA 162 0.125 22.878 2.329 1268 H51A NDP 170 H51A NDP 170 -5.955 -0.584 -9.305 1269 H52A NDP 170 H52A NDP 170 -6.430 -2.108 -8.542 1270 H4B NDP 170 H4B NDP 170 -7.847 -2.593 -10.589 1271 H3B NDP 170 H3B NDP 170 -6.996 0.198 -11.380 1272 HO3A NDP 170 HO3A NDP 170 -7.540 -2.260 -12.740 1273 H2B NDP 170 H2B NDP 170 -9.213 0.529 -12.235 1274 H1B NDP 170 H1B NDP 170 -10.522 -0.530 -10.056 1275 H8A NDP 170 H8A NDP 170 -7.305 1.247 -9.094 1276 H61A NDP 170 H61A NDP 170 -10.852 6.299 -8.459 1277 H62A NDP 170 H62A NDP 170 -9.235 5.653 -8.298 1278 H2A NDP 170 H2A NDP 170 -13.375 3.046 -10.242 1279 H51N NDP 170 H51N NDP 170 -0.172 -3.598 -9.316 1280 H52N NDP 170 H52N NDP 170 -1.112 -4.301 -7.989 1281 H4D NDP 170 H4D NDP 170 0.995 -5.804 -9.600 1282 H3D NDP 170 H3D NDP 170 -0.670 -6.629 -7.211 1283 HO3N NDP 170 HO3N NDP 170 0.344 -8.151 -9.390 1284 H2D NDP 170 H2D NDP 170 1.222 -7.913 -6.479 1285 HO2N NDP 170 HO2N NDP 170 2.605 -7.331 -8.884 1286 H1D NDP 170 H1D NDP 170 3.098 -5.945 -6.981 1287 H2N NDP 170 H2N NDP 170 3.580 -5.388 -4.712 1288 H71N NDP 170 H71N NDP 170 5.355 -4.667 -2.117 1289 H72N NDP 170 H72N NDP 170 4.932 -5.355 -3.665 1290 H41N NDP 170 H41N NDP 170 0.529 -3.816 -2.686 1291 H42N NDP 170 H42N NDP 170 0.479 -5.551 -2.219 1292 H5N NDP 170 H5N NDP 170 -1.303 -5.006 -3.874 1293 H6N NDP 170 H6N NDP 170 -0.530 -5.657 -6.162 Start of MODEL 25 1 H1 THR 1 HT1 THR 1 -4.308 8.632 5.529 2 H2 THR 1 HT2 THR 1 -5.038 7.417 4.563 3 H3 THR 1 HT3 THR 1 -5.841 8.912 4.816 4 HA THR 1 HA THR 1 -4.695 8.541 2.629 5 HB THR 1 HB THR 1 -3.893 10.943 2.689 6 HG1 THR 1 HG1 THR 1 -4.620 10.663 5.413 7 HG21 THR 1 HG21 THR 1 -6.313 11.540 3.934 8 HG22 THR 1 HG22 THR 1 -6.549 9.970 3.168 9 HG23 THR 1 HG23 THR 1 -6.011 11.348 2.207 10 H ALA 2 H ALA 2 -3.109 6.763 3.813 11 HA ALA 2 HA ALA 2 -0.411 7.850 3.372 12 HB1 ALA 2 HB1 ALA 2 -1.027 7.466 5.833 13 HB2 ALA 2 HB2 ALA 2 0.489 6.784 5.245 14 HB3 ALA 2 HB3 ALA 2 -0.923 5.748 5.450 15 H PHE 3 H PHE 3 0.971 6.569 2.226 16 HA PHE 3 HA PHE 3 -0.185 4.103 1.115 17 HB2 PHE 3 HB3 PHE 3 2.068 5.845 0.097 18 HB3 PHE 3 HB2 PHE 3 1.515 4.367 -0.678 19 HD1 PHE 3 HD1 PHE 3 -1.435 5.581 0.446 20 HD2 PHE 3 HD2 PHE 3 1.615 6.604 -2.343 21 HE1 PHE 3 HE1 PHE 3 -3.065 6.881 -0.857 22 HE2 PHE 3 HE2 PHE 3 -0.012 7.906 -3.649 23 HZ PHE 3 HZ PHE 3 -2.352 8.045 -2.906 24 H LEU 4 H LEU 4 0.638 2.181 1.676 25 HA LEU 4 HA LEU 4 3.376 2.098 2.751 26 HB2 LEU 4 HB3 LEU 4 1.778 1.944 4.589 27 HB3 LEU 4 HB2 LEU 4 0.968 0.609 3.792 28 HG LEU 4 HG LEU 4 2.982 -0.773 4.047 29 HD11 LEU 4 HD11 LEU 4 4.767 0.747 4.016 30 HD12 LEU 4 HD12 LEU 4 4.729 0.133 5.669 31 HD13 LEU 4 HD13 LEU 4 4.068 1.727 5.305 32 HD21 LEU 4 HD21 LEU 4 2.449 0.335 6.761 33 HD22 LEU 4 HD22 LEU 4 2.557 -1.343 6.229 34 HD23 LEU 4 HD23 LEU 4 1.122 -0.388 5.852 35 H TRP 5 H TRP 5 4.592 0.944 1.403 36 HA TRP 5 HA TRP 5 3.817 -1.719 0.664 37 HB2 TRP 5 HB3 TRP 5 3.633 -1.499 -1.658 38 HB3 TRP 5 HB2 TRP 5 2.733 -0.116 -1.048 39 HD1 TRP 5 HD1 TRP 5 5.784 -1.033 -3.092 40 HE1 TRP 5 HE1 TRP 5 6.801 1.101 -4.107 41 HE3 TRP 5 HE3 TRP 5 3.040 2.462 -0.559 42 HZ2 TRP 5 HZ2 TRP 5 6.487 3.894 -3.864 43 HZ3 TRP 5 HZ3 TRP 5 3.462 4.844 -1.012 44 HH2 TRP 5 HH2 TRP 5 5.149 5.543 -2.631 45 H ALA 6 H ALA 6 5.544 -2.861 -0.516 46 HA ALA 6 HA ALA 6 8.170 -1.790 0.253 47 HB1 ALA 6 HB1 ALA 6 7.932 -3.862 1.278 48 HB2 ALA 6 HB2 ALA 6 8.855 -4.245 -0.175 49 HB3 ALA 6 HB3 ALA 6 7.123 -4.571 -0.120 50 H GLN 7 H GLN 7 9.901 -1.753 -1.217 51 HA GLN 7 HA GLN 7 9.370 -2.522 -3.977 52 HB2 GLN 7 HB3 GLN 7 10.227 -0.231 -4.725 53 HB3 GLN 7 HB2 GLN 7 8.577 -0.316 -4.122 54 HG2 GLN 7 HG3 GLN 7 10.370 0.218 -1.955 55 HG3 GLN 7 HG2 GLN 7 10.648 1.367 -3.263 56 HE21 GLN 7 HE21 GLN 7 8.184 0.008 -1.149 57 HE22 GLN 7 HE22 GLN 7 7.126 1.373 -1.199 58 H ASP 8 H ASP 8 11.266 -2.547 -5.324 59 HA ASP 8 HA ASP 8 13.679 -3.103 -3.779 60 HB2 ASP 8 HB3 ASP 8 14.485 -4.241 -5.761 61 HB3 ASP 8 HB2 ASP 8 12.840 -4.767 -5.433 62 H ARG 9 H ARG 9 15.648 -2.665 -5.660 63 HA ARG 9 HA ARG 9 16.049 0.147 -5.406 64 HB2 ARG 9 HB3 ARG 9 17.591 -2.072 -6.725 65 HB3 ARG 9 HB2 ARG 9 18.084 -0.395 -6.904 66 HG2 ARG 9 HG3 ARG 9 17.833 -0.500 -4.238 67 HG3 ARG 9 HG2 ARG 9 18.250 -2.183 -4.568 68 HD2 ARG 9 HD3 ARG 9 20.306 -1.114 -4.221 69 HD3 ARG 9 HD2 ARG 9 20.166 -1.259 -5.970 70 HE ARG 9 HE ARG 9 19.937 1.198 -4.397 71 HH11 ARG 9 HH11 ARG 9 19.964 -0.359 -7.530 72 HH12 ARG 9 HH12 ARG 9 20.184 1.122 -8.395 73 HH21 ARG 9 HH21 ARG 9 20.223 3.138 -5.545 74 HH22 ARG 9 HH22 ARG 9 20.331 3.104 -7.273 75 H ASP 10 H ASP 10 14.774 -1.912 -7.879 76 HA ASP 10 HA ASP 10 15.024 0.092 -9.962 77 HB2 ASP 10 HB3 ASP 10 14.403 -2.761 -9.828 78 HB3 ASP 10 HB2 ASP 10 13.368 -1.887 -10.953 79 H GLY 11 H GLY 11 13.036 -0.178 -7.395 80 HA2 GLY 11 HA3 GLY 11 11.169 1.182 -6.978 81 HA3 GLY 11 HA2 GLY 11 10.966 1.396 -8.709 82 H LEU 12 H LEU 12 11.350 -1.771 -8.574 83 HA LEU 12 HA LEU 12 8.825 -2.559 -9.215 84 HB2 LEU 12 HB3 LEU 12 11.029 -3.882 -9.193 85 HB3 LEU 12 HB2 LEU 12 10.626 -4.290 -7.539 86 HG LEU 12 HG LEU 12 8.520 -5.363 -8.359 87 HD11 LEU 12 HD11 LEU 12 8.182 -5.756 -10.687 88 HD12 LEU 12 HD12 LEU 12 9.723 -5.003 -11.099 89 HD13 LEU 12 HD13 LEU 12 8.402 -4.020 -10.469 90 HD21 LEU 12 HD21 LEU 12 9.600 -7.318 -8.607 91 HD22 LEU 12 HD22 LEU 12 11.034 -6.356 -8.240 92 HD23 LEU 12 HD23 LEU 12 10.616 -6.714 -9.916 93 H ILE 13 H ILE 13 7.364 -4.042 -7.945 94 HA ILE 13 HA ILE 13 7.241 -3.613 -5.101 95 HB ILE 13 HB ILE 13 5.029 -2.682 -5.010 96 HG12 ILE 13 HG13 ILE 13 4.771 -1.938 -7.835 97 HG13 ILE 13 HG12 ILE 13 4.660 -3.670 -7.557 98 HG21 ILE 13 HG21 ILE 13 6.765 -1.069 -6.867 99 HG22 ILE 13 HG22 ILE 13 6.868 -1.104 -5.107 100 HG23 ILE 13 HG23 ILE 13 5.435 -0.442 -5.894 101 HD11 ILE 13 HD11 ILE 13 2.837 -3.366 -6.029 102 HD12 ILE 13 HD12 ILE 13 2.479 -2.514 -7.531 103 HD13 ILE 13 HD13 ILE 13 3.013 -1.613 -6.113 104 H GLY 14 H GLY 14 5.990 -5.017 -8.054 105 HA2 GLY 14 HA3 GLY 14 5.315 -7.414 -6.530 106 HA3 GLY 14 HA2 GLY 14 4.066 -6.703 -7.535 107 H LYS 15 H LYS 15 4.479 -9.131 -8.163 108 HA LYS 15 HA LYS 15 6.163 -9.092 -10.572 109 HB2 LYS 15 HB3 LYS 15 6.857 -11.339 -10.217 110 HB3 LYS 15 HB2 LYS 15 7.107 -10.506 -8.690 111 HG2 LYS 15 HG3 LYS 15 4.481 -11.643 -8.726 112 HG3 LYS 15 HG2 LYS 15 5.665 -12.874 -9.166 113 HD2 LYS 15 HD3 LYS 15 6.762 -12.728 -7.136 114 HD3 LYS 15 HD2 LYS 15 6.173 -11.095 -6.819 115 HE2 LYS 15 HE3 LYS 15 5.060 -12.641 -5.343 116 HE3 LYS 15 HE2 LYS 15 3.899 -12.018 -6.515 117 HZ1 LYS 15 HZ1 LYS 15 4.809 -14.711 -6.095 118 HZ2 LYS 15 HZ2 LYS 15 4.854 -14.246 -7.721 119 HZ3 LYS 15 HZ3 LYS 15 3.405 -14.151 -6.854 120 H ASP 16 H ASP 16 3.576 -8.301 -10.683 121 HA ASP 16 HA ASP 16 1.766 -8.622 -12.050 122 HB2 ASP 16 HB3 ASP 16 2.521 -11.519 -12.413 123 HB3 ASP 16 HB2 ASP 16 1.565 -10.496 -13.480 124 H GLY 17 H GLY 17 1.950 -9.077 -9.185 125 HA2 GLY 17 HA3 GLY 17 -0.665 -9.925 -8.654 126 HA3 GLY 17 HA2 GLY 17 0.418 -11.273 -8.331 127 H HIS 18 H HIS 18 2.617 -9.983 -7.307 128 HA HIS 18 HA HIS 18 2.075 -8.052 -5.329 129 HB2 HIS 18 HB3 HIS 18 2.120 -9.416 -3.314 130 HB3 HIS 18 HB2 HIS 18 0.769 -9.906 -4.330 131 HD1 HIS 18 HD1 HIS 18 0.983 -12.225 -5.539 132 HD2 HIS 18 HD2 HIS 18 4.018 -11.372 -2.832 133 HE1 HIS 18 HE1 HIS 18 2.148 -14.414 -5.124 134 HE2 HIS 18 HE2 HIS 18 4.036 -13.857 -3.551 135 H LEU 19 H LEU 19 3.919 -8.504 -3.432 136 HA LEU 19 HA LEU 19 6.345 -8.048 -4.786 137 HB2 LEU 19 HB3 LEU 19 7.369 -8.241 -2.495 138 HB3 LEU 19 HB2 LEU 19 6.092 -7.052 -2.668 139 HG LEU 19 HG LEU 19 4.693 -9.251 -1.818 140 HD11 LEU 19 HD11 LEU 19 6.724 -10.527 -1.429 141 HD12 LEU 19 HD12 LEU 19 5.919 -10.155 0.095 142 HD13 LEU 19 HD13 LEU 19 7.349 -9.244 -0.393 143 HD21 LEU 19 HD21 LEU 19 4.763 -6.788 -1.056 144 HD22 LEU 19 HD22 LEU 19 5.935 -7.351 0.136 145 HD23 LEU 19 HD23 LEU 19 4.304 -8.023 0.117 146 HA PRO 20 HA PRO 20 7.557 -12.314 -5.361 147 HB2 PRO 20 HB3 PRO 20 9.846 -11.876 -6.674 148 HB3 PRO 20 HB2 PRO 20 8.283 -11.531 -7.421 149 HG2 PRO 20 HG3 PRO 20 10.226 -9.651 -6.142 150 HG3 PRO 20 HG2 PRO 20 9.297 -9.453 -7.638 151 HD2 PRO 20 HD3 PRO 20 8.580 -8.361 -5.219 152 HD3 PRO 20 HD2 PRO 20 7.436 -8.728 -6.524 153 H TRP 21 H TRP 21 9.150 -10.008 -3.414 154 HA TRP 21 HA TRP 21 11.267 -11.843 -2.611 155 HB2 TRP 21 HB3 TRP 21 11.893 -9.875 -1.095 156 HB3 TRP 21 HB2 TRP 21 12.060 -9.635 -2.832 157 HD1 TRP 21 HD1 TRP 21 9.405 -8.903 -0.094 158 HE1 TRP 21 HE1 TRP 21 8.286 -6.657 -0.659 159 HE3 TRP 21 HE3 TRP 21 11.790 -7.902 -4.502 160 HZ2 TRP 21 HZ2 TRP 21 8.395 -4.719 -2.712 161 HZ3 TRP 21 HZ3 TRP 21 11.220 -5.835 -5.707 162 HH2 TRP 21 HH2 TRP 21 9.558 -4.278 -4.830 163 H HIS 22 H HIS 22 11.403 -12.832 -0.652 164 HA HIS 22 HA HIS 22 8.946 -13.036 0.864 165 HB2 HIS 22 HB3 HIS 22 11.217 -14.703 0.386 166 HB3 HIS 22 HB2 HIS 22 11.063 -14.470 2.124 167 HD1 HIS 22 HD1 HIS 22 9.238 -15.743 3.299 168 HD2 HIS 22 HD2 HIS 22 8.900 -15.906 -0.840 169 HE1 HIS 22 HE1 HIS 22 7.432 -17.430 2.838 170 HE2 HIS 22 HE2 HIS 22 7.182 -17.444 0.331 171 H LEU 23 H LEU 23 8.795 -10.979 1.805 172 HA LEU 23 HA LEU 23 10.883 -10.279 3.745 173 HB2 LEU 23 HB3 LEU 23 9.057 -8.751 2.043 174 HB3 LEU 23 HB2 LEU 23 9.115 -8.170 3.696 175 HG LEU 23 HG LEU 23 11.617 -8.049 3.475 176 HD11 LEU 23 HD11 LEU 23 12.699 -8.658 1.621 177 HD12 LEU 23 HD12 LEU 23 11.505 -7.902 0.567 178 HD13 LEU 23 HD13 LEU 23 11.222 -9.525 1.197 179 HD21 LEU 23 HD21 LEU 23 10.632 -6.271 1.357 180 HD22 LEU 23 HD22 LEU 23 11.425 -5.890 2.885 181 HD23 LEU 23 HD23 LEU 23 9.697 -6.237 2.851 182 HA PRO 24 HA PRO 24 7.620 -11.974 6.505 183 HB2 PRO 24 HB3 PRO 24 9.354 -12.704 8.469 184 HB3 PRO 24 HB2 PRO 24 8.996 -13.723 7.071 185 HG2 PRO 24 HG3 PRO 24 11.331 -11.913 7.546 186 HG3 PRO 24 HG2 PRO 24 11.304 -13.548 6.860 187 HD2 PRO 24 HD3 PRO 24 11.491 -11.332 5.321 188 HD3 PRO 24 HD2 PRO 24 10.652 -12.799 4.779 189 H ASP 25 H ASP 25 10.238 -9.712 7.065 190 HA ASP 25 HA ASP 25 9.354 -8.750 9.574 191 HB2 ASP 25 HB3 ASP 25 10.861 -6.801 8.978 192 HB3 ASP 25 HB2 ASP 25 11.626 -8.381 9.008 193 H ASP 26 H ASP 26 8.540 -7.989 6.266 194 HA ASP 26 HA ASP 26 7.251 -5.501 6.877 195 HB2 ASP 26 HB3 ASP 26 7.563 -7.212 4.457 196 HB3 ASP 26 HB2 ASP 26 6.231 -6.060 4.482 197 H LEU 27 H LEU 27 6.126 -8.792 6.146 198 HA LEU 27 HA LEU 27 3.380 -8.288 6.259 199 HB2 LEU 27 HB3 LEU 27 4.670 -10.840 7.198 200 HB3 LEU 27 HB2 LEU 27 3.079 -10.634 6.491 201 HG LEU 27 HG LEU 27 5.342 -9.828 4.772 202 HD11 LEU 27 HD11 LEU 27 4.886 -12.708 4.665 203 HD12 LEU 27 HD12 LEU 27 5.688 -12.171 6.142 204 HD13 LEU 27 HD13 LEU 27 6.389 -11.789 4.569 205 HD21 LEU 27 HD21 LEU 27 3.273 -11.741 3.911 206 HD22 LEU 27 HD22 LEU 27 3.895 -10.298 3.110 207 HD23 LEU 27 HD23 LEU 27 2.700 -10.145 4.397 208 H HIS 28 H HIS 28 5.448 -9.667 8.818 209 HA HIS 28 HA HIS 28 3.591 -9.702 10.863 210 HB2 HIS 28 HB3 HIS 28 6.028 -10.578 10.801 211 HB3 HIS 28 HB2 HIS 28 6.461 -8.974 11.381 212 HD1 HIS 28 HD1 HIS 28 7.236 -10.954 13.321 213 HD2 HIS 28 HD2 HIS 28 3.302 -9.627 13.155 214 HE1 HIS 28 HE1 HIS 28 6.253 -11.480 15.575 215 HE2 HIS 28 HE2 HIS 28 3.848 -10.744 15.422 216 H TYR 29 H TYR 29 5.684 -7.046 9.827 217 HA TYR 29 HA TYR 29 4.892 -5.270 11.910 218 HB2 TYR 29 HB3 TYR 29 7.027 -5.074 10.626 219 HB3 TYR 29 HB2 TYR 29 6.090 -4.573 9.222 220 HD1 TYR 29 HD1 TYR 29 5.830 -3.623 12.825 221 HD2 TYR 29 HD2 TYR 29 6.552 -2.340 8.834 222 HE1 TYR 29 HE1 TYR 29 5.931 -1.291 13.599 223 HE2 TYR 29 HE2 TYR 29 6.656 -0.004 9.596 224 HH TYR 29 HH TYR 29 7.204 1.182 11.830 225 H PHE 30 H PHE 30 3.786 -5.883 8.628 226 HA PHE 30 HA PHE 30 2.133 -3.648 8.304 227 HB2 PHE 30 HB3 PHE 30 2.833 -5.503 6.610 228 HB3 PHE 30 HB2 PHE 30 1.392 -6.334 7.185 229 HD1 PHE 30 HD2 PHE 30 2.600 -3.231 5.582 230 HD2 PHE 30 HD1 PHE 30 -0.745 -5.721 6.432 231 HE1 PHE 30 HE2 PHE 30 1.226 -1.909 4.026 232 HE2 PHE 30 HE1 PHE 30 -2.125 -4.405 4.877 233 HZ PHE 30 HZ PHE 30 -1.140 -2.495 3.673 234 H ARG 31 H ARG 31 1.248 -6.940 9.348 235 HA ARG 31 HA ARG 31 -1.427 -6.357 9.962 236 HB2 ARG 31 HB3 ARG 31 -0.381 -8.641 9.676 237 HB3 ARG 31 HB2 ARG 31 0.267 -8.466 11.300 238 HG2 ARG 31 HG3 ARG 31 -1.652 -9.687 11.657 239 HG3 ARG 31 HG2 ARG 31 -2.191 -8.038 11.978 240 HD2 ARG 31 HD3 ARG 31 -3.812 -9.238 10.611 241 HD3 ARG 31 HD2 ARG 31 -3.109 -7.892 9.720 242 HE ARG 31 HE ARG 31 -2.664 -10.738 9.234 243 HH11 ARG 31 HH11 ARG 31 -1.952 -7.424 8.375 244 HH12 ARG 31 HH12 ARG 31 -1.303 -7.839 6.826 245 HH21 ARG 31 HH21 ARG 31 -1.805 -11.275 7.198 246 HH22 ARG 31 HH22 ARG 31 -1.218 -10.021 6.158 247 H ALA 32 H ALA 32 1.504 -5.781 11.719 248 HA ALA 32 HA ALA 32 0.280 -5.493 14.292 249 HB1 ALA 32 HB1 ALA 32 2.384 -5.073 15.098 250 HB2 ALA 32 HB2 ALA 32 2.890 -4.213 13.644 251 HB3 ALA 32 HB3 ALA 32 2.774 -5.973 13.633 252 H GLN 33 H GLN 33 1.212 -3.294 11.694 253 HA GLN 33 HA GLN 33 0.438 -0.961 13.223 254 HB2 GLN 33 HB3 GLN 33 2.010 -1.484 10.880 255 HB3 GLN 33 HB2 GLN 33 0.789 -0.277 10.501 256 HG2 GLN 33 HG3 GLN 33 1.686 0.673 12.855 257 HG3 GLN 33 HG2 GLN 33 3.146 -0.108 12.249 258 HE21 GLN 33 HE21 GLN 33 2.932 0.303 9.563 259 HE22 GLN 33 HE22 GLN 33 3.013 1.993 9.217 260 H THR 34 H THR 34 -0.970 -3.090 10.867 261 HA THR 34 HA THR 34 -3.156 -1.247 10.311 262 HB THR 34 HB THR 34 -3.934 -2.990 8.749 263 HG1 THR 34 HG1 THR 34 -1.616 -4.419 9.529 264 HG21 THR 34 HG21 THR 34 -1.079 -2.945 8.067 265 HG22 THR 34 HG22 THR 34 -1.828 -1.371 8.333 266 HG23 THR 34 HG23 THR 34 -2.488 -2.468 7.119 267 H VAL 35 H VAL 35 -2.872 -2.231 13.017 268 HA VAL 35 HA VAL 35 -5.031 -4.162 13.331 269 HB VAL 35 HB VAL 35 -3.465 -2.802 15.523 270 HG11 VAL 35 HG11 VAL 35 -5.196 -3.783 16.629 271 HG12 VAL 35 HG12 VAL 35 -4.117 -5.175 16.528 272 HG13 VAL 35 HG13 VAL 35 -5.447 -5.005 15.382 273 HG21 VAL 35 HG21 VAL 35 -2.032 -4.035 13.851 274 HG22 VAL 35 HG22 VAL 35 -2.873 -5.506 14.340 275 HG23 VAL 35 HG23 VAL 35 -1.922 -4.602 15.518 276 H GLY 36 H GLY 36 -7.051 -3.438 13.313 277 HA2 GLY 36 HA3 GLY 36 -8.909 -2.264 14.034 278 HA3 GLY 36 HA2 GLY 36 -7.864 -1.334 15.096 279 H LYS 37 H LYS 37 -6.922 -1.469 11.797 280 HA LYS 37 HA LYS 37 -7.963 1.261 11.409 281 HB2 LYS 37 HB3 LYS 37 -5.500 0.059 10.137 282 HB3 LYS 37 HB2 LYS 37 -6.030 1.733 10.038 283 HG2 LYS 37 HG3 LYS 37 -5.745 1.843 12.543 284 HG3 LYS 37 HG2 LYS 37 -4.937 0.278 12.427 285 HD2 LYS 37 HD3 LYS 37 -3.257 1.210 10.961 286 HD3 LYS 37 HD2 LYS 37 -4.101 2.759 10.927 287 HE2 LYS 37 HE3 LYS 37 -3.810 2.568 13.547 288 HE3 LYS 37 HE2 LYS 37 -2.465 1.526 13.085 289 HZ1 LYS 37 HZ1 LYS 37 -1.423 3.271 11.947 290 HZ2 LYS 37 HZ2 LYS 37 -1.960 3.967 13.391 291 HZ3 LYS 37 HZ3 LYS 37 -2.810 4.240 11.955 292 H ILE 38 H ILE 38 -7.536 1.622 8.759 293 HA ILE 38 HA ILE 38 -9.069 -0.537 7.469 294 HB ILE 38 HB ILE 38 -9.571 1.949 6.135 295 HG12 ILE 38 HG13 ILE 38 -10.764 2.037 8.876 296 HG13 ILE 38 HG12 ILE 38 -9.147 2.687 8.640 297 HG21 ILE 38 HG21 ILE 38 -10.863 -0.403 6.615 298 HG22 ILE 38 HG22 ILE 38 -11.594 1.027 5.888 299 HG23 ILE 38 HG23 ILE 38 -11.775 0.727 7.616 300 HD11 ILE 38 HD11 ILE 38 -10.371 4.564 8.296 301 HD12 ILE 38 HD12 ILE 38 -11.754 3.680 7.651 302 HD13 ILE 38 HD13 ILE 38 -10.329 3.945 6.646 303 H MET 39 H MET 39 -7.971 -1.442 5.881 304 HA MET 39 HA MET 39 -5.910 0.148 4.507 305 HB2 MET 39 HB3 MET 39 -5.075 -1.854 5.648 306 HB3 MET 39 HB2 MET 39 -6.195 -2.854 4.735 307 HG2 MET 39 HG3 MET 39 -4.242 -1.140 3.278 308 HG3 MET 39 HG2 MET 39 -3.699 -2.647 4.014 309 HE1 MET 39 HE1 MET 39 -5.422 -4.550 4.007 310 HE2 MET 39 HE2 MET 39 -5.317 -5.397 2.464 311 HE3 MET 39 HE3 MET 39 -6.817 -4.594 2.929 312 H VAL 40 H VAL 40 -6.216 0.708 2.461 313 HA VAL 40 HA VAL 40 -8.508 -0.351 1.012 314 HB VAL 40 HB VAL 40 -6.568 1.791 0.132 315 HG11 VAL 40 HG11 VAL 40 -7.874 2.135 -1.672 316 HG12 VAL 40 HG12 VAL 40 -9.362 1.770 -0.798 317 HG13 VAL 40 HG13 VAL 40 -8.345 0.458 -1.394 318 HG21 VAL 40 HG21 VAL 40 -9.238 2.588 1.060 319 HG22 VAL 40 HG22 VAL 40 -7.669 3.353 1.315 320 HG23 VAL 40 HG23 VAL 40 -8.159 1.991 2.321 321 H VAL 41 H VAL 41 -8.393 -1.716 -0.687 322 HA VAL 41 HA VAL 41 -5.725 -2.340 -1.763 323 HB VAL 41 HB VAL 41 -7.064 -4.045 -0.142 324 HG11 VAL 41 HG11 VAL 41 -8.916 -4.282 -1.759 325 HG12 VAL 41 HG12 VAL 41 -8.100 -5.807 -1.411 326 HG13 VAL 41 HG13 VAL 41 -7.777 -4.959 -2.923 327 HG21 VAL 41 HG21 VAL 41 -5.092 -5.005 -0.436 328 HG22 VAL 41 HG22 VAL 41 -4.862 -4.162 -1.967 329 HG23 VAL 41 HG23 VAL 41 -5.695 -5.717 -1.932 330 H GLY 42 H GLY 42 -5.570 -2.724 -3.947 331 HA2 GLY 42 HA3 GLY 42 -7.666 -1.661 -5.586 332 HA3 GLY 42 HA2 GLY 42 -6.144 -2.337 -6.150 333 H ARG 43 H ARG 43 -8.405 -2.836 -7.588 334 HA ARG 43 HA ARG 43 -9.931 -5.036 -6.928 335 HB2 ARG 43 HB3 ARG 43 -9.812 -5.392 -9.558 336 HB3 ARG 43 HB2 ARG 43 -10.729 -4.083 -8.835 337 HG2 ARG 43 HG3 ARG 43 -9.356 -2.496 -9.645 338 HG3 ARG 43 HG2 ARG 43 -7.910 -3.486 -9.450 339 HD2 ARG 43 HD3 ARG 43 -8.389 -3.066 -11.808 340 HD3 ARG 43 HD2 ARG 43 -8.524 -4.782 -11.424 341 HE ARG 43 HE ARG 43 -11.030 -3.457 -11.210 342 HH11 ARG 43 HH11 ARG 43 -8.782 -4.806 -13.512 343 HH12 ARG 43 HH12 ARG 43 -9.998 -5.125 -14.703 344 HH21 ARG 43 HH21 ARG 43 -12.633 -3.877 -12.775 345 HH22 ARG 43 HH22 ARG 43 -12.184 -4.597 -14.285 346 H ARG 44 H ARG 44 -7.050 -5.108 -9.035 347 HA ARG 44 HA ARG 44 -6.835 -7.915 -9.051 348 HB2 ARG 44 HB3 ARG 44 -4.750 -5.788 -9.567 349 HB3 ARG 44 HB2 ARG 44 -4.523 -7.500 -9.897 350 HG2 ARG 44 HG3 ARG 44 -6.530 -5.664 -11.187 351 HG3 ARG 44 HG2 ARG 44 -5.090 -6.362 -11.933 352 HD2 ARG 44 HD3 ARG 44 -6.671 -7.822 -12.699 353 HD3 ARG 44 HD2 ARG 44 -6.228 -8.624 -11.193 354 HE ARG 44 HE ARG 44 -8.274 -7.031 -10.448 355 HH11 ARG 44 HH11 ARG 44 -7.898 -9.358 -13.021 356 HH12 ARG 44 HH12 ARG 44 -9.574 -9.791 -13.045 357 HH21 ARG 44 HH21 ARG 44 -10.480 -7.598 -10.477 358 HH22 ARG 44 HH22 ARG 44 -11.041 -8.791 -11.601 359 H THR 45 H THR 45 -6.061 -5.604 -6.669 360 HA THR 45 HA THR 45 -3.949 -7.045 -5.396 361 HB THR 45 HB THR 45 -5.568 -5.138 -3.814 362 HG1 THR 45 HG1 THR 45 -4.026 -4.273 -6.027 363 HG21 THR 45 HG21 THR 45 -2.626 -5.352 -4.400 364 HG22 THR 45 HG22 THR 45 -3.452 -5.890 -2.937 365 HG23 THR 45 HG23 THR 45 -3.370 -4.171 -3.322 366 H TYR 46 H TYR 46 -7.394 -6.520 -4.560 367 HA TYR 46 HA TYR 46 -7.445 -8.100 -2.283 368 HB2 TYR 46 HB3 TYR 46 -9.829 -8.166 -2.482 369 HB3 TYR 46 HB2 TYR 46 -9.299 -6.598 -3.074 370 HD1 TYR 46 HD2 TYR 46 -10.054 -10.020 -4.391 371 HD2 TYR 46 HD1 TYR 46 -10.257 -5.816 -5.033 372 HE1 TYR 46 HE2 TYR 46 -11.279 -10.401 -6.476 373 HE2 TYR 46 HE1 TYR 46 -11.500 -6.197 -7.118 374 HH TYR 46 HH TYR 46 -11.864 -7.912 -8.760 375 H GLU 47 H GLU 47 -7.891 -9.065 -5.666 376 HA GLU 47 HA GLU 47 -8.360 -11.816 -5.002 377 HB2 GLU 47 HB3 GLU 47 -8.513 -10.166 -7.334 378 HB3 GLU 47 HB2 GLU 47 -7.525 -11.573 -7.705 379 HG2 GLU 47 HG3 GLU 47 -9.250 -13.054 -7.303 380 HG3 GLU 47 HG2 GLU 47 -10.145 -11.896 -6.322 381 H SER 48 H SER 48 -5.599 -9.842 -5.610 382 HA SER 48 HA SER 48 -3.881 -12.210 -5.872 383 HB2 SER 48 HB3 SER 48 -3.709 -10.283 -7.526 384 HB3 SER 48 HB2 SER 48 -3.015 -9.339 -6.208 385 HG SER 48 HG SER 48 -1.989 -11.661 -7.447 386 H PHE 49 H PHE 49 -5.142 -11.015 -3.342 387 HA PHE 49 HA PHE 49 -2.739 -10.327 -1.836 388 HB2 PHE 49 HB3 PHE 49 -5.192 -9.275 -1.665 389 HB3 PHE 49 HB2 PHE 49 -5.381 -10.572 -0.489 390 HD1 PHE 49 HD1 PHE 49 -2.967 -7.866 -1.377 391 HD2 PHE 49 HD2 PHE 49 -4.845 -10.133 1.697 392 HE1 PHE 49 HE1 PHE 49 -1.845 -6.485 0.322 393 HE2 PHE 49 HE2 PHE 49 -3.727 -8.756 3.401 394 HZ PHE 49 HZ PHE 49 -2.225 -6.929 2.715 395 HA PRO 50 HA PRO 50 -2.320 -14.465 -0.305 396 HB2 PRO 50 HB3 PRO 50 -0.631 -14.025 1.740 397 HB3 PRO 50 HB2 PRO 50 -0.122 -13.863 0.055 398 HG2 PRO 50 HG3 PRO 50 -0.902 -11.736 2.011 399 HG3 PRO 50 HG2 PRO 50 0.441 -11.753 0.854 400 HD2 PRO 50 HD3 PRO 50 -1.920 -10.452 0.406 401 HD3 PRO 50 HD2 PRO 50 -0.894 -11.094 -0.891 402 H LYS 51 H LYS 51 -3.344 -11.872 1.829 403 HA LYS 51 HA LYS 51 -4.783 -13.863 3.452 404 HB2 LYS 51 HB3 LYS 51 -2.730 -12.797 4.567 405 HB3 LYS 51 HB2 LYS 51 -3.675 -11.315 4.611 406 HG2 LYS 51 HG3 LYS 51 -3.985 -12.282 6.711 407 HG3 LYS 51 HG2 LYS 51 -5.455 -12.678 5.819 408 HD2 LYS 51 HD3 LYS 51 -5.076 -14.791 6.452 409 HD3 LYS 51 HD2 LYS 51 -3.798 -14.794 5.235 410 HE2 LYS 51 HE3 LYS 51 -2.155 -14.190 6.884 411 HE3 LYS 51 HE2 LYS 51 -3.403 -13.980 8.111 412 HZ1 LYS 51 HZ1 LYS 51 -2.181 -16.412 7.110 413 HZ2 LYS 51 HZ2 LYS 51 -3.853 -16.495 7.355 414 HZ3 LYS 51 HZ3 LYS 51 -2.831 -16.073 8.635 415 H ARG 52 H ARG 52 -6.556 -13.380 1.995 416 HA ARG 52 HA ARG 52 -7.881 -10.838 2.666 417 HB2 ARG 52 HB3 ARG 52 -9.064 -11.125 0.438 418 HB3 ARG 52 HB2 ARG 52 -7.359 -10.702 0.364 419 HG2 ARG 52 HG3 ARG 52 -6.874 -12.534 -0.786 420 HG3 ARG 52 HG2 ARG 52 -7.713 -13.564 0.375 421 HD2 ARG 52 HD3 ARG 52 -8.941 -12.067 -1.937 422 HD3 ARG 52 HD2 ARG 52 -8.721 -13.811 -1.806 423 HE ARG 52 HE ARG 52 -10.235 -13.170 0.362 424 HH11 ARG 52 HH11 ARG 52 -10.551 -12.636 -3.073 425 HH12 ARG 52 HH12 ARG 52 -12.282 -12.658 -3.044 426 HH21 ARG 52 HH21 ARG 52 -12.513 -13.200 0.401 427 HH22 ARG 52 HH22 ARG 52 -13.396 -12.978 -1.072 428 HA PRO 53 HA PRO 53 -9.384 -9.990 3.429 429 HB2 PRO 53 HB3 PRO 53 -11.023 -10.140 5.765 430 HB3 PRO 53 HB2 PRO 53 -11.430 -9.430 4.203 431 HG2 PRO 53 HG3 PRO 53 -12.616 -11.688 5.275 432 HG3 PRO 53 HG2 PRO 53 -12.616 -11.258 3.556 433 HD2 PRO 53 HD3 PRO 53 -10.881 -13.199 5.028 434 HD3 PRO 53 HD2 PRO 53 -11.582 -13.319 3.399 435 H LEU 54 H LEU 54 -8.660 -8.771 5.409 436 HA LEU 54 HA LEU 54 -6.675 -10.357 6.815 437 HB2 LEU 54 HB3 LEU 54 -7.194 -7.395 6.666 438 HB3 LEU 54 HB2 LEU 54 -5.951 -8.099 7.682 439 HG LEU 54 HG LEU 54 -5.762 -9.007 4.919 440 HD11 LEU 54 HD11 LEU 54 -5.510 -7.080 3.768 441 HD12 LEU 54 HD12 LEU 54 -4.916 -6.191 5.171 442 HD13 LEU 54 HD13 LEU 54 -6.645 -6.478 4.976 443 HD21 LEU 54 HD21 LEU 54 -3.419 -7.903 5.403 444 HD22 LEU 54 HD22 LEU 54 -3.876 -9.440 6.139 445 HD23 LEU 54 HD23 LEU 54 -3.999 -7.945 7.068 446 HA PRO 55 HA PRO 55 -9.344 -10.680 10.386 447 HB2 PRO 55 HB3 PRO 55 -7.009 -11.682 11.830 448 HB3 PRO 55 HB2 PRO 55 -8.496 -12.524 11.388 449 HG2 PRO 55 HG3 PRO 55 -6.113 -13.080 10.237 450 HG3 PRO 55 HG2 PRO 55 -7.653 -13.231 9.371 451 HD2 PRO 55 HD3 PRO 55 -5.618 -11.035 9.253 452 HD3 PRO 55 HD2 PRO 55 -6.542 -11.791 7.936 453 H GLU 56 H GLU 56 -9.623 -9.766 12.419 454 HA GLU 56 HA GLU 56 -9.576 -8.056 13.913 455 HB2 GLU 56 HB3 GLU 56 -6.771 -9.059 13.803 456 HB3 GLU 56 HB2 GLU 56 -7.109 -7.614 14.746 457 HG2 GLU 56 HG3 GLU 56 -7.932 -8.813 16.411 458 HG3 GLU 56 HG2 GLU 56 -9.042 -9.653 15.330 459 H ARG 57 H ARG 57 -9.342 -7.278 11.064 460 HA ARG 57 HA ARG 57 -8.579 -4.534 11.566 461 HB2 ARG 57 HB3 ARG 57 -6.914 -4.304 9.951 462 HB3 ARG 57 HB2 ARG 57 -6.520 -5.826 10.730 463 HG2 ARG 57 HG3 ARG 57 -6.243 -6.353 8.518 464 HG3 ARG 57 HG2 ARG 57 -7.904 -6.874 8.797 465 HD2 ARG 57 HD3 ARG 57 -7.289 -5.433 6.697 466 HD3 ARG 57 HD2 ARG 57 -8.794 -5.157 7.567 467 HE ARG 57 HE ARG 57 -8.006 -3.105 8.233 468 HH11 ARG 57 HH11 ARG 57 -5.386 -4.958 6.859 469 HH12 ARG 57 HH12 ARG 57 -4.284 -3.623 6.847 470 HH21 ARG 57 HH21 ARG 57 -6.558 -1.352 8.221 471 HH22 ARG 57 HH22 ARG 57 -4.949 -1.575 7.621 472 H THR 58 H THR 58 -9.314 -3.053 9.874 473 HA THR 58 HA THR 58 -11.821 -3.970 8.763 474 HB THR 58 HB THR 58 -10.605 -1.235 8.411 475 HG1 THR 58 HG1 THR 58 -11.970 -2.322 10.630 476 HG21 THR 58 HG21 THR 58 -13.428 -2.254 8.418 477 HG22 THR 58 HG22 THR 58 -12.560 -1.464 7.101 478 HG23 THR 58 HG23 THR 58 -13.007 -0.546 8.540 479 H ASN 59 H ASN 59 -12.071 -4.742 6.792 480 HA ASN 59 HA ASN 59 -9.894 -4.480 4.874 481 HB2 ASN 59 HB3 ASN 59 -12.409 -6.128 4.603 482 HB3 ASN 59 HB2 ASN 59 -10.909 -6.304 3.696 483 HD21 ASN 59 HD21 ASN 59 -9.112 -6.048 5.829 484 HD22 ASN 59 HD22 ASN 59 -9.259 -7.445 6.833 485 H VAL 60 H VAL 60 -9.985 -3.354 3.031 486 HA VAL 60 HA VAL 60 -12.564 -2.286 2.137 487 HB VAL 60 HB VAL 60 -10.047 -0.639 2.442 488 HG11 VAL 60 HG11 VAL 60 -11.987 1.145 1.865 489 HG12 VAL 60 HG12 VAL 60 -12.533 -0.232 0.908 490 HG13 VAL 60 HG13 VAL 60 -10.919 0.433 0.654 491 HG21 VAL 60 HG21 VAL 60 -11.931 0.680 3.836 492 HG22 VAL 60 HG22 VAL 60 -10.849 -0.514 4.554 493 HG23 VAL 60 HG23 VAL 60 -12.483 -0.978 4.075 494 H VAL 61 H VAL 61 -12.868 -2.496 0.001 495 HA VAL 61 HA VAL 61 -10.498 -3.053 -1.668 496 HB VAL 61 HB VAL 61 -13.241 -4.277 -1.974 497 HG11 VAL 61 HG11 VAL 61 -10.708 -4.493 -3.563 498 HG12 VAL 61 HG12 VAL 61 -12.351 -4.182 -4.127 499 HG13 VAL 61 HG13 VAL 61 -11.901 -5.791 -3.561 500 HG21 VAL 61 HG21 VAL 61 -11.590 -4.972 -0.038 501 HG22 VAL 61 HG22 VAL 61 -10.809 -5.867 -1.341 502 HG23 VAL 61 HG23 VAL 61 -12.499 -6.180 -0.946 503 H LEU 62 H LEU 62 -10.343 -2.109 -3.627 504 HA LEU 62 HA LEU 62 -12.555 -0.375 -4.506 505 HB2 LEU 62 HB3 LEU 62 -10.587 0.867 -3.507 506 HB3 LEU 62 HB2 LEU 62 -9.622 0.264 -4.840 507 HG LEU 62 HG LEU 62 -11.499 1.395 -6.308 508 HD11 LEU 62 HD11 LEU 62 -11.583 3.459 -4.223 509 HD12 LEU 62 HD12 LEU 62 -12.530 2.010 -3.881 510 HD13 LEU 62 HD13 LEU 62 -12.830 2.932 -5.356 511 HD21 LEU 62 HD21 LEU 62 -10.177 3.572 -6.115 512 HD22 LEU 62 HD22 LEU 62 -9.283 2.116 -6.555 513 HD23 LEU 62 HD23 LEU 62 -9.207 2.733 -4.903 514 H THR 63 H THR 63 -13.364 -1.374 -6.248 515 HA THR 63 HA THR 63 -11.486 -2.227 -8.342 516 HB THR 63 HB THR 63 -12.226 -4.270 -7.401 517 HG1 THR 63 HG1 THR 63 -12.507 -3.983 -9.751 518 HG21 THR 63 HG21 THR 63 -15.103 -3.471 -7.656 519 HG22 THR 63 HG22 THR 63 -14.186 -3.240 -6.167 520 HG23 THR 63 HG23 THR 63 -14.412 -4.862 -6.821 521 H HIS 64 H HIS 64 -12.281 -2.107 -10.495 522 HA HIS 64 HA HIS 64 -13.956 0.156 -10.959 523 HB2 HIS 64 HB3 HIS 64 -12.052 -1.342 -12.426 524 HB3 HIS 64 HB2 HIS 64 -13.549 -1.372 -13.351 525 HD1 HIS 64 HD1 HIS 64 -12.429 0.153 -15.147 526 HD2 HIS 64 HD2 HIS 64 -12.791 1.882 -11.388 527 HE1 HIS 64 HE1 HIS 64 -12.002 2.606 -15.489 528 HE2 HIS 64 HE2 HIS 64 -12.132 3.617 -13.187 529 H GLN 65 H GLN 65 -14.385 -3.319 -11.119 530 HA GLN 65 HA GLN 65 -16.712 -3.501 -12.604 531 HB2 GLN 65 HB3 GLN 65 -15.694 -5.143 -10.294 532 HB3 GLN 65 HB2 GLN 65 -17.179 -5.550 -11.143 533 HG2 GLN 65 HG3 GLN 65 -16.094 -6.326 -12.950 534 HG3 GLN 65 HG2 GLN 65 -14.833 -5.098 -12.854 535 HE21 GLN 65 HE21 GLN 65 -13.609 -5.421 -10.579 536 HE22 GLN 65 HE22 GLN 65 -12.970 -7.014 -10.388 537 H GLU 66 H GLU 66 -18.754 -2.914 -12.304 538 HA GLU 66 HA GLU 66 -19.482 -1.539 -9.865 539 HB2 GLU 66 HB3 GLU 66 -21.515 -0.921 -11.045 540 HB3 GLU 66 HB2 GLU 66 -20.113 -0.619 -12.061 541 HG2 GLU 66 HG3 GLU 66 -20.818 -3.170 -12.764 542 HG3 GLU 66 HG2 GLU 66 -22.378 -2.402 -12.471 543 H ASP 67 H ASP 67 -20.188 -4.563 -11.472 544 HA ASP 67 HA ASP 67 -22.216 -5.213 -9.468 545 HB2 ASP 67 HB3 ASP 67 -22.390 -5.595 -12.067 546 HB3 ASP 67 HB2 ASP 67 -21.495 -7.066 -11.698 547 H TYR 68 H TYR 68 -19.144 -5.233 -9.093 548 HA TYR 68 HA TYR 68 -18.706 -8.050 -8.509 549 HB2 TYR 68 HB3 TYR 68 -16.900 -6.567 -9.462 550 HB3 TYR 68 HB2 TYR 68 -16.849 -5.745 -7.905 551 HD1 TYR 68 HD1 TYR 68 -16.065 -8.833 -9.709 552 HD2 TYR 68 HD2 TYR 68 -15.933 -6.857 -5.944 553 HE1 TYR 68 HE1 TYR 68 -14.514 -10.546 -8.871 554 HE2 TYR 68 HE2 TYR 68 -14.380 -8.564 -5.096 555 HH TYR 68 HH TYR 68 -13.789 -10.928 -5.603 556 H GLN 69 H GLN 69 -18.512 -8.934 -6.483 557 HA GLN 69 HA GLN 69 -19.202 -7.179 -4.219 558 HB2 GLN 69 HB3 GLN 69 -20.220 -9.960 -4.810 559 HB3 GLN 69 HB2 GLN 69 -20.434 -9.152 -3.264 560 HG2 GLN 69 HG3 GLN 69 -21.467 -8.153 -5.908 561 HG3 GLN 69 HG2 GLN 69 -22.419 -8.996 -4.687 562 HE21 GLN 69 HE21 GLN 69 -20.909 -6.029 -5.601 563 HE22 GLN 69 HE22 GLN 69 -21.575 -5.054 -4.340 564 H ALA 70 H ALA 70 -17.607 -7.108 -2.801 565 HA ALA 70 HA ALA 70 -15.768 -9.387 -2.591 566 HB1 ALA 70 HB1 ALA 70 -14.114 -7.934 -1.848 567 HB2 ALA 70 HB2 ALA 70 -15.278 -6.716 -1.328 568 HB3 ALA 70 HB3 ALA 70 -14.977 -6.970 -3.047 569 H GLN 71 H GLN 71 -16.689 -10.771 -1.182 570 HA GLN 71 HA GLN 71 -18.140 -10.005 1.119 571 HB2 GLN 71 HB3 GLN 71 -16.897 -12.622 0.280 572 HB3 GLN 71 HB2 GLN 71 -17.821 -12.440 1.764 573 HG2 GLN 71 HG3 GLN 71 -18.783 -12.148 -1.062 574 HG3 GLN 71 HG2 GLN 71 -19.289 -13.327 0.146 575 HE21 GLN 71 HE21 GLN 71 -19.411 -9.954 -0.784 576 HE22 GLN 71 HE22 GLN 71 -20.827 -9.556 0.120 577 H GLY 72 H GLY 72 -17.523 -9.648 3.153 578 HA2 GLY 72 HA3 GLY 72 -16.100 -9.899 5.033 579 HA3 GLY 72 HA2 GLY 72 -14.785 -10.321 3.947 580 H ALA 73 H ALA 73 -15.274 -8.023 2.132 581 HA ALA 73 HA ALA 73 -14.450 -5.844 3.942 582 HB1 ALA 73 HB1 ALA 73 -12.558 -6.935 2.688 583 HB2 ALA 73 HB2 ALA 73 -12.730 -5.197 2.441 584 HB3 ALA 73 HB3 ALA 73 -13.293 -6.324 1.207 585 H VAL 74 H VAL 74 -14.589 -3.662 2.833 586 HA VAL 74 HA VAL 74 -17.187 -3.424 1.610 587 HB VAL 74 HB VAL 74 -16.545 -0.939 1.641 588 HG11 VAL 74 HG11 VAL 74 -16.829 -2.483 4.204 589 HG12 VAL 74 HG12 VAL 74 -18.136 -1.884 3.181 590 HG13 VAL 74 HG13 VAL 74 -17.091 -0.746 4.034 591 HG21 VAL 74 HG21 VAL 74 -14.434 -1.927 3.539 592 HG22 VAL 74 HG22 VAL 74 -14.803 -0.252 3.135 593 HG23 VAL 74 HG23 VAL 74 -14.120 -1.321 1.913 594 H VAL 75 H VAL 75 -17.612 -2.602 -0.441 595 HA VAL 75 HA VAL 75 -15.280 -2.441 -2.237 596 HB VAL 75 HB VAL 75 -18.009 -3.462 -3.018 597 HG11 VAL 75 HG11 VAL 75 -15.475 -2.939 -4.440 598 HG12 VAL 75 HG12 VAL 75 -17.138 -2.896 -5.026 599 HG13 VAL 75 HG13 VAL 75 -16.305 -4.440 -4.849 600 HG21 VAL 75 HG21 VAL 75 -16.384 -5.615 -3.205 601 HG22 VAL 75 HG22 VAL 75 -17.416 -5.272 -1.817 602 HG23 VAL 75 HG23 VAL 75 -15.712 -4.819 -1.782 603 H VAL 76 H VAL 76 -15.251 -0.873 -3.780 604 HA VAL 76 HA VAL 76 -17.566 0.805 -4.229 605 HB VAL 76 HB VAL 76 -16.122 2.892 -3.819 606 HG11 VAL 76 HG11 VAL 76 -16.699 1.833 -1.163 607 HG12 VAL 76 HG12 VAL 76 -18.014 1.616 -2.319 608 HG13 VAL 76 HG13 VAL 76 -17.372 3.229 -2.006 609 HG21 VAL 76 HG21 VAL 76 -14.741 1.810 -1.576 610 HG22 VAL 76 HG22 VAL 76 -14.090 2.652 -2.981 611 HG23 VAL 76 HG23 VAL 76 -14.283 0.901 -3.017 612 H HIS 77 H HIS 77 -17.460 1.961 -6.120 613 HA HIS 77 HA HIS 77 -15.027 1.604 -7.736 614 HB2 HIS 77 HB3 HIS 77 -17.431 1.801 -9.358 615 HB3 HIS 77 HB2 HIS 77 -16.159 0.587 -9.392 616 HD1 HIS 77 HD1 HIS 77 -16.465 -1.406 -7.584 617 HD2 HIS 77 HD2 HIS 77 -19.811 0.930 -8.363 618 HE1 HIS 77 HE1 HIS 77 -18.425 -2.742 -6.750 619 HE2 HIS 77 HE2 HIS 77 -20.446 -1.345 -7.307 620 H ASP 78 H ASP 78 -14.964 3.809 -6.419 621 HA ASP 78 HA ASP 78 -15.177 5.830 -8.360 622 HB2 ASP 78 HB3 ASP 78 -17.433 5.529 -6.525 623 HB3 ASP 78 HB2 ASP 78 -16.712 7.134 -6.458 624 H VAL 79 H VAL 79 -13.948 7.645 -7.787 625 HA VAL 79 HA VAL 79 -12.073 7.215 -5.699 626 HB VAL 79 HB VAL 79 -11.653 9.814 -6.239 627 HG11 VAL 79 HG11 VAL 79 -10.438 7.421 -6.824 628 HG12 VAL 79 HG12 VAL 79 -9.769 9.023 -7.135 629 HG13 VAL 79 HG13 VAL 79 -10.634 8.165 -8.411 630 HG21 VAL 79 HG21 VAL 79 -12.715 8.792 -8.859 631 HG22 VAL 79 HG22 VAL 79 -12.172 10.421 -8.459 632 HG23 VAL 79 HG23 VAL 79 -13.671 9.799 -7.774 633 H ALA 80 H ALA 80 -14.628 9.604 -6.158 634 HA ALA 80 HA ALA 80 -14.413 10.725 -3.566 635 HB1 ALA 80 HB1 ALA 80 -16.874 11.451 -4.203 636 HB2 ALA 80 HB2 ALA 80 -16.367 10.905 -5.801 637 HB3 ALA 80 HB3 ALA 80 -15.468 12.180 -4.979 638 H ALA 81 H ALA 81 -16.016 7.920 -4.845 639 HA ALA 81 HA ALA 81 -18.024 7.554 -2.933 640 HB1 ALA 81 HB1 ALA 81 -17.616 5.056 -3.471 641 HB2 ALA 81 HB2 ALA 81 -16.461 5.667 -4.656 642 HB3 ALA 81 HB3 ALA 81 -18.160 6.128 -4.762 643 H VAL 82 H VAL 82 -14.976 5.706 -3.012 644 HA VAL 82 HA VAL 82 -15.027 4.710 -0.475 645 HB VAL 82 HB VAL 82 -13.335 4.272 -2.340 646 HG11 VAL 82 HG11 VAL 82 -12.662 6.805 -2.229 647 HG12 VAL 82 HG12 VAL 82 -11.476 5.563 -2.621 648 HG13 VAL 82 HG13 VAL 82 -11.551 6.226 -0.988 649 HG21 VAL 82 HG21 VAL 82 -11.772 3.333 -0.845 650 HG22 VAL 82 HG22 VAL 82 -13.320 3.316 -0.001 651 HG23 VAL 82 HG23 VAL 82 -12.114 4.543 0.391 652 H PHE 83 H PHE 83 -13.991 7.940 -1.483 653 HA PHE 83 HA PHE 83 -12.805 8.753 0.916 654 HB2 PHE 83 HB3 PHE 83 -13.998 10.125 -1.429 655 HB3 PHE 83 HB2 PHE 83 -13.847 11.083 0.040 656 HD1 PHE 83 HD2 PHE 83 -11.407 10.482 1.236 657 HD2 PHE 83 HD1 PHE 83 -12.315 10.524 -2.922 658 HE1 PHE 83 HE2 PHE 83 -9.035 10.891 0.726 659 HE2 PHE 83 HE1 PHE 83 -9.944 10.932 -3.439 660 HZ PHE 83 HZ PHE 83 -8.301 11.116 -1.614 661 H ALA 84 H ALA 84 -16.184 8.661 -0.064 662 HA ALA 84 HA ALA 84 -17.214 10.118 2.130 663 HB1 ALA 84 HB1 ALA 84 -18.675 9.859 0.305 664 HB2 ALA 84 HB2 ALA 84 -19.355 8.834 1.570 665 HB3 ALA 84 HB3 ALA 84 -18.433 8.112 0.250 666 H TYR 85 H TYR 85 -16.359 6.769 1.632 667 HA TYR 85 HA TYR 85 -17.530 5.719 3.975 668 HB2 TYR 85 HB3 TYR 85 -16.741 3.796 3.126 669 HB3 TYR 85 HB2 TYR 85 -15.945 4.718 1.860 670 HD1 TYR 85 HD1 TYR 85 -15.388 3.628 5.397 671 HD2 TYR 85 HD2 TYR 85 -13.668 4.485 1.606 672 HE1 TYR 85 HE1 TYR 85 -13.197 2.876 6.224 673 HE2 TYR 85 HE2 TYR 85 -11.476 3.738 2.418 674 HH TYR 85 HH TYR 85 -10.331 3.542 4.688 675 H ALA 86 H ALA 86 -14.118 6.584 3.359 676 HA ALA 86 HA ALA 86 -13.037 6.378 5.815 677 HB1 ALA 86 HB1 ALA 86 -12.593 8.473 3.718 678 HB2 ALA 86 HB2 ALA 86 -11.599 7.073 4.121 679 HB3 ALA 86 HB3 ALA 86 -11.658 8.455 5.214 680 H LYS 87 H LYS 87 -15.123 9.065 4.762 681 HA LYS 87 HA LYS 87 -14.811 10.645 7.085 682 HB2 LYS 87 HB3 LYS 87 -16.083 11.018 4.733 683 HB3 LYS 87 HB2 LYS 87 -17.462 10.627 5.751 684 HG2 LYS 87 HG3 LYS 87 -17.278 12.969 5.781 685 HG3 LYS 87 HG2 LYS 87 -16.641 12.418 7.332 686 HD2 LYS 87 HD3 LYS 87 -14.869 13.705 6.859 687 HD3 LYS 87 HD2 LYS 87 -14.407 12.418 5.743 688 HE2 LYS 87 HE3 LYS 87 -16.203 13.887 4.272 689 HE3 LYS 87 HE2 LYS 87 -15.357 15.124 5.201 690 HZ1 LYS 87 HZ1 LYS 87 -14.321 13.303 3.155 691 HZ2 LYS 87 HZ2 LYS 87 -13.279 13.767 4.403 692 HZ3 LYS 87 HZ3 LYS 87 -13.984 14.942 3.412 693 H GLN 88 H GLN 88 -17.144 8.186 6.174 694 HA GLN 88 HA GLN 88 -18.749 8.212 8.462 695 HB2 GLN 88 HB3 GLN 88 -18.839 6.845 6.147 696 HB3 GLN 88 HB2 GLN 88 -18.232 5.576 7.202 697 HG2 GLN 88 HG3 GLN 88 -20.579 5.362 7.160 698 HG3 GLN 88 HG2 GLN 88 -20.164 6.056 8.727 699 HE21 GLN 88 HE21 GLN 88 -20.643 7.389 5.470 700 HE22 GLN 88 HE22 GLN 88 -21.799 8.582 5.943 701 H HIS 89 H HIS 89 -15.531 7.141 8.049 702 HA HIS 89 HA HIS 89 -15.587 5.803 10.673 703 HB2 HIS 89 HB3 HIS 89 -14.208 5.155 8.124 704 HB3 HIS 89 HB2 HIS 89 -13.298 4.880 9.607 705 HD1 HIS 89 HD1 HIS 89 -15.400 3.720 11.440 706 HD2 HIS 89 HD2 HIS 89 -15.083 2.701 7.425 707 HE1 HIS 89 HE1 HIS 89 -16.502 1.469 11.230 708 HE2 HIS 89 HE2 HIS 89 -16.382 0.916 8.775 709 HA PRO 90 HA PRO 90 -13.035 9.659 11.063 710 HB2 PRO 90 HB3 PRO 90 -14.185 9.767 13.754 711 HB3 PRO 90 HB2 PRO 90 -14.239 10.972 12.465 712 HG2 PRO 90 HG3 PRO 90 -16.422 9.583 13.236 713 HG3 PRO 90 HG2 PRO 90 -16.173 10.113 11.562 714 HD2 PRO 90 HD3 PRO 90 -15.736 7.409 12.778 715 HD3 PRO 90 HD2 PRO 90 -16.456 7.838 11.212 716 H ASP 91 H ASP 91 -13.620 7.236 13.624 717 HA ASP 91 HA ASP 91 -11.139 7.709 14.925 718 HB2 ASP 91 HB3 ASP 91 -13.032 5.358 15.095 719 HB3 ASP 91 HB2 ASP 91 -11.673 5.637 16.181 720 H GLN 92 H GLN 92 -11.823 6.144 12.026 721 HA GLN 92 HA GLN 92 -9.506 4.359 12.286 722 HB2 GLN 92 HB3 GLN 92 -11.412 4.374 9.961 723 HB3 GLN 92 HB2 GLN 92 -10.362 3.077 10.513 724 HG2 GLN 92 HG3 GLN 92 -12.568 4.056 12.269 725 HG3 GLN 92 HG2 GLN 92 -12.913 2.951 10.939 726 HE21 GLN 92 HE21 GLN 92 -11.121 1.126 10.876 727 HE22 GLN 92 HE22 GLN 92 -10.911 0.308 12.383 728 H GLU 93 H GLU 93 -7.917 4.289 10.615 729 HA GLU 93 HA GLU 93 -7.624 6.860 9.210 730 HB2 GLU 93 HB3 GLU 93 -5.926 6.089 11.012 731 HB3 GLU 93 HB2 GLU 93 -5.351 4.980 9.776 732 HG2 GLU 93 HG3 GLU 93 -4.179 6.580 8.799 733 HG3 GLU 93 HG2 GLU 93 -5.598 7.620 8.685 734 H LEU 94 H LEU 94 -6.536 6.801 7.111 735 HA LEU 94 HA LEU 94 -7.339 4.421 5.604 736 HB2 LEU 94 HB3 LEU 94 -7.000 7.307 4.949 737 HB3 LEU 94 HB2 LEU 94 -6.776 6.134 3.669 738 HG LEU 94 HG LEU 94 -9.113 5.244 4.489 739 HD11 LEU 94 HD11 LEU 94 -9.713 8.077 5.033 740 HD12 LEU 94 HD12 LEU 94 -8.860 7.208 6.309 741 HD13 LEU 94 HD13 LEU 94 -10.412 6.611 5.722 742 HD21 LEU 94 HD21 LEU 94 -10.026 6.258 2.657 743 HD22 LEU 94 HD22 LEU 94 -8.314 6.508 2.316 744 HD23 LEU 94 HD23 LEU 94 -9.275 7.816 3.005 745 H VAL 95 H VAL 95 -5.889 3.100 4.711 746 HA VAL 95 HA VAL 95 -3.148 4.055 4.284 747 HB VAL 95 HB VAL 95 -3.752 1.387 5.559 748 HG11 VAL 95 HG11 VAL 95 -1.086 2.622 5.754 749 HG12 VAL 95 HG12 VAL 95 -1.570 2.099 4.140 750 HG13 VAL 95 HG13 VAL 95 -1.545 0.943 5.471 751 HG21 VAL 95 HG21 VAL 95 -4.335 3.169 7.110 752 HG22 VAL 95 HG22 VAL 95 -2.763 3.927 6.854 753 HG23 VAL 95 HG23 VAL 95 -2.864 2.349 7.635 754 H ILE 96 H ILE 96 -2.822 3.835 2.170 755 HA ILE 96 HA ILE 96 -4.183 1.780 0.647 756 HB ILE 96 HB ILE 96 -2.120 3.720 -0.385 757 HG12 ILE 96 HG13 ILE 96 -3.820 5.035 0.725 758 HG13 ILE 96 HG12 ILE 96 -4.053 5.161 -1.016 759 HG21 ILE 96 HG21 ILE 96 -3.199 3.372 -2.519 760 HG22 ILE 96 HG22 ILE 96 -4.406 2.328 -1.770 761 HG23 ILE 96 HG23 ILE 96 -2.719 1.820 -1.834 762 HD11 ILE 96 HD11 ILE 96 -5.865 3.541 -0.896 763 HD12 ILE 96 HD12 ILE 96 -6.167 4.923 0.158 764 HD13 ILE 96 HD13 ILE 96 -5.622 3.392 0.844 765 H ALA 97 H ALA 97 -3.326 -0.088 -0.060 766 HA ALA 97 HA ALA 97 -0.462 -0.550 0.463 767 HB1 ALA 97 HB1 ALA 97 -1.852 -1.898 1.908 768 HB2 ALA 97 HB2 ALA 97 -1.039 -2.931 0.733 769 HB3 ALA 97 HB3 ALA 97 -2.741 -2.523 0.520 770 H GLY 98 H GLY 98 -3.064 -0.858 -1.855 771 HA2 GLY 98 HA3 GLY 98 -1.366 -0.871 -4.081 772 HA3 GLY 98 HA2 GLY 98 -1.777 -2.540 -3.715 773 H GLY 99 H GLY 99 -4.241 -1.472 -6.192 774 HA2 GLY 99 HA3 GLY 99 -1.472 -2.240 -5.788 775 HA3 GLY 99 HA2 GLY 99 -2.372 -2.306 -7.292 776 H ALA 100 H ALA 100 -0.518 -1.415 -8.333 777 HA ALA 100 HA ALA 100 0.641 1.054 -7.667 778 HB1 ALA 100 HB1 ALA 100 1.667 0.993 -9.835 779 HB2 ALA 100 HB2 ALA 100 0.476 -0.171 -10.416 780 HB3 ALA 100 HB3 ALA 100 1.643 -0.644 -9.180 781 H GLN 101 H GLN 101 -2.228 0.247 -9.502 782 HA GLN 101 HA GLN 101 -2.523 2.855 -10.659 783 HB2 GLN 101 HB3 GLN 101 -3.792 0.304 -10.910 784 HB3 GLN 101 HB2 GLN 101 -5.027 1.514 -10.591 785 HG2 GLN 101 HG3 GLN 101 -2.953 1.755 -12.755 786 HG3 GLN 101 HG2 GLN 101 -4.572 1.101 -12.998 787 HE21 GLN 101 HE21 GLN 101 -6.338 2.602 -12.103 788 HE22 GLN 101 HE22 GLN 101 -6.178 4.271 -12.522 789 H ILE 102 H ILE 102 -3.653 1.225 -7.770 790 HA ILE 102 HA ILE 102 -5.632 3.116 -7.041 791 HB ILE 102 HB ILE 102 -4.030 1.308 -5.223 792 HG12 ILE 102 HG13 ILE 102 -5.185 0.078 -7.027 793 HG13 ILE 102 HG12 ILE 102 -5.876 -0.272 -5.446 794 HG21 ILE 102 HG21 ILE 102 -6.774 1.940 -4.476 795 HG22 ILE 102 HG22 ILE 102 -5.727 3.357 -4.527 796 HG23 ILE 102 HG23 ILE 102 -5.298 1.980 -3.512 797 HD11 ILE 102 HD11 ILE 102 -7.208 0.571 -7.754 798 HD12 ILE 102 HD12 ILE 102 -7.251 1.936 -6.639 799 HD13 ILE 102 HD13 ILE 102 -7.875 0.366 -6.135 800 H PHE 103 H PHE 103 -2.172 2.909 -6.543 801 HA PHE 103 HA PHE 103 -2.020 5.022 -4.628 802 HB2 PHE 103 HB3 PHE 103 0.031 3.660 -6.372 803 HB3 PHE 103 HB2 PHE 103 0.448 4.988 -5.294 804 HD1 PHE 103 HD2 PHE 103 -0.594 4.623 -2.819 805 HD2 PHE 103 HD1 PHE 103 0.454 1.560 -5.580 806 HE1 PHE 103 HE2 PHE 103 -0.342 3.036 -0.956 807 HE2 PHE 103 HE1 PHE 103 0.706 -0.033 -3.723 808 HZ PHE 103 HZ PHE 103 0.309 0.704 -1.407 809 H THR 104 H THR 104 -1.859 4.795 -8.121 810 HA THR 104 HA THR 104 -0.819 7.312 -8.717 811 HB THR 104 HB THR 104 -2.850 5.705 -10.277 812 HG1 THR 104 HG1 THR 104 -0.887 4.598 -9.853 813 HG21 THR 104 HG21 THR 104 -2.701 7.123 -11.972 814 HG22 THR 104 HG22 THR 104 -0.950 7.263 -11.806 815 HG23 THR 104 HG23 THR 104 -2.013 8.269 -10.821 816 H ALA 105 H ALA 105 -4.254 6.333 -8.513 817 HA ALA 105 HA ALA 105 -5.350 8.854 -8.985 818 HB1 ALA 105 HB1 ALA 105 -6.315 6.357 -7.709 819 HB2 ALA 105 HB2 ALA 105 -6.971 7.258 -9.076 820 HB3 ALA 105 HB3 ALA 105 -7.245 7.829 -7.429 821 H PHE 106 H PHE 106 -4.896 7.292 -5.784 822 HA PHE 106 HA PHE 106 -5.511 9.636 -4.357 823 HB2 PHE 106 HB3 PHE 106 -4.069 7.102 -3.575 824 HB3 PHE 106 HB2 PHE 106 -4.452 8.384 -2.432 825 HD1 PHE 106 HD2 PHE 106 -6.060 6.096 -4.896 826 HD2 PHE 106 HD1 PHE 106 -6.479 8.369 -1.322 827 HE1 PHE 106 HE2 PHE 106 -8.281 5.099 -4.528 828 HE2 PHE 106 HE1 PHE 106 -8.698 7.374 -0.949 829 HZ PHE 106 HZ PHE 106 -9.597 5.736 -2.554 830 H LYS 107 H LYS 107 -2.712 8.766 -6.095 831 HA LYS 107 HA LYS 107 -0.576 9.666 -4.668 832 HB2 LYS 107 HB3 LYS 107 0.567 9.847 -6.652 833 HB3 LYS 107 HB2 LYS 107 -0.803 8.878 -7.170 834 HG2 LYS 107 HG3 LYS 107 -1.890 11.082 -7.851 835 HG3 LYS 107 HG2 LYS 107 -0.289 11.794 -7.650 836 HD2 LYS 107 HD3 LYS 107 -0.197 9.349 -9.207 837 HD3 LYS 107 HD2 LYS 107 -1.282 10.542 -9.924 838 HE2 LYS 107 HE3 LYS 107 1.111 11.845 -9.052 839 HE3 LYS 107 HE2 LYS 107 1.537 10.450 -10.041 840 HZ1 LYS 107 HZ1 LYS 107 0.031 12.858 -10.779 841 HZ2 LYS 107 HZ2 LYS 107 -0.301 11.412 -11.590 842 HZ3 LYS 107 HZ3 LYS 107 1.262 12.059 -11.623 843 H ASP 108 H ASP 108 -2.972 11.665 -6.317 844 HA ASP 108 HA ASP 108 -1.655 14.114 -5.484 845 HB2 ASP 108 HB3 ASP 108 -3.154 13.529 -7.664 846 HB3 ASP 108 HB2 ASP 108 -4.384 14.239 -6.622 847 H ASP 109 H ASP 109 -4.471 12.183 -4.659 848 HA ASP 109 HA ASP 109 -5.413 14.138 -2.729 849 HB2 ASP 109 HB3 ASP 109 -6.670 12.206 -4.228 850 HB3 ASP 109 HB2 ASP 109 -6.625 11.471 -2.628 851 H VAL 110 H VAL 110 -2.854 12.229 -2.580 852 HA VAL 110 HA VAL 110 -3.332 10.937 -0.033 853 HB VAL 110 HB VAL 110 -1.946 9.842 -1.747 854 HG11 VAL 110 HG11 VAL 110 0.406 11.524 -1.229 855 HG12 VAL 110 HG12 VAL 110 -0.858 12.277 -2.202 856 HG13 VAL 110 HG13 VAL 110 -0.136 10.753 -2.720 857 HG21 VAL 110 HG21 VAL 110 -1.650 9.568 0.799 858 HG22 VAL 110 HG22 VAL 110 -0.149 10.464 0.567 859 HG23 VAL 110 HG23 VAL 110 -0.399 8.931 -0.268 860 H ASP 111 H ASP 111 -1.905 11.266 1.814 861 HA ASP 111 HA ASP 111 -0.878 14.017 2.012 862 HB2 ASP 111 HB3 ASP 111 -2.872 12.625 3.692 863 HB3 ASP 111 HB2 ASP 111 -1.647 13.541 4.564 864 H THR 112 H THR 112 -0.679 10.684 3.169 865 HA THR 112 HA THR 112 1.996 11.293 4.234 866 HB THR 112 HB THR 112 0.105 9.089 5.069 867 HG1 THR 112 HG1 THR 112 -0.418 11.234 5.798 868 HG21 THR 112 HG21 THR 112 1.716 8.860 6.992 869 HG22 THR 112 HG22 THR 112 2.864 9.790 6.028 870 HG23 THR 112 HG23 THR 112 2.269 8.239 5.438 871 H LEU 113 H LEU 113 3.614 9.598 4.028 872 HA LEU 113 HA LEU 113 3.117 7.659 1.901 873 HB2 LEU 113 HB3 LEU 113 4.509 10.069 1.505 874 HB3 LEU 113 HB2 LEU 113 5.731 8.815 1.566 875 HG LEU 113 HG LEU 113 4.751 7.658 -0.284 876 HD11 LEU 113 HD11 LEU 113 2.727 8.753 -1.420 877 HD12 LEU 113 HD12 LEU 113 2.460 9.547 0.132 878 HD13 LEU 113 HD13 LEU 113 2.442 7.787 0.028 879 HD21 LEU 113 HD21 LEU 113 4.530 9.789 -1.890 880 HD22 LEU 113 HD22 LEU 113 6.076 9.191 -1.287 881 HD23 LEU 113 HD23 LEU 113 5.286 10.552 -0.491 882 H LEU 114 H LEU 114 3.966 5.746 2.324 883 HA LEU 114 HA LEU 114 6.267 5.527 4.129 884 HB2 LEU 114 HB3 LEU 114 3.740 3.883 4.348 885 HB3 LEU 114 HB2 LEU 114 5.200 3.635 5.287 886 HG LEU 114 HG LEU 114 3.858 6.297 5.417 887 HD11 LEU 114 HD11 LEU 114 2.920 3.807 6.829 888 HD12 LEU 114 HD12 LEU 114 1.996 4.817 5.718 889 HD13 LEU 114 HD13 LEU 114 2.472 5.447 7.295 890 HD21 LEU 114 HD21 LEU 114 5.929 6.128 6.558 891 HD22 LEU 114 HD22 LEU 114 5.480 4.585 7.285 892 HD23 LEU 114 HD23 LEU 114 4.667 6.067 7.789 893 H VAL 115 H VAL 115 7.810 4.415 3.099 894 HA VAL 115 HA VAL 115 7.000 2.164 1.398 895 HB VAL 115 HB VAL 115 8.595 2.805 -0.331 896 HG11 VAL 115 HG11 VAL 115 7.271 4.425 -1.374 897 HG12 VAL 115 HG12 VAL 115 6.838 5.185 0.158 898 HG13 VAL 115 HG13 VAL 115 6.167 3.609 -0.267 899 HG21 VAL 115 HG21 VAL 115 10.238 4.034 0.853 900 HG22 VAL 115 HG22 VAL 115 9.050 5.209 1.420 901 HG23 VAL 115 HG23 VAL 115 9.496 5.158 -0.286 902 H THR 116 H THR 116 8.548 0.556 1.069 903 HA THR 116 HA THR 116 10.791 0.593 2.980 904 HB THR 116 HB THR 116 9.063 -1.694 2.020 905 HG1 THR 116 HG1 THR 116 8.538 -1.863 4.170 906 HG21 THR 116 HG21 THR 116 11.195 -2.672 2.076 907 HG22 THR 116 HG22 THR 116 10.430 -3.088 3.609 908 HG23 THR 116 HG23 THR 116 11.641 -1.808 3.548 909 H ARG 117 H ARG 117 12.443 1.260 1.693 910 HA ARG 117 HA ARG 117 12.745 0.291 -0.996 911 HB2 ARG 117 HB3 ARG 117 13.537 2.559 0.246 912 HB3 ARG 117 HB2 ARG 117 15.030 1.634 0.319 913 HG2 ARG 117 HG3 ARG 117 13.777 1.549 -2.304 914 HG3 ARG 117 HG2 ARG 117 14.184 3.185 -1.783 915 HD2 ARG 117 HD3 ARG 117 16.153 0.926 -1.595 916 HD3 ARG 117 HD2 ARG 117 15.956 1.862 -3.074 917 HE ARG 117 HE ARG 117 16.799 3.760 -1.963 918 HH11 ARG 117 HH11 ARG 117 16.832 0.913 0.070 919 HH12 ARG 117 HH12 ARG 117 17.953 1.589 1.200 920 HH21 ARG 117 HH21 ARG 117 18.269 4.638 -0.472 921 HH22 ARG 117 HH22 ARG 117 18.768 3.699 0.896 922 H LEU 118 H LEU 118 13.315 -1.760 -1.284 923 HA LEU 118 HA LEU 118 14.934 -3.229 0.546 924 HB2 LEU 118 HB3 LEU 118 13.406 -3.748 -1.859 925 HB3 LEU 118 HB2 LEU 118 14.947 -4.582 -1.905 926 HG LEU 118 HG LEU 118 14.355 -5.483 0.410 927 HD11 LEU 118 HD11 LEU 118 11.509 -5.278 -0.146 928 HD12 LEU 118 HD12 LEU 118 12.253 -3.717 0.198 929 HD13 LEU 118 HD13 LEU 118 12.390 -5.035 1.361 930 HD21 LEU 118 HD21 LEU 118 13.670 -7.375 -0.588 931 HD22 LEU 118 HD22 LEU 118 13.990 -6.483 -2.075 932 HD23 LEU 118 HD23 LEU 118 12.348 -6.574 -1.437 933 H ALA 119 H ALA 119 17.020 -4.146 0.126 934 HA ALA 119 HA ALA 119 18.818 -2.275 -1.120 935 HB1 ALA 119 HB1 ALA 119 20.108 -3.068 0.509 936 HB2 ALA 119 HB2 ALA 119 20.272 -4.555 -0.426 937 HB3 ALA 119 HB3 ALA 119 19.010 -4.417 0.798 938 H GLY 120 H GLY 120 17.794 -5.618 -1.698 939 HA2 GLY 120 HA3 GLY 120 19.488 -6.060 -3.926 940 HA3 GLY 120 HA2 GLY 120 18.062 -6.998 -3.513 941 H SER 121 H SER 121 19.084 -6.047 -6.113 942 HA SER 121 HA SER 121 16.937 -4.234 -6.949 943 HB2 SER 121 HB3 SER 121 19.376 -5.177 -8.479 944 HB3 SER 121 HB2 SER 121 18.214 -3.969 -9.029 945 HG SER 121 HG SER 121 20.282 -3.283 -7.919 946 H PHE 122 H PHE 122 15.128 -5.188 -7.589 947 HA PHE 122 HA PHE 122 15.305 -7.783 -8.964 948 HB2 PHE 122 HB3 PHE 122 12.968 -6.562 -7.481 949 HB3 PHE 122 HB2 PHE 122 12.970 -8.138 -8.267 950 HD1 PHE 122 HD2 PHE 122 14.855 -6.206 -5.697 951 HD2 PHE 122 HD1 PHE 122 13.451 -10.003 -7.008 952 HE1 PHE 122 HE2 PHE 122 15.704 -7.229 -3.627 953 HE2 PHE 122 HE1 PHE 122 14.297 -11.034 -4.940 954 HZ PHE 122 HZ PHE 122 15.427 -9.647 -3.247 955 H GLU 123 H GLU 123 13.596 -8.181 -10.607 956 HA GLU 123 HA GLU 123 12.781 -5.735 -12.014 957 HB2 GLU 123 HB3 GLU 123 13.461 -6.665 -14.152 958 HB3 GLU 123 HB2 GLU 123 14.842 -6.592 -13.066 959 HG2 GLU 123 HG3 GLU 123 13.792 -9.113 -12.638 960 HG3 GLU 123 HG2 GLU 123 13.624 -8.867 -14.375 961 H GLY 124 H GLY 124 10.768 -5.787 -12.864 962 HA2 GLY 124 HA3 GLY 124 9.423 -8.313 -13.341 963 HA3 GLY 124 HA2 GLY 124 8.773 -7.367 -12.011 964 H ASP 125 H ASP 125 6.849 -6.721 -12.803 965 HA ASP 125 HA ASP 125 6.917 -4.926 -15.115 966 HB2 ASP 125 HB3 ASP 125 6.010 -7.452 -15.450 967 HB3 ASP 125 HB2 ASP 125 4.524 -6.659 -14.934 968 H THR 126 H THR 126 6.737 -4.527 -12.212 969 HA THR 126 HA THR 126 4.327 -2.880 -12.226 970 HB THR 126 HB THR 126 4.938 -4.549 -9.800 971 HG1 THR 126 HG1 THR 126 3.339 -5.998 -10.560 972 HG21 THR 126 HG21 THR 126 2.485 -3.122 -10.781 973 HG22 THR 126 HG22 THR 126 3.427 -2.790 -9.327 974 HG23 THR 126 HG23 THR 126 2.481 -4.273 -9.446 975 H LYS 127 H LYS 127 5.266 -0.940 -12.067 976 HA LYS 127 HA LYS 127 7.236 -0.532 -9.912 977 HB2 LYS 127 HB3 LYS 127 8.150 -0.266 -12.216 978 HB3 LYS 127 HB2 LYS 127 6.999 1.035 -12.486 979 HG2 LYS 127 HG3 LYS 127 8.026 2.326 -10.687 980 HG3 LYS 127 HG2 LYS 127 9.176 1.018 -10.405 981 HD2 LYS 127 HD3 LYS 127 8.902 2.340 -13.089 982 HD3 LYS 127 HD2 LYS 127 9.956 2.993 -11.832 983 HE2 LYS 127 HE3 LYS 127 11.525 1.625 -12.633 984 HE3 LYS 127 HE2 LYS 127 10.612 0.316 -11.884 985 HZ1 LYS 127 HZ1 LYS 127 10.615 1.184 -14.703 986 HZ2 LYS 127 HZ2 LYS 127 9.311 0.311 -14.073 987 HZ3 LYS 127 HZ3 LYS 127 10.861 -0.365 -14.068 988 H MET 128 H MET 128 7.249 1.652 -8.973 989 HA MET 128 HA MET 128 4.581 2.474 -8.312 990 HB2 MET 128 HB3 MET 128 6.468 2.431 -6.679 991 HB3 MET 128 HB2 MET 128 7.200 3.773 -7.548 992 HG2 MET 128 HG3 MET 128 6.066 4.622 -5.627 993 HG3 MET 128 HG2 MET 128 5.190 5.127 -7.069 994 HE1 MET 128 HE1 MET 128 2.592 4.662 -4.174 995 HE2 MET 128 HE2 MET 128 2.565 5.491 -5.730 996 HE3 MET 128 HE3 MET 128 3.963 5.654 -4.669 997 H ILE 129 H ILE 129 3.813 4.690 -8.453 998 HA ILE 129 HA ILE 129 4.468 5.858 -11.043 999 HB ILE 129 HB ILE 129 2.456 7.239 -10.713 1000 HG12 ILE 129 HG13 ILE 129 1.042 6.159 -8.655 1001 HG13 ILE 129 HG12 ILE 129 2.670 6.122 -7.986 1002 HG21 ILE 129 HG21 ILE 129 1.243 5.596 -11.592 1003 HG22 ILE 129 HG22 ILE 129 1.246 4.690 -10.079 1004 HG23 ILE 129 HG23 ILE 129 2.583 4.512 -11.216 1005 HD11 ILE 129 HD11 ILE 129 2.858 8.405 -7.971 1006 HD12 ILE 129 HD12 ILE 129 1.147 8.184 -7.610 1007 HD13 ILE 129 HD13 ILE 129 1.656 8.622 -9.241 1008 HA PRO 130 HA PRO 130 6.835 9.287 -9.611 1009 HB2 PRO 130 HB3 PRO 130 5.668 11.361 -11.022 1010 HB3 PRO 130 HB2 PRO 130 6.886 10.258 -11.669 1011 HG2 PRO 130 HG3 PRO 130 3.913 10.190 -11.973 1012 HG3 PRO 130 HG2 PRO 130 5.172 9.854 -13.176 1013 HD2 PRO 130 HD3 PRO 130 3.832 7.872 -11.975 1014 HD3 PRO 130 HD2 PRO 130 5.562 7.717 -12.351 1015 H LEU 131 H LEU 131 6.799 11.026 -8.172 1016 HA LEU 131 HA LEU 131 4.208 11.993 -7.231 1017 HB2 LEU 131 HB3 LEU 131 6.073 11.313 -5.055 1018 HB3 LEU 131 HB2 LEU 131 4.327 11.188 -5.119 1019 HG LEU 131 HG LEU 131 5.853 9.219 -6.734 1020 HD11 LEU 131 HD11 LEU 131 6.114 9.502 -3.804 1021 HD12 LEU 131 HD12 LEU 131 7.221 8.796 -4.982 1022 HD13 LEU 131 HD13 LEU 131 5.820 7.879 -4.428 1023 HD21 LEU 131 HD21 LEU 131 3.636 8.645 -4.821 1024 HD22 LEU 131 HD22 LEU 131 4.023 7.872 -6.358 1025 HD23 LEU 131 HD23 LEU 131 3.285 9.474 -6.338 1026 H ASN 132 H ASN 132 4.317 13.942 -6.012 1027 HA ASN 132 HA ASN 132 6.554 15.618 -6.748 1028 HB2 ASN 132 HB3 ASN 132 3.923 16.152 -6.476 1029 HB3 ASN 132 HB2 ASN 132 4.485 16.639 -4.880 1030 HD21 ASN 132 HD21 ASN 132 6.890 17.726 -5.338 1031 HD22 ASN 132 HD22 ASN 132 6.755 19.107 -6.368 1032 H TRP 133 H TRP 133 8.151 14.450 -5.529 1033 HA TRP 133 HA TRP 133 8.110 14.006 -2.797 1034 HB2 TRP 133 HB3 TRP 133 10.469 14.558 -4.599 1035 HB3 TRP 133 HB2 TRP 133 10.588 13.913 -2.964 1036 HD1 TRP 133 HD1 TRP 133 9.319 12.941 -6.465 1037 HE1 TRP 133 HE1 TRP 133 9.157 10.375 -6.588 1038 HE3 TRP 133 HE3 TRP 133 10.373 11.827 -1.588 1039 HZ2 TRP 133 HZ2 TRP 133 9.443 8.171 -4.849 1040 HZ3 TRP 133 HZ3 TRP 133 10.408 9.466 -0.899 1041 HH2 TRP 133 HH2 TRP 133 9.951 7.677 -2.497 1042 H ASP 134 H ASP 134 9.122 16.960 -4.534 1043 HA ASP 134 HA ASP 134 10.276 18.296 -2.392 1044 HB2 ASP 134 HB3 ASP 134 9.351 18.949 -5.035 1045 HB3 ASP 134 HB2 ASP 134 8.866 20.220 -3.917 1046 H ASP 135 H ASP 135 6.885 18.094 -3.374 1047 HA ASP 135 HA ASP 135 5.941 19.870 -1.357 1048 HB2 ASP 135 HB3 ASP 135 4.808 18.306 -3.527 1049 HB3 ASP 135 HB2 ASP 135 3.788 18.262 -2.092 1050 H PHE 136 H PHE 136 7.282 16.897 -0.996 1051 HA PHE 136 HA PHE 136 5.658 16.333 1.395 1052 HB2 PHE 136 HB3 PHE 136 6.908 14.414 -0.568 1053 HB3 PHE 136 HB2 PHE 136 6.408 13.917 1.046 1054 HD1 PHE 136 HD1 PHE 136 3.929 14.670 1.661 1055 HD2 PHE 136 HD2 PHE 136 5.424 14.099 -2.281 1056 HE1 PHE 136 HE1 PHE 136 1.635 14.323 0.847 1057 HE2 PHE 136 HE2 PHE 136 3.132 13.750 -3.104 1058 HZ PHE 136 HZ PHE 136 1.233 13.862 -1.540 1059 H THR 137 H THR 137 6.707 16.176 3.260 1060 HA THR 137 HA THR 137 9.654 16.269 3.192 1061 HB THR 137 HB THR 137 7.693 17.444 5.168 1062 HG1 THR 137 HG1 THR 137 9.689 18.681 3.583 1063 HG21 THR 137 HG21 THR 137 9.577 18.360 6.382 1064 HG22 THR 137 HG22 THR 137 10.697 17.489 5.334 1065 HG23 THR 137 HG23 THR 137 9.617 16.597 6.406 1066 H LYS 138 H LYS 138 10.773 14.717 4.175 1067 HA LYS 138 HA LYS 138 9.545 12.377 5.098 1068 HB2 LYS 138 HB3 LYS 138 11.854 12.510 4.192 1069 HB3 LYS 138 HB2 LYS 138 12.357 13.304 5.679 1070 HG2 LYS 138 HG3 LYS 138 12.452 11.386 6.808 1071 HG3 LYS 138 HG2 LYS 138 10.938 10.796 6.124 1072 HD2 LYS 138 HD3 LYS 138 12.801 9.363 5.478 1073 HD3 LYS 138 HD2 LYS 138 12.109 10.171 4.071 1074 HE2 LYS 138 HE3 LYS 138 13.980 11.366 3.674 1075 HE3 LYS 138 HE2 LYS 138 14.314 11.605 5.389 1076 HZ1 LYS 138 HZ1 LYS 138 15.997 10.200 4.898 1077 HZ2 LYS 138 HZ2 LYS 138 15.185 9.469 3.607 1078 HZ3 LYS 138 HZ3 LYS 138 14.818 9.024 5.197 1079 H VAL 139 H VAL 139 8.530 11.997 6.921 1080 HA VAL 139 HA VAL 139 8.980 13.759 9.205 1081 HB VAL 139 HB VAL 139 7.039 12.078 10.089 1082 HG11 VAL 139 HG11 VAL 139 7.049 14.704 8.720 1083 HG12 VAL 139 HG12 VAL 139 6.535 14.274 10.351 1084 HG13 VAL 139 HG13 VAL 139 5.486 13.928 8.976 1085 HG21 VAL 139 HG21 VAL 139 6.358 12.440 7.183 1086 HG22 VAL 139 HG22 VAL 139 5.509 11.487 8.399 1087 HG23 VAL 139 HG23 VAL 139 7.082 10.958 7.804 1088 H SER 140 H SER 140 9.432 10.446 8.181 1089 HA SER 140 HA SER 140 11.103 10.009 10.531 1090 HB2 SER 140 HB3 SER 140 8.480 8.930 10.348 1091 HB3 SER 140 HB2 SER 140 9.614 7.596 10.141 1092 HG SER 140 HG SER 140 10.571 8.151 12.095 1093 H SER 141 H SER 141 12.642 8.338 10.279 1094 HA SER 141 HA SER 141 12.765 6.881 7.786 1095 HB2 SER 141 HB3 SER 141 14.810 7.807 6.974 1096 HB3 SER 141 HB2 SER 141 13.746 9.172 7.311 1097 HG SER 141 HG SER 141 14.972 9.747 8.970 1098 H ARG 142 H ARG 142 13.520 4.923 8.215 1099 HA ARG 142 HA ARG 142 15.624 4.576 10.212 1100 HB2 ARG 142 HB3 ARG 142 13.387 4.269 11.328 1101 HB3 ARG 142 HB2 ARG 142 13.110 2.902 10.258 1102 HG2 ARG 142 HG3 ARG 142 13.873 2.011 12.302 1103 HG3 ARG 142 HG2 ARG 142 15.226 1.895 11.176 1104 HD2 ARG 142 HD3 ARG 142 15.294 4.421 12.540 1105 HD3 ARG 142 HD2 ARG 142 15.190 3.107 13.711 1106 HE ARG 142 HE ARG 142 17.142 2.512 11.760 1107 HH11 ARG 142 HH11 ARG 142 16.593 4.584 14.515 1108 HH12 ARG 142 HH12 ARG 142 18.273 4.709 14.913 1109 HH21 ARG 142 HH21 ARG 142 19.352 2.675 12.283 1110 HH22 ARG 142 HH22 ARG 142 19.840 3.626 13.646 1111 H THR 143 H THR 143 16.990 2.881 9.801 1112 HA THR 143 HA THR 143 16.492 1.429 7.291 1113 HB THR 143 HB THR 143 19.210 1.593 8.517 1114 HG1 THR 143 HG1 THR 143 18.965 3.697 8.505 1115 HG21 THR 143 HG21 THR 143 18.618 2.019 5.639 1116 HG22 THR 143 HG22 THR 143 18.494 0.390 6.303 1117 HG23 THR 143 HG23 THR 143 20.017 1.272 6.410 1118 H VAL 144 H VAL 144 15.807 -0.573 7.610 1119 HA VAL 144 HA VAL 144 16.725 -2.048 9.977 1120 HB VAL 144 HB VAL 144 14.492 -2.809 8.093 1121 HG11 VAL 144 HG11 VAL 144 14.834 -3.707 10.931 1122 HG12 VAL 144 HG12 VAL 144 15.664 -4.530 9.611 1123 HG13 VAL 144 HG13 VAL 144 13.903 -4.452 9.632 1124 HG21 VAL 144 HG21 VAL 144 14.403 -1.250 10.671 1125 HG22 VAL 144 HG22 VAL 144 12.990 -1.987 9.916 1126 HG23 VAL 144 HG23 VAL 144 13.878 -0.717 9.074 1127 H GLU 145 H GLU 145 18.141 -3.664 9.781 1128 HA GLU 145 HA GLU 145 18.576 -4.813 7.103 1129 HB2 GLU 145 HB3 GLU 145 20.972 -5.202 7.992 1130 HB3 GLU 145 HB2 GLU 145 20.525 -3.589 7.455 1131 HG2 GLU 145 HG3 GLU 145 20.533 -2.727 9.573 1132 HG3 GLU 145 HG2 GLU 145 20.192 -4.285 10.326 1133 H ASP 146 H ASP 146 18.961 -6.998 6.949 1134 HA ASP 146 HA ASP 146 18.413 -8.556 9.390 1135 HB2 ASP 146 HB3 ASP 146 17.680 -9.056 6.505 1136 HB3 ASP 146 HB2 ASP 146 17.615 -10.326 7.723 1137 H THR 147 H THR 147 19.115 -11.052 8.628 1138 HA THR 147 HA THR 147 21.895 -11.080 8.916 1139 HB THR 147 HB THR 147 21.484 -13.540 7.951 1140 HG1 THR 147 HG1 THR 147 19.423 -14.146 8.009 1141 HG21 THR 147 HG21 THR 147 21.221 -14.320 10.093 1142 HG22 THR 147 HG22 THR 147 20.186 -12.975 10.571 1143 HG23 THR 147 HG23 THR 147 21.921 -12.726 10.374 1144 H ASN 148 H ASN 148 19.860 -11.424 6.051 1145 HA ASN 148 HA ASN 148 22.165 -11.711 4.316 1146 HB2 ASN 148 HB3 ASN 148 19.197 -11.801 3.930 1147 HB3 ASN 148 HB2 ASN 148 20.240 -11.542 2.536 1148 HD21 ASN 148 HD21 ASN 148 18.699 -13.821 4.320 1149 HD22 ASN 148 HD22 ASN 148 19.639 -15.207 3.896 1150 HA PRO 149 HA PRO 149 22.663 -7.352 3.606 1151 HB2 PRO 149 HB3 PRO 149 23.710 -8.093 0.949 1152 HB3 PRO 149 HB2 PRO 149 24.512 -7.250 2.277 1153 HG2 PRO 149 HG3 PRO 149 25.147 -9.773 1.634 1154 HG3 PRO 149 HG2 PRO 149 25.147 -9.209 3.313 1155 HD2 PRO 149 HD3 PRO 149 23.105 -10.848 1.869 1156 HD3 PRO 149 HD2 PRO 149 23.719 -11.013 3.528 1157 H ALA 150 H ALA 150 21.111 -9.457 1.298 1158 HA ALA 150 HA ALA 150 20.003 -7.315 -0.278 1159 HB1 ALA 150 HB1 ALA 150 20.316 -9.192 -1.570 1160 HB2 ALA 150 HB2 ALA 150 18.600 -9.321 -1.183 1161 HB3 ALA 150 HB3 ALA 150 19.779 -10.289 -0.298 1162 H LEU 151 H LEU 151 19.101 -9.020 2.579 1163 HA LEU 151 HA LEU 151 16.287 -8.380 2.330 1164 HB2 LEU 151 HB3 LEU 151 17.914 -9.727 4.471 1165 HB3 LEU 151 HB2 LEU 151 16.219 -9.340 4.689 1166 HG LEU 151 HG LEU 151 17.439 -11.301 2.761 1167 HD11 LEU 151 HD11 LEU 151 15.592 -12.711 3.867 1168 HD12 LEU 151 HD12 LEU 151 15.570 -11.444 5.094 1169 HD13 LEU 151 HD13 LEU 151 17.050 -12.355 4.793 1170 HD21 LEU 151 HD21 LEU 151 15.120 -11.649 1.917 1171 HD22 LEU 151 HD22 LEU 151 15.828 -10.101 1.457 1172 HD23 LEU 151 HD23 LEU 151 14.643 -10.176 2.761 1173 H THR 152 H THR 152 18.765 -6.440 2.871 1174 HA THR 152 HA THR 152 17.859 -5.101 5.265 1175 HB THR 152 HB THR 152 19.889 -4.161 3.232 1176 HG1 THR 152 HG1 THR 152 21.403 -5.079 4.695 1177 HG21 THR 152 HG21 THR 152 19.521 -2.316 4.558 1178 HG22 THR 152 HG22 THR 152 20.849 -3.121 5.394 1179 HG23 THR 152 HG23 THR 152 19.200 -3.283 5.998 1180 H HIS 153 H HIS 153 16.249 -3.682 5.315 1181 HA HIS 153 HA HIS 153 15.671 -2.123 2.883 1182 HB2 HIS 153 HB3 HIS 153 13.389 -2.674 4.679 1183 HB3 HIS 153 HB2 HIS 153 13.452 -2.614 2.922 1184 HD1 HIS 153 HD1 HIS 153 12.639 -4.901 5.395 1185 HD2 HIS 153 HD2 HIS 153 15.141 -5.116 2.085 1186 HE1 HIS 153 HE1 HIS 153 12.875 -7.353 4.890 1187 HE2 HIS 153 HE2 HIS 153 14.459 -7.462 2.933 1188 H THR 154 H THR 154 14.347 -0.143 3.361 1189 HA THR 154 HA THR 154 14.962 0.963 6.015 1190 HB THR 154 HB THR 154 15.212 2.572 3.477 1191 HG1 THR 154 HG1 THR 154 17.457 2.256 3.692 1192 HG21 THR 154 HG21 THR 154 16.565 3.091 6.094 1193 HG22 THR 154 HG22 THR 154 14.946 3.698 5.748 1194 HG23 THR 154 HG23 THR 154 16.306 4.190 4.739 1195 H TYR 155 H TYR 155 13.242 1.807 6.984 1196 HA TYR 155 HA TYR 155 10.795 2.193 5.445 1197 HB2 TYR 155 HB3 TYR 155 11.460 1.744 8.305 1198 HB3 TYR 155 HB2 TYR 155 10.035 2.722 7.973 1199 HD1 TYR 155 HD1 TYR 155 8.386 1.680 6.182 1200 HD2 TYR 155 HD2 TYR 155 11.208 -0.547 8.458 1201 HE1 TYR 155 HE1 TYR 155 7.067 -0.361 5.809 1202 HE2 TYR 155 HE2 TYR 155 9.897 -2.595 8.091 1203 HH TYR 155 HH TYR 155 6.734 -2.555 6.846 1204 H GLU 156 H GLU 156 10.158 4.142 4.777 1205 HA GLU 156 HA GLU 156 11.203 6.503 6.199 1206 HB2 GLU 156 HB3 GLU 156 10.828 6.103 3.231 1207 HB3 GLU 156 HB2 GLU 156 11.133 7.668 3.971 1208 HG2 GLU 156 HG3 GLU 156 13.308 7.291 3.976 1209 HG3 GLU 156 HG2 GLU 156 13.085 5.803 4.894 1210 H VAL 157 H VAL 157 9.811 8.097 6.692 1211 HA VAL 157 HA VAL 157 7.003 7.731 5.884 1212 HB VAL 157 HB VAL 157 7.896 9.278 8.311 1213 HG11 VAL 157 HG11 VAL 157 5.312 7.898 8.289 1214 HG12 VAL 157 HG12 VAL 157 5.468 9.158 7.066 1215 HG13 VAL 157 HG13 VAL 157 5.714 9.545 8.769 1216 HG21 VAL 157 HG21 VAL 157 7.082 6.375 8.233 1217 HG22 VAL 157 HG22 VAL 157 7.463 7.321 9.672 1218 HG23 VAL 157 HG23 VAL 157 8.723 6.965 8.490 1219 H TRP 158 H TRP 158 5.818 9.524 5.285 1220 HA TRP 158 HA TRP 158 7.180 12.091 5.004 1221 HB2 TRP 158 HB3 TRP 158 5.932 10.759 2.600 1222 HB3 TRP 158 HB2 TRP 158 6.761 12.310 2.638 1223 HD1 TRP 158 HD1 TRP 158 7.563 8.553 3.142 1224 HE1 TRP 158 HE1 TRP 158 10.004 8.162 2.424 1225 HE3 TRP 158 HE3 TRP 158 8.899 13.384 2.135 1226 HZ2 TRP 158 HZ2 TRP 158 12.204 9.698 1.548 1227 HZ3 TRP 158 HZ3 TRP 158 11.190 13.838 1.362 1228 HH2 TRP 158 HH2 TRP 158 12.808 12.032 1.075 1229 H GLN 159 H GLN 159 5.869 13.819 5.129 1230 HA GLN 159 HA GLN 159 2.973 13.421 4.886 1231 HB2 GLN 159 HB3 GLN 159 4.479 14.388 7.282 1232 HB3 GLN 159 HB2 GLN 159 2.895 15.073 6.943 1233 HG2 GLN 159 HG3 GLN 159 2.283 12.487 6.728 1234 HG3 GLN 159 HG2 GLN 159 3.641 12.362 7.846 1235 HE21 GLN 159 HE21 GLN 159 0.444 12.432 7.782 1236 HE22 GLN 159 HE22 GLN 159 0.098 13.222 9.279 1237 H LYS 160 H LYS 160 2.042 14.970 3.686 1238 HA LYS 160 HA LYS 160 3.506 16.960 2.405 1239 HB2 LYS 160 HB3 LYS 160 1.183 15.934 1.848 1240 HB3 LYS 160 HB2 LYS 160 0.551 17.221 2.863 1241 HG2 LYS 160 HG3 LYS 160 1.804 18.840 1.399 1242 HG3 LYS 160 HG2 LYS 160 2.114 17.485 0.311 1243 HD2 LYS 160 HD3 LYS 160 0.196 18.268 -0.636 1244 HD3 LYS 160 HD2 LYS 160 -0.514 17.185 0.562 1245 HE2 LYS 160 HE3 LYS 160 -0.754 19.091 2.105 1246 HE3 LYS 160 HE2 LYS 160 -0.098 20.158 0.864 1247 HZ1 LYS 160 HZ1 LYS 160 -2.136 20.382 0.068 1248 HZ2 LYS 160 HZ2 LYS 160 -2.751 19.294 1.207 1249 HZ3 LYS 160 HZ3 LYS 160 -2.194 18.729 -0.287 1250 H LYS 161 H LYS 161 3.947 19.047 2.805 1251 HA LYS 161 HA LYS 161 3.761 20.012 5.474 1252 HB2 LYS 161 HB3 LYS 161 4.434 21.623 3.010 1253 HB3 LYS 161 HB2 LYS 161 4.888 21.975 4.672 1254 HG2 LYS 161 HG3 LYS 161 6.158 19.759 4.605 1255 HG3 LYS 161 HG2 LYS 161 5.947 19.843 2.855 1256 HD2 LYS 161 HD3 LYS 161 8.084 20.788 3.425 1257 HD3 LYS 161 HD2 LYS 161 7.015 22.085 2.889 1258 HE2 LYS 161 HE3 LYS 161 6.645 22.816 5.122 1259 HE3 LYS 161 HE2 LYS 161 7.425 21.381 5.786 1260 HZ1 LYS 161 HZ1 LYS 161 9.170 22.769 5.935 1261 HZ2 LYS 161 HZ2 LYS 161 8.609 23.809 4.725 1262 HZ3 LYS 161 HZ3 LYS 161 9.397 22.373 4.305 1263 H ALA 162 H ALA 162 2.535 21.685 6.325 1264 HA ALA 162 HA ALA 162 0.685 22.970 6.649 1265 HB1 ALA 162 HB1 ALA 162 0.185 24.526 5.041 1266 HB2 ALA 162 HB2 ALA 162 0.327 23.368 3.719 1267 HB3 ALA 162 HB3 ALA 162 1.778 24.003 4.495 1268 H51A NDP 170 H51A NDP 170 -5.075 -0.955 -10.746 1269 H52A NDP 170 H52A NDP 170 -5.714 0.283 -9.651 1270 H4B NDP 170 H4B NDP 170 -7.339 -1.900 -11.025 1271 H3B NDP 170 H3B NDP 170 -7.148 1.078 -11.536 1272 HO3A NDP 170 HO3A NDP 170 -7.321 -1.293 -13.126 1273 H2B NDP 170 H2B NDP 170 -9.478 1.006 -12.121 1274 H1B NDP 170 H1B NDP 170 -10.250 -0.557 -9.978 1275 H8A NDP 170 H8A NDP 170 -7.445 1.985 -9.345 1276 H61A NDP 170 H61A NDP 170 -12.019 5.678 -7.357 1277 H62A NDP 170 H62A NDP 170 -10.285 5.474 -7.465 1278 H2A NDP 170 H2A NDP 170 -13.871 1.950 -9.029 1279 H51N NDP 170 H51N NDP 170 -0.530 -3.008 -8.784 1280 H52N NDP 170 H52N NDP 170 -1.312 -3.935 -7.492 1281 H4D NDP 170 H4D NDP 170 0.748 -5.067 -9.432 1282 H3D NDP 170 H3D NDP 170 -0.653 -6.297 -7.048 1283 HO3N NDP 170 HO3N NDP 170 -1.407 -7.158 -8.917 1284 H2D NDP 170 H2D NDP 170 1.373 -7.522 -6.639 1285 HO2N NDP 170 HO2N NDP 170 2.267 -6.616 -9.181 1286 H1D NDP 170 H1D NDP 170 3.066 -5.366 -7.002 1287 H2N NDP 170 H2N NDP 170 3.682 -5.171 -4.696 1288 H71N NDP 170 H71N NDP 170 5.598 -4.618 -2.159 1289 H72N NDP 170 H72N NDP 170 5.087 -4.925 -3.800 1290 H41N NDP 170 H41N NDP 170 0.744 -3.862 -2.340 1291 H42N NDP 170 H42N NDP 170 0.726 -5.639 -2.071 1292 H5N NDP 170 H5N NDP 170 -1.143 -4.915 -3.556 1293 H6N NDP 170 H6N NDP 170 -0.502 -5.312 -5.938 Start of MODEL 26 1 H1 THR 1 HT1 THR 1 -5.229 9.848 5.306 2 H2 THR 1 HT2 THR 1 -4.919 8.336 6.058 3 H3 THR 1 HT3 THR 1 -6.441 8.635 5.322 4 HA THR 1 HA THR 1 -5.330 7.314 3.838 5 HB THR 1 HB THR 1 -4.589 9.998 2.751 6 HG1 THR 1 HG1 THR 1 -6.412 10.596 3.773 7 HG21 THR 1 HG21 THR 1 -5.427 7.459 1.687 8 HG22 THR 1 HG22 THR 1 -4.730 8.855 0.864 9 HG23 THR 1 HG23 THR 1 -6.471 8.766 1.129 10 H ALA 2 H ALA 2 -3.511 6.174 4.088 11 HA ALA 2 HA ALA 2 -0.951 7.602 3.852 12 HB1 ALA 2 HB1 ALA 2 -1.709 5.532 5.891 13 HB2 ALA 2 HB2 ALA 2 -1.028 7.138 6.150 14 HB3 ALA 2 HB3 ALA 2 -0.028 5.856 5.467 15 H PHE 3 H PHE 3 0.789 6.353 2.985 16 HA PHE 3 HA PHE 3 -0.137 4.114 1.308 17 HB2 PHE 3 HB3 PHE 3 1.875 6.288 0.896 18 HB3 PHE 3 HB2 PHE 3 2.106 4.749 0.077 19 HD1 PHE 3 HD1 PHE 3 -1.103 6.472 0.775 20 HD2 PHE 3 HD2 PHE 3 1.766 5.323 -2.149 21 HE1 PHE 3 HE1 PHE 3 -2.632 7.202 -1.008 22 HE2 PHE 3 HE2 PHE 3 0.243 6.050 -3.937 23 HZ PHE 3 HZ PHE 3 -1.957 6.994 -3.368 24 H LEU 4 H LEU 4 0.828 2.148 1.494 25 HA LEU 4 HA LEU 4 3.400 1.943 2.848 26 HB2 LEU 4 HB3 LEU 4 1.872 1.720 4.676 27 HB3 LEU 4 HB2 LEU 4 0.875 0.594 3.776 28 HG LEU 4 HG LEU 4 2.876 -0.979 3.793 29 HD11 LEU 4 HD11 LEU 4 4.718 0.282 4.371 30 HD12 LEU 4 HD12 LEU 4 4.310 -0.488 5.905 31 HD13 LEU 4 HD13 LEU 4 3.844 1.187 5.607 32 HD21 LEU 4 HD21 LEU 4 0.781 -0.967 5.298 33 HD22 LEU 4 HD22 LEU 4 1.881 -0.395 6.553 34 HD23 LEU 4 HD23 LEU 4 2.166 -1.951 5.774 35 H TRP 5 H TRP 5 4.631 0.827 1.469 36 HA TRP 5 HA TRP 5 3.788 -1.773 0.582 37 HB2 TRP 5 HB3 TRP 5 3.628 -1.444 -1.719 38 HB3 TRP 5 HB2 TRP 5 2.803 -0.034 -1.068 39 HD1 TRP 5 HD1 TRP 5 5.921 -1.055 -3.001 40 HE1 TRP 5 HE1 TRP 5 7.027 1.054 -3.975 41 HE3 TRP 5 HE3 TRP 5 3.103 2.504 -0.648 42 HZ2 TRP 5 HZ2 TRP 5 6.749 3.853 -3.769 43 HZ3 TRP 5 HZ3 TRP 5 3.589 4.876 -1.096 44 HH2 TRP 5 HH2 TRP 5 5.372 5.534 -2.625 45 H ALA 6 H ALA 6 5.487 -2.974 -0.503 46 HA ALA 6 HA ALA 6 8.141 -2.021 0.323 47 HB1 ALA 6 HB1 ALA 6 8.840 -4.353 0.178 48 HB2 ALA 6 HB2 ALA 6 7.248 -4.803 -0.434 49 HB3 ALA 6 HB3 ALA 6 7.419 -4.189 1.210 50 H GLN 7 H GLN 7 9.928 -2.088 -1.109 51 HA GLN 7 HA GLN 7 9.490 -2.800 -3.882 52 HB2 GLN 7 HB3 GLN 7 10.107 -0.536 -4.713 53 HB3 GLN 7 HB2 GLN 7 8.551 -0.584 -3.894 54 HG2 GLN 7 HG3 GLN 7 10.452 0.004 -1.918 55 HG3 GLN 7 HG2 GLN 7 10.865 0.999 -3.313 56 HE21 GLN 7 HE21 GLN 7 8.376 0.229 -0.974 57 HE22 GLN 7 HE22 GLN 7 7.459 1.677 -1.190 58 H ASP 8 H ASP 8 11.422 -2.732 -5.172 59 HA ASP 8 HA ASP 8 13.840 -3.048 -3.549 60 HB2 ASP 8 HB3 ASP 8 14.457 -3.694 -6.223 61 HB3 ASP 8 HB2 ASP 8 14.215 -4.808 -4.886 62 H ARG 9 H ARG 9 15.791 -2.534 -5.524 63 HA ARG 9 HA ARG 9 15.931 0.308 -5.333 64 HB2 ARG 9 HB3 ARG 9 17.663 -1.881 -6.261 65 HB3 ARG 9 HB2 ARG 9 17.890 -0.365 -7.120 66 HG2 ARG 9 HG3 ARG 9 17.918 -0.545 -4.123 67 HG3 ARG 9 HG2 ARG 9 19.365 -0.755 -5.111 68 HD2 ARG 9 HD3 ARG 9 19.357 1.447 -5.823 69 HD3 ARG 9 HD2 ARG 9 17.638 1.653 -5.492 70 HE ARG 9 HE ARG 9 18.167 2.279 -3.360 71 HH11 ARG 9 HH11 ARG 9 20.915 0.641 -4.755 72 HH12 ARG 9 HH12 ARG 9 21.961 0.993 -3.420 73 HH21 ARG 9 HH21 ARG 9 19.540 2.742 -1.603 74 HH22 ARG 9 HH22 ARG 9 21.180 2.186 -1.630 75 H ASP 10 H ASP 10 14.740 -1.902 -7.703 76 HA ASP 10 HA ASP 10 14.815 0.005 -9.879 77 HB2 ASP 10 HB3 ASP 10 14.041 -2.846 -9.554 78 HB3 ASP 10 HB2 ASP 10 13.265 -1.949 -10.856 79 H GLY 11 H GLY 11 12.970 -0.142 -7.216 80 HA2 GLY 11 HA3 GLY 11 11.055 1.084 -6.725 81 HA3 GLY 11 HA2 GLY 11 10.842 1.381 -8.443 82 H LEU 12 H LEU 12 11.282 -1.838 -8.266 83 HA LEU 12 HA LEU 12 8.751 -2.613 -9.005 84 HB2 LEU 12 HB3 LEU 12 11.049 -3.885 -8.868 85 HB3 LEU 12 HB2 LEU 12 10.425 -4.429 -7.328 86 HG LEU 12 HG LEU 12 8.482 -5.441 -8.481 87 HD11 LEU 12 HD11 LEU 12 8.418 -5.610 -10.874 88 HD12 LEU 12 HD12 LEU 12 9.948 -4.747 -11.024 89 HD13 LEU 12 HD13 LEU 12 8.514 -3.904 -10.442 90 HD21 LEU 12 HD21 LEU 12 9.671 -7.313 -8.618 91 HD22 LEU 12 HD22 LEU 12 11.110 -6.328 -8.344 92 HD23 LEU 12 HD23 LEU 12 10.599 -6.706 -9.991 93 H ILE 13 H ILE 13 7.380 -4.234 -7.714 94 HA ILE 13 HA ILE 13 7.229 -3.768 -4.878 95 HB ILE 13 HB ILE 13 4.946 -2.985 -4.814 96 HG12 ILE 13 HG13 ILE 13 4.815 -2.321 -7.702 97 HG13 ILE 13 HG12 ILE 13 4.590 -4.015 -7.289 98 HG21 ILE 13 HG21 ILE 13 6.428 -1.177 -6.700 99 HG22 ILE 13 HG22 ILE 13 6.883 -1.385 -5.009 100 HG23 ILE 13 HG23 ILE 13 5.297 -0.733 -5.422 101 HD11 ILE 13 HD11 ILE 13 2.710 -3.529 -5.940 102 HD12 ILE 13 HD12 ILE 13 2.498 -2.655 -7.456 103 HD13 ILE 13 HD13 ILE 13 3.027 -1.797 -6.010 104 H GLY 14 H GLY 14 5.992 -5.251 -7.801 105 HA2 GLY 14 HA3 GLY 14 5.537 -7.711 -6.293 106 HA3 GLY 14 HA2 GLY 14 4.186 -7.053 -7.201 107 H LYS 15 H LYS 15 4.701 -9.432 -7.948 108 HA LYS 15 HA LYS 15 6.198 -9.182 -10.463 109 HB2 LYS 15 HB3 LYS 15 6.994 -11.477 -10.237 110 HB3 LYS 15 HB2 LYS 15 7.531 -10.510 -8.870 111 HG2 LYS 15 HG3 LYS 15 6.393 -11.743 -7.392 112 HG3 LYS 15 HG2 LYS 15 4.979 -11.872 -8.439 113 HD2 LYS 15 HD3 LYS 15 6.866 -13.398 -9.745 114 HD3 LYS 15 HD2 LYS 15 7.191 -13.730 -8.043 115 HE2 LYS 15 HE3 LYS 15 5.479 -15.145 -8.041 116 HE3 LYS 15 HE2 LYS 15 4.398 -13.782 -8.326 117 HZ1 LYS 15 HZ1 LYS 15 5.329 -15.821 -10.161 118 HZ2 LYS 15 HZ2 LYS 15 5.311 -14.252 -10.792 119 HZ3 LYS 15 HZ3 LYS 15 3.892 -14.928 -10.170 120 H ASP 16 H ASP 16 3.668 -8.615 -10.617 121 HA ASP 16 HA ASP 16 1.815 -9.132 -11.854 122 HB2 ASP 16 HB3 ASP 16 3.587 -10.952 -12.827 123 HB3 ASP 16 HB2 ASP 16 2.372 -12.022 -12.134 124 H GLY 17 H GLY 17 2.108 -9.403 -8.968 125 HA2 GLY 17 HA3 GLY 17 -0.436 -10.428 -8.340 126 HA3 GLY 17 HA2 GLY 17 0.776 -11.632 -7.923 127 H HIS 18 H HIS 18 2.784 -10.428 -6.806 128 HA HIS 18 HA HIS 18 2.267 -8.219 -5.135 129 HB2 HIS 18 HB3 HIS 18 2.004 -9.323 -2.977 130 HB3 HIS 18 HB2 HIS 18 0.699 -9.800 -4.059 131 HD1 HIS 18 HD1 HIS 18 3.230 -11.761 -5.342 132 HD2 HIS 18 HD2 HIS 18 1.165 -11.878 -1.738 133 HE1 HIS 18 HE1 HIS 18 3.496 -14.112 -4.492 134 HE2 HIS 18 HE2 HIS 18 2.311 -14.135 -2.268 135 H LEU 19 H LEU 19 3.867 -8.603 -3.011 136 HA LEU 19 HA LEU 19 6.456 -8.583 -4.147 137 HB2 LEU 19 HB3 LEU 19 7.234 -8.497 -1.772 138 HB3 LEU 19 HB2 LEU 19 6.089 -7.250 -2.223 139 HG LEU 19 HG LEU 19 4.389 -9.088 -1.211 140 HD11 LEU 19 HD11 LEU 19 5.288 -10.546 0.214 141 HD12 LEU 19 HD12 LEU 19 6.351 -9.328 0.918 142 HD13 LEU 19 HD13 LEU 19 6.834 -10.178 -0.550 143 HD21 LEU 19 HD21 LEU 19 5.945 -7.029 0.350 144 HD22 LEU 19 HD22 LEU 19 4.410 -7.746 0.841 145 HD23 LEU 19 HD23 LEU 19 4.490 -6.734 -0.602 146 HA PRO 20 HA PRO 20 6.931 -13.057 -3.838 147 HB2 PRO 20 HB3 PRO 20 8.859 -13.330 -5.659 148 HB3 PRO 20 HB2 PRO 20 7.200 -12.948 -6.134 149 HG2 PRO 20 HG3 PRO 20 9.578 -11.154 -5.937 150 HG3 PRO 20 HG2 PRO 20 8.276 -11.162 -7.138 151 HD2 PRO 20 HD3 PRO 20 8.441 -9.456 -4.941 152 HD3 PRO 20 HD2 PRO 20 6.972 -9.792 -5.876 153 H TRP 21 H TRP 21 8.706 -10.743 -2.428 154 HA TRP 21 HA TRP 21 11.032 -12.450 -1.900 155 HB2 TRP 21 HB3 TRP 21 11.909 -10.338 -0.756 156 HB3 TRP 21 HB2 TRP 21 11.764 -10.296 -2.509 157 HD1 TRP 21 HD1 TRP 21 9.662 -9.190 0.565 158 HE1 TRP 21 HE1 TRP 21 8.465 -6.995 -0.049 159 HE3 TRP 21 HE3 TRP 21 11.182 -8.777 -4.296 160 HZ2 TRP 21 HZ2 TRP 21 8.200 -5.313 -2.302 161 HZ3 TRP 21 HZ3 TRP 21 10.411 -6.849 -5.613 162 HH2 TRP 21 HH2 TRP 21 8.950 -5.153 -4.636 163 H HIS 22 H HIS 22 11.610 -13.072 0.160 164 HA HIS 22 HA HIS 22 9.424 -13.190 2.059 165 HB2 HIS 22 HB3 HIS 22 10.918 -15.156 1.480 166 HB3 HIS 22 HB2 HIS 22 12.196 -14.344 2.379 167 HD1 HIS 22 HD1 HIS 22 12.028 -14.343 4.939 168 HD2 HIS 22 HD2 HIS 22 8.843 -16.230 3.053 169 HE1 HIS 22 HE1 HIS 22 10.798 -15.566 6.760 170 HE2 HIS 22 HE2 HIS 22 8.822 -16.624 5.609 171 H LEU 23 H LEU 23 9.259 -11.085 2.837 172 HA LEU 23 HA LEU 23 11.559 -10.130 4.412 173 HB2 LEU 23 HB3 LEU 23 9.846 -8.810 2.524 174 HB3 LEU 23 HB2 LEU 23 9.673 -8.049 4.094 175 HG LEU 23 HG LEU 23 12.291 -8.034 4.063 176 HD11 LEU 23 HD11 LEU 23 11.617 -8.214 1.131 177 HD12 LEU 23 HD12 LEU 23 12.577 -9.362 2.063 178 HD13 LEU 23 HD13 LEU 23 13.179 -7.728 1.790 179 HD21 LEU 23 HD21 LEU 23 12.216 -5.835 2.901 180 HD22 LEU 23 HD22 LEU 23 10.982 -6.027 4.146 181 HD23 LEU 23 HD23 LEU 23 10.549 -6.183 2.443 182 HA PRO 24 HA PRO 24 8.473 -11.574 7.553 183 HB2 PRO 24 HB3 PRO 24 10.966 -11.248 9.150 184 HB3 PRO 24 HB2 PRO 24 9.792 -12.569 9.153 185 HG2 PRO 24 HG3 PRO 24 12.159 -12.856 7.967 186 HG3 PRO 24 HG2 PRO 24 10.690 -13.547 7.252 187 HD2 PRO 24 HD3 PRO 24 12.224 -11.112 6.458 188 HD3 PRO 24 HD2 PRO 24 11.372 -12.293 5.443 189 H ASP 25 H ASP 25 11.039 -9.152 8.096 190 HA ASP 25 HA ASP 25 9.819 -7.728 10.128 191 HB2 ASP 25 HB3 ASP 25 11.353 -5.950 9.569 192 HB3 ASP 25 HB2 ASP 25 12.177 -7.489 9.394 193 H ASP 26 H ASP 26 9.272 -7.623 6.675 194 HA ASP 26 HA ASP 26 7.816 -5.167 6.680 195 HB2 ASP 26 HB3 ASP 26 8.975 -6.314 4.692 196 HB3 ASP 26 HB2 ASP 26 7.538 -7.328 4.601 197 H LEU 27 H LEU 27 6.725 -8.537 6.199 198 HA LEU 27 HA LEU 27 3.983 -7.924 6.419 199 HB2 LEU 27 HB3 LEU 27 3.975 -10.506 7.112 200 HB3 LEU 27 HB2 LEU 27 4.148 -9.960 5.456 201 HG LEU 27 HG LEU 27 6.695 -10.231 6.894 202 HD11 LEU 27 HD11 LEU 27 6.187 -12.173 7.872 203 HD12 LEU 27 HD12 LEU 27 6.343 -12.833 6.245 204 HD13 LEU 27 HD13 LEU 27 4.751 -12.419 6.880 205 HD21 LEU 27 HD21 LEU 27 7.264 -11.428 4.781 206 HD22 LEU 27 HD22 LEU 27 6.674 -9.782 4.544 207 HD23 LEU 27 HD23 LEU 27 5.607 -11.154 4.240 208 H HIS 28 H HIS 28 6.370 -8.982 8.803 209 HA HIS 28 HA HIS 28 4.706 -9.498 10.958 210 HB2 HIS 28 HB3 HIS 28 7.520 -8.478 10.748 211 HB3 HIS 28 HB2 HIS 28 6.744 -8.604 12.323 212 HD1 HIS 28 HD1 HIS 28 8.352 -10.472 13.077 213 HD2 HIS 28 HD2 HIS 28 6.119 -11.422 9.704 214 HE1 HIS 28 HE1 HIS 28 8.652 -12.947 12.747 215 HE2 HIS 28 HE2 HIS 28 7.373 -13.480 10.643 216 H TYR 29 H TYR 29 6.204 -6.406 10.039 217 HA TYR 29 HA TYR 29 4.820 -4.954 12.093 218 HB2 TYR 29 HB3 TYR 29 7.052 -4.275 11.251 219 HB3 TYR 29 HB2 TYR 29 6.329 -3.907 9.689 220 HD1 TYR 29 HD1 TYR 29 5.331 -3.144 13.213 221 HD2 TYR 29 HD2 TYR 29 6.283 -1.627 9.354 222 HE1 TYR 29 HE1 TYR 29 4.828 -0.866 13.991 223 HE2 TYR 29 HE2 TYR 29 5.784 0.655 10.121 224 HH TYR 29 HH TYR 29 4.529 1.786 11.845 225 H PHE 30 H PHE 30 4.220 -5.799 8.785 226 HA PHE 30 HA PHE 30 2.339 -3.772 8.174 227 HB2 PHE 30 HB3 PHE 30 3.512 -5.228 6.499 228 HB3 PHE 30 HB2 PHE 30 2.475 -6.558 7.005 229 HD1 PHE 30 HD1 PHE 30 -0.099 -6.053 6.908 230 HD2 PHE 30 HD2 PHE 30 2.868 -3.929 4.719 231 HE1 PHE 30 HE1 PHE 30 -1.812 -5.329 5.297 232 HE2 PHE 30 HE2 PHE 30 1.161 -3.201 3.104 233 HZ PHE 30 HZ PHE 30 -1.183 -3.901 3.393 234 H ARG 31 H ARG 31 1.891 -7.178 9.126 235 HA ARG 31 HA ARG 31 -0.931 -6.952 9.382 236 HB2 ARG 31 HB3 ARG 31 0.375 -9.077 8.978 237 HB3 ARG 31 HB2 ARG 31 0.839 -9.028 10.673 238 HG2 ARG 31 HG3 ARG 31 -1.762 -8.862 11.035 239 HG3 ARG 31 HG2 ARG 31 -1.798 -9.619 9.441 240 HD2 ARG 31 HD3 ARG 31 -0.065 -10.725 11.618 241 HD3 ARG 31 HD2 ARG 31 -1.783 -11.116 11.556 242 HE ARG 31 HE ARG 31 -0.945 -11.678 9.052 243 HH11 ARG 31 HH11 ARG 31 0.215 -12.611 12.209 244 HH12 ARG 31 HH12 ARG 31 0.829 -14.138 11.669 245 HH21 ARG 31 HH21 ARG 31 -0.139 -13.685 8.341 246 HH22 ARG 31 HH22 ARG 31 0.628 -14.748 9.474 247 H ALA 32 H ALA 32 1.710 -6.206 11.472 248 HA ALA 32 HA ALA 32 0.199 -6.355 13.916 249 HB1 ALA 32 HB1 ALA 32 2.818 -4.932 13.521 250 HB2 ALA 32 HB2 ALA 32 2.697 -6.681 13.712 251 HB3 ALA 32 HB3 ALA 32 2.157 -5.613 15.008 252 H GLN 33 H GLN 33 1.071 -3.861 11.602 253 HA GLN 33 HA GLN 33 0.029 -1.742 13.282 254 HB2 GLN 33 HB3 GLN 33 1.701 -1.924 10.932 255 HB3 GLN 33 HB2 GLN 33 0.423 -0.740 10.691 256 HG2 GLN 33 HG3 GLN 33 1.483 -0.337 13.282 257 HG3 GLN 33 HG2 GLN 33 2.838 -0.490 12.164 258 HE21 GLN 33 HE21 GLN 33 2.358 0.739 10.012 259 HE22 GLN 33 HE22 GLN 33 1.817 2.367 10.220 260 H THR 34 H THR 34 -1.058 -3.750 10.660 261 HA THR 34 HA THR 34 -3.344 -2.073 10.070 262 HB THR 34 HB THR 34 -3.916 -3.756 8.418 263 HG1 THR 34 HG1 THR 34 -1.940 -5.277 9.740 264 HG21 THR 34 HG21 THR 34 -1.149 -2.751 8.540 265 HG22 THR 34 HG22 THR 34 -2.386 -2.543 7.299 266 HG23 THR 34 HG23 THR 34 -1.473 -4.049 7.391 267 H VAL 35 H VAL 35 -2.948 -3.389 12.778 268 HA VAL 35 HA VAL 35 -5.205 -5.218 12.905 269 HB VAL 35 HB VAL 35 -3.496 -4.218 15.184 270 HG11 VAL 35 HG11 VAL 35 -5.540 -5.151 15.983 271 HG12 VAL 35 HG12 VAL 35 -4.273 -6.352 16.241 272 HG13 VAL 35 HG13 VAL 35 -5.401 -6.533 14.897 273 HG21 VAL 35 HG21 VAL 35 -3.146 -6.626 13.405 274 HG22 VAL 35 HG22 VAL 35 -2.314 -6.406 14.945 275 HG23 VAL 35 HG23 VAL 35 -2.029 -5.278 13.619 276 H GLY 36 H GLY 36 -7.060 -4.055 12.615 277 HA2 GLY 36 HA3 GLY 36 -8.887 -3.025 13.720 278 HA3 GLY 36 HA2 GLY 36 -7.753 -2.224 14.795 279 H LYS 37 H LYS 37 -7.184 -2.226 11.365 280 HA LYS 37 HA LYS 37 -8.104 0.571 11.234 281 HB2 LYS 37 HB3 LYS 37 -5.488 -0.628 10.418 282 HB3 LYS 37 HB2 LYS 37 -6.121 0.739 9.510 283 HG2 LYS 37 HG3 LYS 37 -6.403 1.603 12.078 284 HG3 LYS 37 HG2 LYS 37 -4.930 0.637 12.177 285 HD2 LYS 37 HD3 LYS 37 -4.187 1.925 10.082 286 HD3 LYS 37 HD2 LYS 37 -5.489 3.048 10.479 287 HE2 LYS 37 HE3 LYS 37 -3.402 2.255 12.487 288 HE3 LYS 37 HE2 LYS 37 -3.152 3.588 11.360 289 HZ1 LYS 37 HZ1 LYS 37 -5.629 3.562 12.915 290 HZ2 LYS 37 HZ2 LYS 37 -4.698 4.873 12.390 291 HZ3 LYS 37 HZ3 LYS 37 -4.199 3.963 13.725 292 H ILE 38 H ILE 38 -7.882 1.225 8.711 293 HA ILE 38 HA ILE 38 -9.373 -0.848 7.235 294 HB ILE 38 HB ILE 38 -9.783 1.740 6.069 295 HG12 ILE 38 HG13 ILE 38 -10.829 1.620 8.892 296 HG13 ILE 38 HG12 ILE 38 -9.313 2.425 8.505 297 HG21 ILE 38 HG21 ILE 38 -12.122 1.170 6.343 298 HG22 ILE 38 HG22 ILE 38 -11.698 -0.102 7.487 299 HG23 ILE 38 HG23 ILE 38 -11.208 -0.238 5.799 300 HD11 ILE 38 HD11 ILE 38 -12.070 3.132 7.569 301 HD12 ILE 38 HD12 ILE 38 -10.608 3.801 6.843 302 HD13 ILE 38 HD13 ILE 38 -10.963 4.096 8.546 303 H MET 39 H MET 39 -8.117 -1.740 5.740 304 HA MET 39 HA MET 39 -6.073 -0.090 4.430 305 HB2 MET 39 HB3 MET 39 -5.155 -2.064 5.423 306 HB3 MET 39 HB2 MET 39 -6.392 -3.079 4.697 307 HG2 MET 39 HG3 MET 39 -4.682 -1.530 2.851 308 HG3 MET 39 HG2 MET 39 -3.922 -2.860 3.723 309 HE1 MET 39 HE1 MET 39 -5.255 -4.960 4.141 310 HE2 MET 39 HE2 MET 39 -5.616 -5.954 2.730 311 HE3 MET 39 HE3 MET 39 -6.910 -5.068 3.538 312 H VAL 40 H VAL 40 -6.191 0.428 2.339 313 HA VAL 40 HA VAL 40 -8.499 -0.520 0.812 314 HB VAL 40 HB VAL 40 -6.572 1.655 0.006 315 HG11 VAL 40 HG11 VAL 40 -8.458 0.418 -1.475 316 HG12 VAL 40 HG12 VAL 40 -7.962 2.094 -1.712 317 HG13 VAL 40 HG13 VAL 40 -9.410 1.726 -0.774 318 HG21 VAL 40 HG21 VAL 40 -7.322 2.662 1.901 319 HG22 VAL 40 HG22 VAL 40 -8.798 1.698 1.963 320 HG23 VAL 40 HG23 VAL 40 -8.679 3.059 0.847 321 H VAL 41 H VAL 41 -8.325 -1.864 -0.877 322 HA VAL 41 HA VAL 41 -5.637 -2.380 -1.959 323 HB VAL 41 HB VAL 41 -6.883 -4.164 -0.390 324 HG11 VAL 41 HG11 VAL 41 -7.591 -5.271 -3.073 325 HG12 VAL 41 HG12 VAL 41 -8.733 -4.237 -2.214 326 HG13 VAL 41 HG13 VAL 41 -8.175 -5.737 -1.475 327 HG21 VAL 41 HG21 VAL 41 -4.843 -4.940 -0.833 328 HG22 VAL 41 HG22 VAL 41 -4.848 -4.278 -2.467 329 HG23 VAL 41 HG23 VAL 41 -5.603 -5.839 -2.146 330 H GLY 42 H GLY 42 -5.495 -2.921 -4.162 331 HA2 GLY 42 HA3 GLY 42 -7.568 -1.760 -5.792 332 HA3 GLY 42 HA2 GLY 42 -6.049 -2.438 -6.360 333 H ARG 43 H ARG 43 -8.266 -2.916 -7.838 334 HA ARG 43 HA ARG 43 -9.836 -5.097 -7.210 335 HB2 ARG 43 HB3 ARG 43 -10.421 -3.846 -9.123 336 HB3 ARG 43 HB2 ARG 43 -8.835 -4.065 -9.848 337 HG2 ARG 43 HG3 ARG 43 -9.494 -5.904 -10.897 338 HG3 ARG 43 HG2 ARG 43 -10.090 -6.616 -9.397 339 HD2 ARG 43 HD3 ARG 43 -11.847 -6.380 -11.109 340 HD3 ARG 43 HD2 ARG 43 -12.195 -5.475 -9.640 341 HE ARG 43 HE ARG 43 -11.606 -3.459 -10.812 342 HH11 ARG 43 HH11 ARG 43 -11.963 -6.295 -12.834 343 HH12 ARG 43 HH12 ARG 43 -12.217 -5.377 -14.278 344 HH21 ARG 43 HH21 ARG 43 -11.934 -2.269 -12.716 345 HH22 ARG 43 HH22 ARG 43 -12.201 -3.098 -14.213 346 H ARG 44 H ARG 44 -6.959 -5.201 -9.304 347 HA ARG 44 HA ARG 44 -6.757 -7.973 -9.447 348 HB2 ARG 44 HB3 ARG 44 -4.773 -5.750 -9.801 349 HB3 ARG 44 HB2 ARG 44 -4.258 -7.428 -9.901 350 HG2 ARG 44 HG3 ARG 44 -4.724 -7.175 -12.078 351 HG3 ARG 44 HG2 ARG 44 -6.384 -7.475 -11.560 352 HD2 ARG 44 HD3 ARG 44 -5.807 -4.711 -11.191 353 HD3 ARG 44 HD2 ARG 44 -5.313 -5.170 -12.820 354 HE ARG 44 HE ARG 44 -7.988 -4.966 -11.821 355 HH11 ARG 44 HH11 ARG 44 -5.954 -6.566 -14.162 356 HH12 ARG 44 HH12 ARG 44 -7.256 -6.894 -15.255 357 HH21 ARG 44 HH21 ARG 44 -9.702 -5.397 -13.258 358 HH22 ARG 44 HH22 ARG 44 -9.385 -6.230 -14.742 359 H THR 45 H THR 45 -5.972 -5.839 -6.868 360 HA THR 45 HA THR 45 -4.099 -7.612 -5.603 361 HB THR 45 HB THR 45 -5.475 -5.397 -4.142 362 HG1 THR 45 HG1 THR 45 -4.901 -4.077 -5.658 363 HG21 THR 45 HG21 THR 45 -3.843 -6.488 -2.842 364 HG22 THR 45 HG22 THR 45 -3.107 -4.984 -3.396 365 HG23 THR 45 HG23 THR 45 -2.689 -6.509 -4.175 366 H TYR 46 H TYR 46 -7.519 -6.706 -5.014 367 HA TYR 46 HA TYR 46 -7.874 -8.166 -2.685 368 HB2 TYR 46 HB3 TYR 46 -10.241 -8.130 -3.089 369 HB3 TYR 46 HB2 TYR 46 -9.573 -6.606 -3.650 370 HD1 TYR 46 HD2 TYR 46 -10.227 -10.006 -5.113 371 HD2 TYR 46 HD1 TYR 46 -10.545 -5.783 -5.569 372 HE1 TYR 46 HE2 TYR 46 -11.302 -10.325 -7.284 373 HE2 TYR 46 HE1 TYR 46 -11.642 -6.107 -7.741 374 HH TYR 46 HH TYR 46 -12.891 -7.806 -8.944 375 H GLU 47 H GLU 47 -7.938 -9.268 -6.035 376 HA GLU 47 HA GLU 47 -8.588 -11.980 -5.233 377 HB2 GLU 47 HB3 GLU 47 -8.674 -10.455 -7.664 378 HB3 GLU 47 HB2 GLU 47 -7.750 -11.928 -7.933 379 HG2 GLU 47 HG3 GLU 47 -9.564 -13.289 -7.240 380 HG3 GLU 47 HG2 GLU 47 -10.462 -11.889 -6.660 381 H SER 48 H SER 48 -5.796 -10.078 -5.725 382 HA SER 48 HA SER 48 -4.095 -12.448 -6.051 383 HB2 SER 48 HB3 SER 48 -3.478 -9.502 -6.330 384 HB3 SER 48 HB2 SER 48 -2.267 -10.777 -6.458 385 HG SER 48 HG SER 48 -4.603 -10.693 -8.058 386 H PHE 49 H PHE 49 -5.460 -11.320 -3.495 387 HA PHE 49 HA PHE 49 -3.032 -11.068 -1.858 388 HB2 PHE 49 HB3 PHE 49 -5.218 -9.470 -1.847 389 HB3 PHE 49 HB2 PHE 49 -5.670 -10.624 -0.597 390 HD1 PHE 49 HD1 PHE 49 -2.884 -8.383 -1.631 391 HD2 PHE 49 HD2 PHE 49 -4.903 -10.338 1.565 392 HE1 PHE 49 HE1 PHE 49 -1.488 -7.168 -0.011 393 HE2 PHE 49 HE2 PHE 49 -3.511 -9.126 3.191 394 HZ PHE 49 HZ PHE 49 -1.800 -7.538 2.405 395 HA PRO 50 HA PRO 50 -3.808 -15.151 -0.294 396 HB2 PRO 50 HB3 PRO 50 -2.071 -15.175 1.752 397 HB3 PRO 50 HB2 PRO 50 -1.526 -15.172 0.070 398 HG2 PRO 50 HG3 PRO 50 -1.696 -12.900 2.011 399 HG3 PRO 50 HG2 PRO 50 -0.407 -13.294 0.859 400 HD2 PRO 50 HD3 PRO 50 -2.333 -11.399 0.404 401 HD3 PRO 50 HD2 PRO 50 -1.493 -12.282 -0.886 402 H LYS 51 H LYS 51 -4.246 -12.292 1.631 403 HA LYS 51 HA LYS 51 -5.963 -13.823 3.474 404 HB2 LYS 51 HB3 LYS 51 -4.082 -11.545 4.003 405 HB3 LYS 51 HB2 LYS 51 -5.475 -11.801 5.046 406 HG2 LYS 51 HG3 LYS 51 -3.788 -14.163 4.513 407 HG3 LYS 51 HG2 LYS 51 -3.073 -12.885 5.498 408 HD2 LYS 51 HD3 LYS 51 -4.978 -12.979 7.020 409 HD3 LYS 51 HD2 LYS 51 -5.723 -14.231 6.024 410 HE2 LYS 51 HE3 LYS 51 -4.448 -15.845 6.910 411 HE3 LYS 51 HE2 LYS 51 -2.987 -14.862 6.818 412 HZ1 LYS 51 HZ1 LYS 51 -4.226 -13.642 8.804 413 HZ2 LYS 51 HZ2 LYS 51 -3.193 -14.958 9.051 414 HZ3 LYS 51 HZ3 LYS 51 -4.868 -15.193 9.017 415 H ARG 52 H ARG 52 -7.608 -13.415 1.818 416 HA ARG 52 HA ARG 52 -8.717 -10.696 2.038 417 HB2 ARG 52 HB3 ARG 52 -9.843 -11.312 -0.201 418 HB3 ARG 52 HB2 ARG 52 -8.141 -10.868 -0.211 419 HG2 ARG 52 HG3 ARG 52 -7.488 -12.895 -0.903 420 HG3 ARG 52 HG2 ARG 52 -8.640 -13.733 0.137 421 HD2 ARG 52 HD3 ARG 52 -10.399 -13.438 -1.421 422 HD3 ARG 52 HD2 ARG 52 -9.463 -12.279 -2.365 423 HE ARG 52 HE ARG 52 -8.025 -14.634 -2.394 424 HH11 ARG 52 HH11 ARG 52 -11.184 -13.572 -3.429 425 HH12 ARG 52 HH12 ARG 52 -11.276 -14.709 -4.732 426 HH21 ARG 52 HH21 ARG 52 -8.145 -16.130 -4.107 427 HH22 ARG 52 HH22 ARG 52 -9.552 -16.161 -5.117 428 HA PRO 53 HA PRO 53 -9.765 -9.830 3.174 429 HB2 PRO 53 HB3 PRO 53 -11.345 -9.287 5.258 430 HB3 PRO 53 HB2 PRO 53 -11.945 -9.190 3.599 431 HG2 PRO 53 HG3 PRO 53 -12.441 -11.253 5.672 432 HG3 PRO 53 HG2 PRO 53 -13.490 -10.702 4.356 433 HD2 PRO 53 HD3 PRO 53 -11.867 -13.026 4.392 434 HD3 PRO 53 HD2 PRO 53 -12.759 -12.366 3.009 435 H LEU 54 H LEU 54 -8.531 -9.005 4.948 436 HA LEU 54 HA LEU 54 -7.058 -10.980 6.357 437 HB2 LEU 54 HB3 LEU 54 -7.122 -7.976 6.489 438 HB3 LEU 54 HB2 LEU 54 -6.088 -8.928 7.537 439 HG LEU 54 HG LEU 54 -5.637 -9.831 4.888 440 HD11 LEU 54 HD11 LEU 54 -4.659 -7.457 4.195 441 HD12 LEU 54 HD12 LEU 54 -6.063 -6.910 5.110 442 HD13 LEU 54 HD13 LEU 54 -6.275 -7.989 3.731 443 HD21 LEU 54 HD21 LEU 54 -3.473 -9.613 5.494 444 HD22 LEU 54 HD22 LEU 54 -4.177 -9.404 7.098 445 HD23 LEU 54 HD23 LEU 54 -3.705 -7.993 6.151 446 HA PRO 55 HA PRO 55 -9.645 -11.371 9.929 447 HB2 PRO 55 HB3 PRO 55 -7.903 -12.546 11.622 448 HB3 PRO 55 HB2 PRO 55 -8.600 -13.394 10.236 449 HG2 PRO 55 HG3 PRO 55 -5.913 -12.101 10.510 450 HG3 PRO 55 HG2 PRO 55 -6.333 -13.664 9.786 451 HD2 PRO 55 HD3 PRO 55 -5.881 -11.424 8.313 452 HD3 PRO 55 HD2 PRO 55 -6.994 -12.708 7.801 453 H GLU 56 H GLU 56 -10.072 -10.465 11.900 454 HA GLU 56 HA GLU 56 -10.113 -8.824 13.465 455 HB2 GLU 56 HB3 GLU 56 -8.093 -10.373 14.083 456 HB3 GLU 56 HB2 GLU 56 -7.132 -8.964 13.656 457 HG2 GLU 56 HG3 GLU 56 -7.546 -8.020 15.612 458 HG3 GLU 56 HG2 GLU 56 -9.285 -8.183 15.375 459 H ARG 57 H ARG 57 -9.718 -7.946 10.661 460 HA ARG 57 HA ARG 57 -8.968 -5.224 11.310 461 HB2 ARG 57 HB3 ARG 57 -7.235 -4.947 9.771 462 HB3 ARG 57 HB2 ARG 57 -6.879 -6.491 10.525 463 HG2 ARG 57 HG3 ARG 57 -6.513 -6.984 8.324 464 HG3 ARG 57 HG2 ARG 57 -8.202 -7.464 8.495 465 HD2 ARG 57 HD3 ARG 57 -7.495 -6.026 6.460 466 HD3 ARG 57 HD2 ARG 57 -8.977 -5.628 7.322 467 HE ARG 57 HE ARG 57 -8.020 -3.659 8.019 468 HH11 ARG 57 HH11 ARG 57 -5.562 -5.712 6.629 469 HH12 ARG 57 HH12 ARG 57 -4.362 -4.464 6.600 470 HH21 ARG 57 HH21 ARG 57 -6.444 -2.019 7.980 471 HH22 ARG 57 HH22 ARG 57 -4.862 -2.367 7.367 472 H THR 58 H THR 58 -9.504 -3.691 9.556 473 HA THR 58 HA THR 58 -11.925 -4.586 8.182 474 HB THR 58 HB THR 58 -10.948 -1.746 8.289 475 HG1 THR 58 HG1 THR 58 -12.088 -1.533 10.243 476 HG21 THR 58 HG21 THR 58 -13.746 -2.838 8.364 477 HG22 THR 58 HG22 THR 58 -12.924 -2.307 6.897 478 HG23 THR 58 HG23 THR 58 -13.252 -1.154 8.190 479 H ASN 59 H ASN 59 -11.892 -5.059 6.091 480 HA ASN 59 HA ASN 59 -9.581 -4.229 4.499 481 HB2 ASN 59 HB3 ASN 59 -11.644 -6.395 4.133 482 HB3 ASN 59 HB2 ASN 59 -10.515 -5.943 2.859 483 HD21 ASN 59 HD21 ASN 59 -10.507 -6.745 6.310 484 HD22 ASN 59 HD22 ASN 59 -9.086 -7.724 6.256 485 H VAL 60 H VAL 60 -9.759 -3.241 2.516 486 HA VAL 60 HA VAL 60 -12.406 -2.273 1.704 487 HB VAL 60 HB VAL 60 -9.942 -0.546 2.007 488 HG11 VAL 60 HG11 VAL 60 -10.782 0.472 0.174 489 HG12 VAL 60 HG12 VAL 60 -11.885 1.192 1.347 490 HG13 VAL 60 HG13 VAL 60 -12.394 -0.208 0.402 491 HG21 VAL 60 HG21 VAL 60 -12.487 0.278 3.211 492 HG22 VAL 60 HG22 VAL 60 -10.850 0.323 3.867 493 HG23 VAL 60 HG23 VAL 60 -11.775 -1.178 3.906 494 H VAL 61 H VAL 61 -12.755 -2.613 -0.395 495 HA VAL 61 HA VAL 61 -10.446 -3.248 -2.101 496 HB VAL 61 HB VAL 61 -13.346 -4.034 -2.417 497 HG11 VAL 61 HG11 VAL 61 -12.799 -4.176 -4.590 498 HG12 VAL 61 HG12 VAL 61 -11.942 -5.639 -4.104 499 HG13 VAL 61 HG13 VAL 61 -11.067 -4.115 -4.262 500 HG21 VAL 61 HG21 VAL 61 -11.711 -5.104 -0.639 501 HG22 VAL 61 HG22 VAL 61 -11.145 -5.996 -2.052 502 HG23 VAL 61 HG23 VAL 61 -12.838 -6.092 -1.569 503 H LEU 62 H LEU 62 -10.177 -2.291 -4.074 504 HA LEU 62 HA LEU 62 -12.020 -0.093 -4.737 505 HB2 LEU 62 HB3 LEU 62 -9.805 0.653 -3.830 506 HB3 LEU 62 HB2 LEU 62 -9.041 -0.111 -5.210 507 HG LEU 62 HG LEU 62 -10.181 1.416 -6.729 508 HD11 LEU 62 HD11 LEU 62 -12.247 1.733 -5.498 509 HD12 LEU 62 HD12 LEU 62 -11.501 3.291 -5.850 510 HD13 LEU 62 HD13 LEU 62 -11.382 2.602 -4.231 511 HD21 LEU 62 HD21 LEU 62 -8.226 2.451 -6.303 512 HD22 LEU 62 HD22 LEU 62 -8.430 2.351 -4.555 513 HD23 LEU 62 HD23 LEU 62 -9.255 3.615 -5.468 514 H THR 63 H THR 63 -13.169 -0.954 -6.360 515 HA THR 63 HA THR 63 -11.690 -1.857 -8.731 516 HB THR 63 HB THR 63 -12.670 -3.806 -7.564 517 HG1 THR 63 HG1 THR 63 -13.533 -3.024 -10.101 518 HG21 THR 63 HG21 THR 63 -15.044 -2.115 -7.504 519 HG22 THR 63 HG22 THR 63 -14.605 -3.503 -6.508 520 HG23 THR 63 HG23 THR 63 -15.343 -3.751 -8.090 521 H HIS 64 H HIS 64 -12.558 -1.224 -10.716 522 HA HIS 64 HA HIS 64 -14.067 1.172 -10.708 523 HB2 HIS 64 HB3 HIS 64 -12.959 -0.630 -12.808 524 HB3 HIS 64 HB2 HIS 64 -14.191 0.534 -13.282 525 HD1 HIS 64 HD1 HIS 64 -13.402 3.013 -11.798 526 HD2 HIS 64 HD2 HIS 64 -10.616 0.484 -13.561 527 HE1 HIS 64 HE1 HIS 64 -11.354 4.423 -12.168 528 HE2 HIS 64 HE2 HIS 64 -9.653 2.850 -13.157 529 H GLN 65 H GLN 65 -14.915 -2.191 -11.184 530 HA GLN 65 HA GLN 65 -17.361 -2.035 -12.415 531 HB2 GLN 65 HB3 GLN 65 -16.185 -3.889 -10.402 532 HB3 GLN 65 HB2 GLN 65 -17.909 -4.017 -10.724 533 HG2 GLN 65 HG3 GLN 65 -17.594 -4.942 -12.736 534 HG3 GLN 65 HG2 GLN 65 -16.234 -3.889 -13.122 535 HE21 GLN 65 HE21 GLN 65 -14.262 -4.379 -11.647 536 HE22 GLN 65 HE22 GLN 65 -13.836 -6.049 -11.535 537 H GLU 66 H GLU 66 -19.339 -1.321 -11.914 538 HA GLU 66 HA GLU 66 -19.690 0.144 -9.450 539 HB2 GLU 66 HB3 GLU 66 -21.820 0.855 -10.416 540 HB3 GLU 66 HB2 GLU 66 -20.505 1.077 -11.562 541 HG2 GLU 66 HG3 GLU 66 -21.343 -1.394 -12.249 542 HG3 GLU 66 HG2 GLU 66 -22.855 -0.677 -11.692 543 H ASP 67 H ASP 67 -20.900 -2.816 -10.910 544 HA ASP 67 HA ASP 67 -22.654 -3.275 -8.617 545 HB2 ASP 67 HB3 ASP 67 -23.051 -3.735 -11.271 546 HB3 ASP 67 HB2 ASP 67 -22.529 -5.326 -10.728 547 H TYR 68 H TYR 68 -19.609 -3.524 -8.631 548 HA TYR 68 HA TYR 68 -19.021 -6.294 -8.355 549 HB2 TYR 68 HB3 TYR 68 -17.308 -4.549 -8.834 550 HB3 TYR 68 HB2 TYR 68 -17.513 -3.942 -7.195 551 HD1 TYR 68 HD1 TYR 68 -16.707 -7.102 -9.015 552 HD2 TYR 68 HD2 TYR 68 -16.113 -4.737 -5.529 553 HE1 TYR 68 HE1 TYR 68 -15.027 -8.711 -8.217 554 HE2 TYR 68 HE2 TYR 68 -14.430 -6.338 -4.722 555 HH TYR 68 HH TYR 68 -13.898 -8.782 -5.072 556 H GLN 69 H GLN 69 -18.916 -7.581 -6.554 557 HA GLN 69 HA GLN 69 -19.920 -6.412 -4.043 558 HB2 GLN 69 HB3 GLN 69 -20.667 -9.005 -5.376 559 HB3 GLN 69 HB2 GLN 69 -20.923 -8.743 -3.656 560 HG2 GLN 69 HG3 GLN 69 -22.140 -7.211 -5.939 561 HG3 GLN 69 HG2 GLN 69 -22.959 -8.280 -4.801 562 HE21 GLN 69 HE21 GLN 69 -22.298 -5.132 -5.542 563 HE22 GLN 69 HE22 GLN 69 -22.616 -4.406 -4.007 564 H ALA 70 H ALA 70 -18.158 -6.306 -2.800 565 HA ALA 70 HA ALA 70 -16.354 -8.620 -2.685 566 HB1 ALA 70 HB1 ALA 70 -14.637 -7.220 -2.078 567 HB2 ALA 70 HB2 ALA 70 -15.718 -6.029 -1.354 568 HB3 ALA 70 HB3 ALA 70 -15.588 -6.151 -3.109 569 H GLN 71 H GLN 71 -17.292 -10.000 -1.269 570 HA GLN 71 HA GLN 71 -18.594 -9.190 1.121 571 HB2 GLN 71 HB3 GLN 71 -17.524 -11.894 0.297 572 HB3 GLN 71 HB2 GLN 71 -18.575 -11.604 1.676 573 HG2 GLN 71 HG3 GLN 71 -20.399 -11.581 0.408 574 HG3 GLN 71 HG2 GLN 71 -19.659 -10.511 -0.781 575 HE21 GLN 71 HE21 GLN 71 -18.482 -11.416 -2.499 576 HE22 GLN 71 HE22 GLN 71 -18.707 -13.061 -2.977 577 H GLY 72 H GLY 72 -17.743 -8.637 3.009 578 HA2 GLY 72 HA3 GLY 72 -16.289 -9.087 4.858 579 HA3 GLY 72 HA2 GLY 72 -15.094 -9.692 3.723 580 H ALA 73 H ALA 73 -15.499 -7.337 1.906 581 HA ALA 73 HA ALA 73 -14.232 -5.283 3.600 582 HB1 ALA 73 HB1 ALA 73 -12.702 -4.766 1.762 583 HB2 ALA 73 HB2 ALA 73 -13.393 -6.085 0.817 584 HB3 ALA 73 HB3 ALA 73 -12.518 -6.433 2.309 585 H VAL 74 H VAL 74 -14.164 -3.110 2.455 586 HA VAL 74 HA VAL 74 -16.844 -2.488 1.551 587 HB VAL 74 HB VAL 74 -14.662 -0.441 1.627 588 HG11 VAL 74 HG11 VAL 74 -16.792 0.679 2.802 589 HG12 VAL 74 HG12 VAL 74 -17.610 -0.536 1.819 590 HG13 VAL 74 HG13 VAL 74 -16.557 0.654 1.054 591 HG21 VAL 74 HG21 VAL 74 -14.133 -1.210 3.704 592 HG22 VAL 74 HG22 VAL 74 -15.708 -1.966 3.948 593 HG23 VAL 74 HG23 VAL 74 -15.528 -0.222 4.137 594 H VAL 75 H VAL 75 -17.442 -1.813 -0.462 595 HA VAL 75 HA VAL 75 -15.367 -2.000 -2.545 596 HB VAL 75 HB VAL 75 -18.335 -2.464 -2.844 597 HG11 VAL 75 HG11 VAL 75 -17.575 -3.456 -5.052 598 HG12 VAL 75 HG12 VAL 75 -16.035 -2.643 -4.775 599 HG13 VAL 75 HG13 VAL 75 -17.516 -1.698 -4.922 600 HG21 VAL 75 HG21 VAL 75 -17.879 -4.449 -1.924 601 HG22 VAL 75 HG22 VAL 75 -16.137 -4.198 -2.037 602 HG23 VAL 75 HG23 VAL 75 -17.031 -4.816 -3.425 603 H VAL 76 H VAL 76 -14.939 -0.334 -3.788 604 HA VAL 76 HA VAL 76 -16.910 1.779 -4.192 605 HB VAL 76 HB VAL 76 -15.303 3.564 -3.742 606 HG11 VAL 76 HG11 VAL 76 -15.173 2.001 -1.229 607 HG12 VAL 76 HG12 VAL 76 -16.769 2.292 -1.921 608 HG13 VAL 76 HG13 VAL 76 -15.723 3.652 -1.512 609 HG21 VAL 76 HG21 VAL 76 -13.120 3.222 -3.541 610 HG22 VAL 76 HG22 VAL 76 -13.401 1.513 -3.875 611 HG23 VAL 76 HG23 VAL 76 -13.366 2.092 -2.209 612 H HIS 77 H HIS 77 -15.882 3.433 -5.861 613 HA HIS 77 HA HIS 77 -14.212 1.949 -7.766 614 HB2 HIS 77 HB3 HIS 77 -16.425 3.536 -8.940 615 HB3 HIS 77 HB2 HIS 77 -15.697 2.029 -9.491 616 HD1 HIS 77 HD1 HIS 77 -16.266 0.049 -7.408 617 HD2 HIS 77 HD2 HIS 77 -19.006 3.031 -8.339 618 HE1 HIS 77 HE1 HIS 77 -18.487 -0.807 -6.602 619 HE2 HIS 77 HE2 HIS 77 -20.144 0.980 -7.247 620 H ASP 78 H ASP 78 -14.989 4.945 -6.284 621 HA ASP 78 HA ASP 78 -13.019 6.261 -8.030 622 HB2 ASP 78 HB3 ASP 78 -15.768 7.106 -7.340 623 HB3 ASP 78 HB2 ASP 78 -14.540 8.367 -7.268 624 H VAL 79 H VAL 79 -11.819 7.993 -7.057 625 HA VAL 79 HA VAL 79 -10.912 7.423 -4.469 626 HB VAL 79 HB VAL 79 -9.848 9.760 -4.699 627 HG11 VAL 79 HG11 VAL 79 -8.784 7.516 -5.128 628 HG12 VAL 79 HG12 VAL 79 -8.068 8.882 -5.984 629 HG13 VAL 79 HG13 VAL 79 -9.143 7.773 -6.836 630 HG21 VAL 79 HG21 VAL 79 -10.582 9.429 -7.586 631 HG22 VAL 79 HG22 VAL 79 -9.847 10.819 -6.788 632 HG23 VAL 79 HG23 VAL 79 -11.538 10.422 -6.486 633 H ALA 80 H ALA 80 -13.200 9.781 -5.710 634 HA ALA 80 HA ALA 80 -13.510 11.255 -3.312 635 HB1 ALA 80 HB1 ALA 80 -15.719 11.936 -4.404 636 HB2 ALA 80 HB2 ALA 80 -15.204 10.953 -5.774 637 HB3 ALA 80 HB3 ALA 80 -14.233 12.335 -5.265 638 H ALA 81 H ALA 81 -15.269 8.524 -4.725 639 HA ALA 81 HA ALA 81 -17.336 8.296 -2.886 640 HB1 ALA 81 HB1 ALA 81 -17.734 6.202 -3.766 641 HB2 ALA 81 HB2 ALA 81 -16.018 5.834 -3.946 642 HB3 ALA 81 HB3 ALA 81 -16.803 6.951 -5.063 643 H VAL 82 H VAL 82 -14.392 6.284 -2.871 644 HA VAL 82 HA VAL 82 -14.672 5.225 -0.337 645 HB VAL 82 HB VAL 82 -12.960 4.662 -2.188 646 HG11 VAL 82 HG11 VAL 82 -10.963 6.222 -0.685 647 HG12 VAL 82 HG12 VAL 82 -12.013 7.136 -1.766 648 HG13 VAL 82 HG13 VAL 82 -11.033 5.815 -2.400 649 HG21 VAL 82 HG21 VAL 82 -13.156 3.529 0.010 650 HG22 VAL 82 HG22 VAL 82 -11.982 4.673 0.659 651 HG23 VAL 82 HG23 VAL 82 -11.511 3.560 -0.625 652 H PHE 83 H PHE 83 -13.579 8.386 -1.304 653 HA PHE 83 HA PHE 83 -12.252 9.115 1.076 654 HB2 PHE 83 HB3 PHE 83 -13.144 10.428 -1.363 655 HB3 PHE 83 HB2 PHE 83 -13.362 11.463 0.043 656 HD1 PHE 83 HD2 PHE 83 -10.663 8.995 -0.030 657 HD2 PHE 83 HD1 PHE 83 -11.731 13.048 -0.775 658 HE1 PHE 83 HE2 PHE 83 -8.281 9.605 -0.109 659 HE2 PHE 83 HE1 PHE 83 -9.350 13.664 -0.856 660 HZ PHE 83 HZ PHE 83 -7.622 11.942 -0.522 661 H ALA 84 H ALA 84 -15.623 9.509 0.024 662 HA ALA 84 HA ALA 84 -16.509 10.910 2.297 663 HB1 ALA 84 HB1 ALA 84 -18.131 8.995 0.621 664 HB2 ALA 84 HB2 ALA 84 -17.805 10.672 0.185 665 HB3 ALA 84 HB3 ALA 84 -18.743 10.304 1.632 666 H TYR 85 H TYR 85 -16.131 7.502 1.595 667 HA TYR 85 HA TYR 85 -17.368 6.524 3.945 668 HB2 TYR 85 HB3 TYR 85 -17.008 4.582 2.883 669 HB3 TYR 85 HB2 TYR 85 -16.017 5.413 1.694 670 HD1 TYR 85 HD1 TYR 85 -15.760 3.971 5.136 671 HD2 TYR 85 HD2 TYR 85 -13.838 4.747 1.427 672 HE1 TYR 85 HE1 TYR 85 -13.788 2.715 5.902 673 HE2 TYR 85 HE2 TYR 85 -11.859 3.491 2.181 674 HH TYR 85 HH TYR 85 -11.304 2.684 5.353 675 H ALA 86 H ALA 86 -13.881 6.797 3.165 676 HA ALA 86 HA ALA 86 -12.788 6.318 5.595 677 HB1 ALA 86 HB1 ALA 86 -10.936 6.893 4.510 678 HB2 ALA 86 HB2 ALA 86 -11.419 8.589 4.529 679 HB3 ALA 86 HB3 ALA 86 -11.927 7.542 3.204 680 H LYS 87 H LYS 87 -14.434 9.265 4.612 681 HA LYS 87 HA LYS 87 -13.719 10.769 6.935 682 HB2 LYS 87 HB3 LYS 87 -14.989 11.312 4.521 683 HB3 LYS 87 HB2 LYS 87 -16.271 11.497 5.709 684 HG2 LYS 87 HG3 LYS 87 -15.516 13.532 6.135 685 HG3 LYS 87 HG2 LYS 87 -14.037 12.814 6.775 686 HD2 LYS 87 HD3 LYS 87 -13.623 12.708 4.066 687 HD3 LYS 87 HD2 LYS 87 -14.508 14.223 4.255 688 HE2 LYS 87 HE3 LYS 87 -12.617 15.195 4.896 689 HE3 LYS 87 HE2 LYS 87 -12.608 14.162 6.324 690 HZ1 LYS 87 HZ1 LYS 87 -10.665 14.191 4.504 691 HZ2 LYS 87 HZ2 LYS 87 -11.619 12.938 3.887 692 HZ3 LYS 87 HZ3 LYS 87 -11.021 12.845 5.466 693 H GLN 88 H GLN 88 -16.503 8.875 5.933 694 HA GLN 88 HA GLN 88 -18.145 9.255 8.143 695 HB2 GLN 88 HB3 GLN 88 -17.861 7.022 6.154 696 HB3 GLN 88 HB2 GLN 88 -19.035 6.937 7.452 697 HG2 GLN 88 HG3 GLN 88 -19.108 9.441 5.956 698 HG3 GLN 88 HG2 GLN 88 -19.477 8.011 4.993 699 HE21 GLN 88 HE21 GLN 88 -20.779 10.360 6.880 700 HE22 GLN 88 HE22 GLN 88 -22.252 9.583 7.339 701 H HIS 89 H HIS 89 -15.242 7.425 7.837 702 HA HIS 89 HA HIS 89 -15.783 6.041 10.374 703 HB2 HIS 89 HB3 HIS 89 -14.248 5.356 7.952 704 HB3 HIS 89 HB2 HIS 89 -13.459 4.942 9.472 705 HD1 HIS 89 HD1 HIS 89 -15.849 3.992 11.115 706 HD2 HIS 89 HD2 HIS 89 -15.236 2.971 7.136 707 HE1 HIS 89 HE1 HIS 89 -17.135 1.859 10.763 708 HE2 HIS 89 HE2 HIS 89 -16.828 1.313 8.323 709 HA PRO 90 HA PRO 90 -12.745 9.407 11.419 710 HB2 PRO 90 HB3 PRO 90 -13.989 10.286 13.641 711 HB3 PRO 90 HB2 PRO 90 -14.455 10.832 12.025 712 HG2 PRO 90 HG3 PRO 90 -15.719 8.733 13.751 713 HG3 PRO 90 HG2 PRO 90 -16.495 10.015 12.802 714 HD2 PRO 90 HD3 PRO 90 -16.311 7.448 11.935 715 HD3 PRO 90 HD2 PRO 90 -16.315 8.840 10.834 716 H ASP 91 H ASP 91 -13.765 6.490 12.745 717 HA ASP 91 HA ASP 91 -11.993 6.697 15.067 718 HB2 ASP 91 HB3 ASP 91 -14.324 5.021 14.360 719 HB3 ASP 91 HB2 ASP 91 -13.049 4.209 15.264 720 H GLN 92 H GLN 92 -11.566 6.025 11.937 721 HA GLN 92 HA GLN 92 -9.324 4.249 12.500 722 HB2 GLN 92 HB3 GLN 92 -11.508 3.636 10.510 723 HB3 GLN 92 HB2 GLN 92 -9.928 2.866 10.469 724 HG2 GLN 92 HG3 GLN 92 -10.313 1.657 12.381 725 HG3 GLN 92 HG2 GLN 92 -11.514 2.795 12.988 726 HE21 GLN 92 HE21 GLN 92 -13.557 2.217 12.821 727 HE22 GLN 92 HE22 GLN 92 -14.188 1.009 11.759 728 H GLU 93 H GLU 93 -7.849 4.064 10.603 729 HA GLU 93 HA GLU 93 -7.895 6.551 9.022 730 HB2 GLU 93 HB3 GLU 93 -5.708 5.136 10.456 731 HB3 GLU 93 HB2 GLU 93 -5.302 5.908 8.929 732 HG2 GLU 93 HG3 GLU 93 -5.004 7.769 10.093 733 HG3 GLU 93 HG2 GLU 93 -6.758 7.836 10.254 734 H LEU 94 H LEU 94 -6.806 6.423 6.906 735 HA LEU 94 HA LEU 94 -7.397 3.848 5.633 736 HB2 LEU 94 HB3 LEU 94 -7.929 6.528 4.924 737 HB3 LEU 94 HB2 LEU 94 -6.759 5.933 3.761 738 HG LEU 94 HG LEU 94 -8.268 4.018 3.279 739 HD11 LEU 94 HD11 LEU 94 -9.915 5.397 5.347 740 HD12 LEU 94 HD12 LEU 94 -9.609 3.676 5.113 741 HD13 LEU 94 HD13 LEU 94 -10.712 4.530 4.034 742 HD21 LEU 94 HD21 LEU 94 -10.169 5.671 2.378 743 HD22 LEU 94 HD22 LEU 94 -8.573 5.546 1.638 744 HD23 LEU 94 HD23 LEU 94 -8.920 6.855 2.767 745 H VAL 95 H VAL 95 -5.865 2.628 4.707 746 HA VAL 95 HA VAL 95 -3.208 3.786 4.248 747 HB VAL 95 HB VAL 95 -3.592 1.110 5.590 748 HG11 VAL 95 HG11 VAL 95 -1.243 1.098 5.883 749 HG12 VAL 95 HG12 VAL 95 -1.099 2.780 5.373 750 HG13 VAL 95 HG13 VAL 95 -1.530 1.536 4.199 751 HG21 VAL 95 HG21 VAL 95 -2.645 2.307 7.608 752 HG22 VAL 95 HG22 VAL 95 -4.314 2.695 7.191 753 HG23 VAL 95 HG23 VAL 95 -3.018 3.816 6.774 754 H ILE 96 H ILE 96 -2.726 3.470 2.188 755 HA ILE 96 HA ILE 96 -4.013 1.404 0.637 756 HB ILE 96 HB ILE 96 -1.770 3.072 -0.432 757 HG12 ILE 96 HG13 ILE 96 -3.089 4.720 0.730 758 HG13 ILE 96 HG12 ILE 96 -3.454 4.844 -0.987 759 HG21 ILE 96 HG21 ILE 96 -3.554 3.065 -2.365 760 HG22 ILE 96 HG22 ILE 96 -4.157 1.654 -1.495 761 HG23 ILE 96 HG23 ILE 96 -2.497 1.680 -2.091 762 HD11 ILE 96 HD11 ILE 96 -5.602 4.361 -0.670 763 HD12 ILE 96 HD12 ILE 96 -5.286 4.703 1.031 764 HD13 ILE 96 HD13 ILE 96 -5.239 3.042 0.442 765 H ALA 97 H ALA 97 -3.218 -0.550 0.195 766 HA ALA 97 HA ALA 97 -0.394 -1.072 0.851 767 HB1 ALA 97 HB1 ALA 97 -2.805 -2.871 0.980 768 HB2 ALA 97 HB2 ALA 97 -1.776 -2.333 2.308 769 HB3 ALA 97 HB3 ALA 97 -1.148 -3.462 1.108 770 H GLY 98 H GLY 98 -2.847 -1.296 -1.605 771 HA2 GLY 98 HA3 GLY 98 -1.118 -1.471 -3.748 772 HA3 GLY 98 HA2 GLY 98 -1.474 -3.133 -3.303 773 H GLY 99 H GLY 99 -3.905 -2.300 -5.897 774 HA2 GLY 99 HA3 GLY 99 -1.157 -3.019 -5.403 775 HA3 GLY 99 HA2 GLY 99 -1.985 -3.035 -6.950 776 H ALA 100 H ALA 100 -0.020 -2.139 -7.823 777 HA ALA 100 HA ALA 100 1.036 0.349 -7.030 778 HB1 ALA 100 HB1 ALA 100 1.875 0.290 -9.521 779 HB2 ALA 100 HB2 ALA 100 1.280 -1.369 -9.449 780 HB3 ALA 100 HB3 ALA 100 2.520 -0.828 -8.318 781 H GLN 101 H GLN 101 -1.509 -0.532 -9.295 782 HA GLN 101 HA GLN 101 -1.786 2.003 -10.514 783 HB2 GLN 101 HB3 GLN 101 -3.158 -0.544 -10.560 784 HB3 GLN 101 HB2 GLN 101 -4.310 0.785 -10.555 785 HG2 GLN 101 HG3 GLN 101 -2.008 0.580 -12.477 786 HG3 GLN 101 HG2 GLN 101 -3.631 -0.022 -12.814 787 HE21 GLN 101 HE21 GLN 101 -5.357 1.733 -12.211 788 HE22 GLN 101 HE22 GLN 101 -5.054 3.291 -12.892 789 H ILE 102 H ILE 102 -3.078 0.599 -7.580 790 HA ILE 102 HA ILE 102 -5.074 2.544 -7.087 791 HB ILE 102 HB ILE 102 -3.594 0.992 -4.969 792 HG12 ILE 102 HG13 ILE 102 -4.328 -0.568 -6.706 793 HG13 ILE 102 HG12 ILE 102 -5.303 -0.761 -5.254 794 HG21 ILE 102 HG21 ILE 102 -5.805 1.127 -3.827 795 HG22 ILE 102 HG22 ILE 102 -6.350 2.197 -5.118 796 HG23 ILE 102 HG23 ILE 102 -5.021 2.688 -4.067 797 HD11 ILE 102 HD11 ILE 102 -6.444 -0.746 -7.569 798 HD12 ILE 102 HD12 ILE 102 -6.246 1.003 -7.466 799 HD13 ILE 102 HD13 ILE 102 -7.178 0.147 -6.238 800 H PHE 103 H PHE 103 -1.658 2.317 -6.251 801 HA PHE 103 HA PHE 103 -1.538 4.489 -4.477 802 HB2 PHE 103 HB3 PHE 103 0.567 3.346 -6.324 803 HB3 PHE 103 HB2 PHE 103 0.896 4.552 -5.085 804 HD1 PHE 103 HD1 PHE 103 -0.821 3.529 -2.888 805 HD2 PHE 103 HD2 PHE 103 1.763 1.493 -5.588 806 HE1 PHE 103 HE1 PHE 103 -0.507 1.738 -1.230 807 HE2 PHE 103 HE2 PHE 103 2.080 -0.303 -3.936 808 HZ PHE 103 HZ PHE 103 0.945 -0.181 -1.754 809 H THR 104 H THR 104 -1.339 4.296 -7.989 810 HA THR 104 HA THR 104 -0.509 6.897 -8.544 811 HB THR 104 HB THR 104 -2.428 5.202 -10.152 812 HG1 THR 104 HG1 THR 104 -0.530 4.077 -9.810 813 HG21 THR 104 HG21 THR 104 -1.699 7.793 -10.649 814 HG22 THR 104 HG22 THR 104 -2.263 6.626 -11.846 815 HG23 THR 104 HG23 THR 104 -0.534 6.865 -11.593 816 H ALA 105 H ALA 105 -3.835 5.624 -8.319 817 HA ALA 105 HA ALA 105 -5.173 8.019 -8.799 818 HB1 ALA 105 HB1 ALA 105 -5.848 5.412 -7.664 819 HB2 ALA 105 HB2 ALA 105 -6.752 6.430 -8.784 820 HB3 ALA 105 HB3 ALA 105 -6.839 6.735 -7.049 821 H PHE 106 H PHE 106 -4.515 6.562 -5.585 822 HA PHE 106 HA PHE 106 -5.317 8.880 -4.192 823 HB2 PHE 106 HB3 PHE 106 -3.774 6.416 -3.414 824 HB3 PHE 106 HB2 PHE 106 -4.070 7.721 -2.270 825 HD1 PHE 106 HD2 PHE 106 -5.899 5.516 -4.652 826 HD2 PHE 106 HD1 PHE 106 -5.964 7.641 -0.966 827 HE1 PHE 106 HE2 PHE 106 -8.101 4.550 -4.141 828 HE2 PHE 106 HE1 PHE 106 -8.167 6.677 -0.446 829 HZ PHE 106 HZ PHE 106 -9.238 5.129 -2.034 830 H LYS 107 H LYS 107 -2.468 8.190 -5.924 831 HA LYS 107 HA LYS 107 -0.405 9.274 -4.517 832 HB2 LYS 107 HB3 LYS 107 0.717 9.462 -6.502 833 HB3 LYS 107 HB2 LYS 107 -0.614 8.442 -7.025 834 HG2 LYS 107 HG3 LYS 107 -1.790 10.487 -7.818 835 HG3 LYS 107 HG2 LYS 107 -0.343 11.415 -7.417 836 HD2 LYS 107 HD3 LYS 107 0.948 9.923 -8.945 837 HD3 LYS 107 HD2 LYS 107 -0.578 9.183 -9.432 838 HE2 LYS 107 HE3 LYS 107 -0.515 10.750 -11.052 839 HE3 LYS 107 HE2 LYS 107 -1.176 11.786 -9.787 840 HZ1 LYS 107 HZ1 LYS 107 1.710 11.527 -10.442 841 HZ2 LYS 107 HZ2 LYS 107 1.038 12.565 -9.289 842 HZ3 LYS 107 HZ3 LYS 107 0.712 12.803 -10.931 843 H ASP 108 H ASP 108 -2.989 11.025 -6.141 844 HA ASP 108 HA ASP 108 -1.876 13.601 -5.381 845 HB2 ASP 108 HB3 ASP 108 -3.171 13.008 -7.579 846 HB3 ASP 108 HB2 ASP 108 -4.602 13.248 -6.581 847 H ASP 109 H ASP 109 -4.565 11.487 -4.544 848 HA ASP 109 HA ASP 109 -5.612 13.368 -2.598 849 HB2 ASP 109 HB3 ASP 109 -6.528 10.900 -3.883 850 HB3 ASP 109 HB2 ASP 109 -6.968 11.015 -2.182 851 H VAL 110 H VAL 110 -2.950 11.611 -2.444 852 HA VAL 110 HA VAL 110 -3.379 10.254 0.077 853 HB VAL 110 HB VAL 110 -1.897 9.255 -1.597 854 HG11 VAL 110 HG11 VAL 110 -0.998 11.776 -2.065 855 HG12 VAL 110 HG12 VAL 110 -0.188 10.305 -2.603 856 HG13 VAL 110 HG13 VAL 110 0.328 11.103 -1.118 857 HG21 VAL 110 HG21 VAL 110 -1.543 8.746 0.769 858 HG22 VAL 110 HG22 VAL 110 -0.428 10.106 0.897 859 HG23 VAL 110 HG23 VAL 110 -0.022 8.728 -0.125 860 H ASP 111 H ASP 111 -2.192 10.683 1.996 861 HA ASP 111 HA ASP 111 -1.311 13.483 2.258 862 HB2 ASP 111 HB3 ASP 111 -3.534 12.666 3.399 863 HB3 ASP 111 HB2 ASP 111 -2.434 11.972 4.586 864 H THR 112 H THR 112 -0.879 10.154 3.371 865 HA THR 112 HA THR 112 1.766 10.924 4.412 866 HB THR 112 HB THR 112 0.122 8.528 5.240 867 HG1 THR 112 HG1 THR 112 -0.527 9.689 6.959 868 HG21 THR 112 HG21 THR 112 2.787 9.537 6.007 869 HG22 THR 112 HG22 THR 112 2.156 7.891 5.976 870 HG23 THR 112 HG23 THR 112 1.741 8.970 7.308 871 H LEU 113 H LEU 113 3.499 9.366 4.131 872 HA LEU 113 HA LEU 113 3.080 7.387 2.016 873 HB2 LEU 113 HB3 LEU 113 4.183 9.876 1.527 874 HB3 LEU 113 HB2 LEU 113 5.585 8.843 1.718 875 HG LEU 113 HG LEU 113 4.897 7.443 -0.101 876 HD11 LEU 113 HD11 LEU 113 2.767 7.159 -0.646 877 HD12 LEU 113 HD12 LEU 113 2.657 8.844 -1.156 878 HD13 LEU 113 HD13 LEU 113 2.304 8.403 0.514 879 HD21 LEU 113 HD21 LEU 113 6.046 9.084 -1.134 880 HD22 LEU 113 HD22 LEU 113 5.056 10.363 -0.430 881 HD23 LEU 113 HD23 LEU 113 4.467 9.460 -1.827 882 H LEU 114 H LEU 114 3.771 5.520 2.823 883 HA LEU 114 HA LEU 114 6.274 5.497 4.380 884 HB2 LEU 114 HB3 LEU 114 3.819 3.782 4.787 885 HB3 LEU 114 HB2 LEU 114 5.359 3.504 5.577 886 HG LEU 114 HG LEU 114 4.172 6.200 5.908 887 HD11 LEU 114 HD11 LEU 114 2.949 3.688 6.980 888 HD12 LEU 114 HD12 LEU 114 2.163 5.106 6.285 889 HD13 LEU 114 HD13 LEU 114 2.873 5.192 7.897 890 HD21 LEU 114 HD21 LEU 114 6.344 5.413 6.898 891 HD22 LEU 114 HD22 LEU 114 5.402 4.317 7.909 892 HD23 LEU 114 HD23 LEU 114 5.180 6.061 8.054 893 H VAL 115 H VAL 115 7.784 4.672 3.074 894 HA VAL 115 HA VAL 115 7.041 2.323 1.452 895 HB VAL 115 HB VAL 115 8.621 3.029 -0.252 896 HG11 VAL 115 HG11 VAL 115 6.866 5.385 0.376 897 HG12 VAL 115 HG12 VAL 115 6.218 3.843 -0.185 898 HG13 VAL 115 HG13 VAL 115 7.333 4.754 -1.203 899 HG21 VAL 115 HG21 VAL 115 9.725 5.190 -0.169 900 HG22 VAL 115 HG22 VAL 115 10.206 4.205 1.213 901 HG23 VAL 115 HG23 VAL 115 9.032 5.505 1.422 902 H THR 116 H THR 116 8.387 0.619 1.352 903 HA THR 116 HA THR 116 10.719 0.651 3.148 904 HB THR 116 HB THR 116 8.943 -1.616 2.219 905 HG1 THR 116 HG1 THR 116 8.427 -1.750 4.389 906 HG21 THR 116 HG21 THR 116 11.481 -1.745 3.818 907 HG22 THR 116 HG22 THR 116 11.102 -2.580 2.311 908 HG23 THR 116 HG23 THR 116 10.268 -3.025 3.801 909 H ARG 117 H ARG 117 12.360 1.276 1.812 910 HA ARG 117 HA ARG 117 12.577 0.198 -0.859 911 HB2 ARG 117 HB3 ARG 117 13.173 2.563 -0.256 912 HB3 ARG 117 HB2 ARG 117 14.563 1.929 0.614 913 HG2 ARG 117 HG3 ARG 117 14.942 0.750 -1.768 914 HG3 ARG 117 HG2 ARG 117 14.108 2.218 -2.281 915 HD2 ARG 117 HD3 ARG 117 16.308 2.493 -0.307 916 HD3 ARG 117 HD2 ARG 117 16.745 2.118 -1.973 917 HE ARG 117 HE ARG 117 15.044 4.197 -2.244 918 HH11 ARG 117 HH11 ARG 117 17.897 3.701 -0.298 919 HH12 ARG 117 HH12 ARG 117 18.343 5.374 -0.302 920 HH21 ARG 117 HH21 ARG 117 15.629 6.398 -2.251 921 HH22 ARG 117 HH22 ARG 117 17.055 6.906 -1.410 922 H LEU 118 H LEU 118 13.218 -1.839 -1.042 923 HA LEU 118 HA LEU 118 14.971 -3.137 0.790 924 HB2 LEU 118 HB3 LEU 118 13.449 -3.829 -1.609 925 HB3 LEU 118 HB2 LEU 118 14.987 -4.665 -1.513 926 HG LEU 118 HG LEU 118 14.338 -5.454 0.772 927 HD11 LEU 118 HD11 LEU 118 12.025 -3.759 0.168 928 HD12 LEU 118 HD12 LEU 118 12.679 -4.282 1.721 929 HD13 LEU 118 HD13 LEU 118 11.622 -5.355 0.803 930 HD21 LEU 118 HD21 LEU 118 13.750 -6.490 -1.672 931 HD22 LEU 118 HD22 LEU 118 12.164 -6.472 -0.901 932 HD23 LEU 118 HD23 LEU 118 13.507 -7.321 -0.136 933 H ALA 119 H ALA 119 17.042 -4.134 0.160 934 HA ALA 119 HA ALA 119 18.713 -2.189 -1.195 935 HB1 ALA 119 HB1 ALA 119 20.125 -4.559 -0.385 936 HB2 ALA 119 HB2 ALA 119 19.089 -3.982 0.921 937 HB3 ALA 119 HB3 ALA 119 20.285 -2.903 0.203 938 H GLY 120 H GLY 120 17.629 -5.511 -1.626 939 HA2 GLY 120 HA3 GLY 120 19.295 -6.086 -3.856 940 HA3 GLY 120 HA2 GLY 120 17.868 -6.987 -3.369 941 H SER 121 H SER 121 18.852 -6.157 -6.025 942 HA SER 121 HA SER 121 16.664 -4.409 -6.901 943 HB2 SER 121 HB3 SER 121 17.971 -3.755 -8.687 944 HB3 SER 121 HB2 SER 121 19.224 -4.106 -7.497 945 HG SER 121 HG SER 121 19.796 -5.855 -8.584 946 H PHE 122 H PHE 122 14.901 -5.407 -7.597 947 HA PHE 122 HA PHE 122 15.190 -8.020 -8.925 948 HB2 PHE 122 HB3 PHE 122 12.808 -6.911 -7.426 949 HB3 PHE 122 HB2 PHE 122 12.867 -8.475 -8.229 950 HD1 PHE 122 HD2 PHE 122 14.848 -6.535 -5.728 951 HD2 PHE 122 HD1 PHE 122 13.260 -10.302 -6.910 952 HE1 PHE 122 HE2 PHE 122 15.737 -7.551 -3.671 953 HE2 PHE 122 HE1 PHE 122 14.145 -11.325 -4.854 954 HZ PHE 122 HZ PHE 122 15.387 -9.949 -3.232 955 H GLU 123 H GLU 123 13.497 -8.499 -10.563 956 HA GLU 123 HA GLU 123 12.606 -6.085 -11.987 957 HB2 GLU 123 HB3 GLU 123 13.258 -7.066 -14.117 958 HB3 GLU 123 HB2 GLU 123 14.654 -6.932 -13.056 959 HG2 GLU 123 HG3 GLU 123 13.633 -9.463 -12.549 960 HG3 GLU 123 HG2 GLU 123 13.490 -9.262 -14.295 961 H GLY 124 H GLY 124 10.585 -6.164 -12.805 962 HA2 GLY 124 HA3 GLY 124 9.252 -8.710 -13.224 963 HA3 GLY 124 HA2 GLY 124 8.604 -7.733 -11.915 964 H ASP 125 H ASP 125 6.733 -6.926 -12.615 965 HA ASP 125 HA ASP 125 6.769 -5.266 -15.015 966 HB2 ASP 125 HB3 ASP 125 5.820 -7.784 -15.267 967 HB3 ASP 125 HB2 ASP 125 4.355 -6.960 -14.742 968 H THR 126 H THR 126 6.637 -4.789 -12.118 969 HA THR 126 HA THR 126 4.298 -3.058 -12.150 970 HB THR 126 HB THR 126 4.779 -4.835 -9.764 971 HG1 THR 126 HG1 THR 126 3.028 -6.079 -10.564 972 HG21 THR 126 HG21 THR 126 2.976 -3.922 -8.839 973 HG22 THR 126 HG22 THR 126 2.081 -3.908 -10.358 974 HG23 THR 126 HG23 THR 126 3.223 -2.613 -9.994 975 H LYS 127 H LYS 127 5.336 -1.172 -11.955 976 HA LYS 127 HA LYS 127 7.281 -0.883 -9.760 977 HB2 LYS 127 HB3 LYS 127 7.379 -0.069 -12.565 978 HB3 LYS 127 HB2 LYS 127 7.739 1.250 -11.459 979 HG2 LYS 127 HG3 LYS 127 9.778 0.157 -12.111 980 HG3 LYS 127 HG2 LYS 127 9.470 -0.145 -10.399 981 HD2 LYS 127 HD3 LYS 127 9.882 -2.289 -10.940 982 HD3 LYS 127 HD2 LYS 127 8.222 -2.270 -11.540 983 HE2 LYS 127 HE3 LYS 127 8.872 -2.423 -13.680 984 HE3 LYS 127 HE2 LYS 127 10.186 -1.268 -13.461 985 HZ1 LYS 127 HZ1 LYS 127 10.211 -4.172 -13.258 986 HZ2 LYS 127 HZ2 LYS 127 11.165 -3.338 -12.138 987 HZ3 LYS 127 HZ3 LYS 127 11.416 -3.113 -13.796 988 H MET 128 H MET 128 7.437 1.382 -8.914 989 HA MET 128 HA MET 128 4.842 2.266 -8.111 990 HB2 MET 128 HB3 MET 128 6.878 2.314 -6.658 991 HB3 MET 128 HB2 MET 128 7.504 3.620 -7.654 992 HG2 MET 128 HG3 MET 128 6.487 4.433 -5.589 993 HG3 MET 128 HG2 MET 128 5.660 5.041 -7.019 994 HE1 MET 128 HE1 MET 128 4.390 5.726 -4.900 995 HE2 MET 128 HE2 MET 128 3.179 4.740 -4.081 996 HE3 MET 128 HE3 MET 128 2.842 5.400 -5.681 997 H ILE 129 H ILE 129 4.194 4.582 -8.218 998 HA ILE 129 HA ILE 129 4.754 5.659 -10.898 999 HB ILE 129 HB ILE 129 2.573 6.771 -10.772 1000 HG12 ILE 129 HG13 ILE 129 1.062 5.744 -8.853 1001 HG13 ILE 129 HG12 ILE 129 2.605 5.607 -8.019 1002 HG21 ILE 129 HG21 ILE 129 1.642 4.104 -10.122 1003 HG22 ILE 129 HG22 ILE 129 3.062 4.074 -11.169 1004 HG23 ILE 129 HG23 ILE 129 1.622 4.965 -11.662 1005 HD11 ILE 129 HD11 ILE 129 2.865 7.866 -7.844 1006 HD12 ILE 129 HD12 ILE 129 1.110 7.727 -7.744 1007 HD13 ILE 129 HD13 ILE 129 1.873 8.204 -9.262 1008 HA PRO 130 HA PRO 130 6.583 9.384 -9.427 1009 HB2 PRO 130 HB3 PRO 130 4.562 10.872 -11.029 1010 HB3 PRO 130 HB2 PRO 130 6.325 10.984 -11.056 1011 HG2 PRO 130 HG3 PRO 130 5.023 9.734 -13.009 1012 HG3 PRO 130 HG2 PRO 130 6.557 9.096 -12.388 1013 HD2 PRO 130 HD3 PRO 130 3.766 8.156 -11.880 1014 HD3 PRO 130 HD2 PRO 130 5.257 7.212 -12.081 1015 H LEU 131 H LEU 131 6.312 11.038 -7.925 1016 HA LEU 131 HA LEU 131 3.609 11.581 -6.942 1017 HB2 LEU 131 HB3 LEU 131 5.695 11.142 -4.875 1018 HB3 LEU 131 HB2 LEU 131 3.963 10.898 -4.785 1019 HG LEU 131 HG LEU 131 5.570 9.047 -6.489 1020 HD11 LEU 131 HD11 LEU 131 5.258 8.524 -3.560 1021 HD12 LEU 131 HD12 LEU 131 6.664 9.388 -4.179 1022 HD13 LEU 131 HD13 LEU 131 6.328 7.746 -4.726 1023 HD21 LEU 131 HD21 LEU 131 3.026 9.081 -6.261 1024 HD22 LEU 131 HD22 LEU 131 3.286 8.444 -4.637 1025 HD23 LEU 131 HD23 LEU 131 3.840 7.532 -6.041 1026 H ASN 132 H ASN 132 3.395 13.544 -5.788 1027 HA ASN 132 HA ASN 132 5.227 15.587 -6.597 1028 HB2 ASN 132 HB3 ASN 132 2.569 15.446 -5.463 1029 HB3 ASN 132 HB2 ASN 132 3.536 16.647 -4.613 1030 HD21 ASN 132 HD21 ASN 132 5.028 17.836 -6.385 1031 HD22 ASN 132 HD22 ASN 132 4.103 18.543 -7.661 1032 H TRP 133 H TRP 133 7.096 14.529 -5.565 1033 HA TRP 133 HA TRP 133 7.454 14.153 -2.861 1034 HB2 TRP 133 HB3 TRP 133 9.469 14.994 -4.945 1035 HB3 TRP 133 HB2 TRP 133 9.889 14.433 -3.328 1036 HD1 TRP 133 HD1 TRP 133 8.580 13.179 -6.688 1037 HE1 TRP 133 HE1 TRP 133 8.700 10.607 -6.719 1038 HE3 TRP 133 HE3 TRP 133 9.850 12.364 -1.802 1039 HZ2 TRP 133 HZ2 TRP 133 9.266 8.513 -4.914 1040 HZ3 TRP 133 HZ3 TRP 133 10.163 10.048 -1.035 1041 HH2 TRP 133 HH2 TRP 133 9.876 8.163 -2.560 1042 H ASP 134 H ASP 134 8.078 17.186 -4.699 1043 HA ASP 134 HA ASP 134 9.151 18.653 -2.609 1044 HB2 ASP 134 HB3 ASP 134 8.191 20.651 -3.856 1045 HB3 ASP 134 HB2 ASP 134 9.235 19.583 -4.791 1046 H ASP 135 H ASP 135 5.764 18.149 -3.497 1047 HA ASP 135 HA ASP 135 4.736 19.851 -1.449 1048 HB2 ASP 135 HB3 ASP 135 3.694 18.399 -3.668 1049 HB3 ASP 135 HB2 ASP 135 2.779 17.930 -2.238 1050 H PHE 136 H PHE 136 6.323 16.999 -1.156 1051 HA PHE 136 HA PHE 136 4.819 16.271 1.267 1052 HB2 PHE 136 HB3 PHE 136 5.994 14.559 -0.880 1053 HB3 PHE 136 HB2 PHE 136 6.000 13.951 0.772 1054 HD1 PHE 136 HD2 PHE 136 3.546 15.802 -1.352 1055 HD2 PHE 136 HD1 PHE 136 4.318 12.455 1.160 1056 HE1 PHE 136 HE2 PHE 136 1.214 15.066 -1.623 1057 HE2 PHE 136 HE1 PHE 136 1.987 11.713 0.894 1058 HZ PHE 136 HZ PHE 136 0.431 13.019 -0.499 1059 H THR 137 H THR 137 5.932 16.181 3.109 1060 HA THR 137 HA THR 137 8.852 16.558 2.961 1061 HB THR 137 HB THR 137 6.896 17.458 5.085 1062 HG1 THR 137 HG1 THR 137 8.342 18.809 3.070 1063 HG21 THR 137 HG21 THR 137 9.871 17.500 5.015 1064 HG22 THR 137 HG22 THR 137 8.776 17.187 6.362 1065 HG23 THR 137 HG23 THR 137 8.997 18.834 5.769 1066 H LYS 138 H LYS 138 10.166 15.170 3.953 1067 HA LYS 138 HA LYS 138 9.257 12.669 4.812 1068 HB2 LYS 138 HB3 LYS 138 11.533 13.126 3.941 1069 HB3 LYS 138 HB2 LYS 138 11.910 13.970 5.437 1070 HG2 LYS 138 HG3 LYS 138 12.220 12.070 6.583 1071 HG3 LYS 138 HG2 LYS 138 10.875 11.250 5.791 1072 HD2 LYS 138 HD3 LYS 138 12.886 10.123 5.164 1073 HD3 LYS 138 HD2 LYS 138 12.314 11.024 3.759 1074 HE2 LYS 138 HE3 LYS 138 14.021 12.731 5.249 1075 HE3 LYS 138 HE2 LYS 138 14.835 11.178 5.073 1076 HZ1 LYS 138 HZ1 LYS 138 15.048 11.439 2.860 1077 HZ2 LYS 138 HZ2 LYS 138 14.921 13.084 3.233 1078 HZ3 LYS 138 HZ3 LYS 138 13.566 12.235 2.681 1079 H VAL 139 H VAL 139 8.367 12.043 6.640 1080 HA VAL 139 HA VAL 139 8.406 13.819 8.949 1081 HB VAL 139 HB VAL 139 6.965 11.196 8.940 1082 HG11 VAL 139 HG11 VAL 139 6.840 13.771 10.372 1083 HG12 VAL 139 HG12 VAL 139 6.533 12.133 10.948 1084 HG13 VAL 139 HG13 VAL 139 5.295 12.993 10.033 1085 HG21 VAL 139 HG21 VAL 139 6.144 13.660 7.421 1086 HG22 VAL 139 HG22 VAL 139 4.995 12.425 7.937 1087 HG23 VAL 139 HG23 VAL 139 6.297 12.007 6.823 1088 H SER 140 H SER 140 9.556 10.670 7.923 1089 HA SER 140 HA SER 140 11.451 10.616 10.088 1090 HB2 SER 140 HB3 SER 140 8.983 8.999 10.205 1091 HB3 SER 140 HB2 SER 140 10.475 8.119 10.536 1092 HG SER 140 HG SER 140 9.251 10.166 11.973 1093 H SER 141 H SER 141 12.904 8.721 9.951 1094 HA SER 141 HA SER 141 12.851 7.126 7.560 1095 HB2 SER 141 HB3 SER 141 14.852 7.977 6.531 1096 HB3 SER 141 HB2 SER 141 13.759 9.339 6.776 1097 HG SER 141 HG SER 141 15.979 8.626 8.395 1098 H ARG 142 H ARG 142 13.658 5.208 8.084 1099 HA ARG 142 HA ARG 142 15.909 5.046 9.947 1100 HB2 ARG 142 HB3 ARG 142 13.860 4.749 11.288 1101 HB3 ARG 142 HB2 ARG 142 13.374 3.424 10.240 1102 HG2 ARG 142 HG3 ARG 142 14.305 2.230 11.926 1103 HG3 ARG 142 HG2 ARG 142 15.747 2.484 10.940 1104 HD2 ARG 142 HD3 ARG 142 14.925 4.285 13.211 1105 HD3 ARG 142 HD2 ARG 142 16.044 2.934 13.388 1106 HE ARG 142 HE ARG 142 17.132 4.370 11.375 1107 HH11 ARG 142 HH11 ARG 142 16.050 5.210 14.585 1108 HH12 ARG 142 HH12 ARG 142 17.198 6.492 14.772 1109 HH21 ARG 142 HH21 ARG 142 18.643 6.057 11.619 1110 HH22 ARG 142 HH22 ARG 142 18.670 6.974 13.088 1111 H THR 143 H THR 143 17.441 3.778 9.143 1112 HA THR 143 HA THR 143 16.789 2.010 6.916 1113 HB THR 143 HB THR 143 19.584 2.352 7.889 1114 HG1 THR 143 HG1 THR 143 17.993 4.392 6.782 1115 HG21 THR 143 HG21 THR 143 18.808 2.770 5.074 1116 HG22 THR 143 HG22 THR 143 18.634 1.138 5.719 1117 HG23 THR 143 HG23 THR 143 20.204 1.940 5.762 1118 H VAL 144 H VAL 144 16.347 -0.043 7.308 1119 HA VAL 144 HA VAL 144 17.537 -1.333 9.670 1120 HB VAL 144 HB VAL 144 15.140 -2.264 8.084 1121 HG11 VAL 144 HG11 VAL 144 14.810 -3.468 10.390 1122 HG12 VAL 144 HG12 VAL 144 16.554 -3.243 10.518 1123 HG13 VAL 144 HG13 VAL 144 15.879 -4.150 9.164 1124 HG21 VAL 144 HG21 VAL 144 13.754 -1.031 9.356 1125 HG22 VAL 144 HG22 VAL 144 15.176 -0.021 9.612 1126 HG23 VAL 144 HG23 VAL 144 14.734 -1.240 10.807 1127 H GLU 145 H GLU 145 18.915 -2.993 9.421 1128 HA GLU 145 HA GLU 145 19.173 -4.170 6.733 1129 HB2 GLU 145 HB3 GLU 145 21.635 -4.500 7.424 1130 HB3 GLU 145 HB2 GLU 145 21.118 -2.897 6.923 1131 HG2 GLU 145 HG3 GLU 145 21.387 -2.010 8.980 1132 HG3 GLU 145 HG2 GLU 145 20.947 -3.505 9.805 1133 H ASP 146 H ASP 146 19.589 -6.348 6.583 1134 HA ASP 146 HA ASP 146 19.261 -7.876 9.080 1135 HB2 ASP 146 HB3 ASP 146 18.264 -8.374 6.282 1136 HB3 ASP 146 HB2 ASP 146 18.399 -9.688 7.446 1137 H THR 147 H THR 147 19.941 -10.372 8.300 1138 HA THR 147 HA THR 147 22.735 -10.353 8.365 1139 HB THR 147 HB THR 147 22.283 -12.837 7.472 1140 HG1 THR 147 HG1 THR 147 20.255 -13.262 7.296 1141 HG21 THR 147 HG21 THR 147 21.664 -13.507 9.795 1142 HG22 THR 147 HG22 THR 147 21.583 -11.792 10.199 1143 HG23 THR 147 HG23 THR 147 23.108 -12.503 9.669 1144 H ASN 148 H ASN 148 20.491 -10.815 5.670 1145 HA ASN 148 HA ASN 148 22.648 -11.117 3.769 1146 HB2 ASN 148 HB3 ASN 148 19.753 -11.503 3.777 1147 HB3 ASN 148 HB2 ASN 148 20.330 -10.737 2.300 1148 HD21 ASN 148 HD21 ASN 148 19.369 -12.926 1.631 1149 HD22 ASN 148 HD22 ASN 148 20.502 -14.221 1.485 1150 HA PRO 149 HA PRO 149 23.166 -6.787 2.929 1151 HB2 PRO 149 HB3 PRO 149 23.902 -7.603 0.187 1152 HB3 PRO 149 HB2 PRO 149 24.857 -6.741 1.397 1153 HG2 PRO 149 HG3 PRO 149 25.385 -9.287 0.760 1154 HG3 PRO 149 HG2 PRO 149 25.563 -8.686 2.417 1155 HD2 PRO 149 HD3 PRO 149 23.362 -10.323 1.226 1156 HD3 PRO 149 HD2 PRO 149 24.136 -10.460 2.819 1157 H ALA 150 H ALA 150 21.355 -8.879 0.793 1158 HA ALA 150 HA ALA 150 20.097 -6.691 -0.616 1159 HB1 ALA 150 HB1 ALA 150 20.608 -9.250 -1.312 1160 HB2 ALA 150 HB2 ALA 150 19.401 -8.232 -2.098 1161 HB3 ALA 150 HB3 ALA 150 18.912 -9.372 -0.844 1162 H LEU 151 H LEU 151 19.552 -8.352 2.309 1163 HA LEU 151 HA LEU 151 16.685 -7.925 2.312 1164 HB2 LEU 151 HB3 LEU 151 18.583 -9.015 4.383 1165 HB3 LEU 151 HB2 LEU 151 16.864 -8.815 4.663 1166 HG LEU 151 HG LEU 151 18.225 -10.707 2.762 1167 HD11 LEU 151 HD11 LEU 151 16.954 -12.382 3.978 1168 HD12 LEU 151 HD12 LEU 151 16.210 -11.124 4.965 1169 HD13 LEU 151 HD13 LEU 151 17.943 -11.429 5.084 1170 HD21 LEU 151 HD21 LEU 151 15.629 -11.274 2.398 1171 HD22 LEU 151 HD22 LEU 151 16.544 -10.200 1.339 1172 HD23 LEU 151 HD23 LEU 151 15.523 -9.526 2.610 1173 H THR 152 H THR 152 19.069 -5.812 2.535 1174 HA THR 152 HA THR 152 18.381 -4.427 4.957 1175 HB THR 152 HB THR 152 19.874 -3.192 2.659 1176 HG1 THR 152 HG1 THR 152 20.845 -5.105 4.508 1177 HG21 THR 152 HG21 THR 152 20.066 -1.588 4.192 1178 HG22 THR 152 HG22 THR 152 21.252 -2.656 4.943 1179 HG23 THR 152 HG23 THR 152 19.583 -2.653 5.512 1180 H HIS 153 H HIS 153 16.670 -3.159 5.223 1181 HA HIS 153 HA HIS 153 15.489 -1.885 2.841 1182 HB2 HIS 153 HB3 HIS 153 13.805 -2.418 5.244 1183 HB3 HIS 153 HB2 HIS 153 13.350 -2.363 3.545 1184 HD1 HIS 153 HD1 HIS 153 13.241 -4.682 6.045 1185 HD2 HIS 153 HD2 HIS 153 15.030 -4.771 2.298 1186 HE1 HIS 153 HE1 HIS 153 13.504 -7.118 5.485 1187 HE2 HIS 153 HE2 HIS 153 14.505 -7.147 3.173 1188 H THR 154 H THR 154 14.161 0.068 3.377 1189 HA THR 154 HA THR 154 15.173 1.536 5.706 1190 HB THR 154 HB THR 154 15.037 2.751 2.944 1191 HG1 THR 154 HG1 THR 154 17.202 1.596 4.341 1192 HG21 THR 154 HG21 THR 154 16.877 4.089 4.564 1193 HG22 THR 154 HG22 THR 154 15.433 3.863 5.551 1194 HG23 THR 154 HG23 THR 154 15.316 4.675 3.989 1195 H TYR 155 H TYR 155 13.480 2.195 6.841 1196 HA TYR 155 HA TYR 155 10.895 2.529 5.534 1197 HB2 TYR 155 HB3 TYR 155 11.827 2.081 8.317 1198 HB3 TYR 155 HB2 TYR 155 10.348 3.015 8.122 1199 HD1 TYR 155 HD1 TYR 155 8.582 1.930 6.470 1200 HD2 TYR 155 HD2 TYR 155 11.662 -0.215 8.473 1201 HE1 TYR 155 HE1 TYR 155 7.302 -0.152 6.195 1202 HE2 TYR 155 HE2 TYR 155 10.392 -2.303 8.203 1203 HH TYR 155 HH TYR 155 7.689 -2.785 7.876 1204 H GLU 156 H GLU 156 10.347 4.460 4.776 1205 HA GLU 156 HA GLU 156 11.274 6.847 6.237 1206 HB2 GLU 156 HB3 GLU 156 10.987 6.408 3.267 1207 HB3 GLU 156 HB2 GLU 156 11.139 8.007 3.983 1208 HG2 GLU 156 HG3 GLU 156 13.228 6.511 5.071 1209 HG3 GLU 156 HG2 GLU 156 13.173 6.073 3.365 1210 H VAL 157 H VAL 157 9.828 8.455 6.632 1211 HA VAL 157 HA VAL 157 7.033 7.911 5.888 1212 HB VAL 157 HB VAL 157 7.919 9.610 8.217 1213 HG11 VAL 157 HG11 VAL 157 5.536 8.830 8.942 1214 HG12 VAL 157 HG12 VAL 157 5.318 8.534 7.217 1215 HG13 VAL 157 HG13 VAL 157 5.719 10.152 7.790 1216 HG21 VAL 157 HG21 VAL 157 7.473 6.652 8.053 1217 HG22 VAL 157 HG22 VAL 157 7.153 7.530 9.548 1218 HG23 VAL 157 HG23 VAL 157 8.772 7.542 8.848 1219 H TRP 158 H TRP 158 5.740 9.597 5.235 1220 HA TRP 158 HA TRP 158 6.927 12.226 4.817 1221 HB2 TRP 158 HB3 TRP 158 5.876 10.583 2.511 1222 HB3 TRP 158 HB2 TRP 158 6.325 12.281 2.419 1223 HD1 TRP 158 HD1 TRP 158 7.963 8.845 3.120 1224 HE1 TRP 158 HE1 TRP 158 10.429 8.978 2.395 1225 HE3 TRP 158 HE3 TRP 158 8.173 13.794 1.856 1226 HZ2 TRP 158 HZ2 TRP 158 12.226 10.923 1.417 1227 HZ3 TRP 158 HZ3 TRP 158 10.303 14.713 1.035 1228 HH2 TRP 158 HH2 TRP 158 12.287 13.306 0.821 1229 H GLN 159 H GLN 159 5.495 13.867 4.861 1230 HA GLN 159 HA GLN 159 2.634 13.238 4.690 1231 HB2 GLN 159 HB3 GLN 159 4.104 14.413 6.997 1232 HB3 GLN 159 HB2 GLN 159 2.519 15.075 6.620 1233 HG2 GLN 159 HG3 GLN 159 1.558 12.821 6.786 1234 HG3 GLN 159 HG2 GLN 159 3.147 12.193 7.220 1235 HE21 GLN 159 HE21 GLN 159 0.718 14.565 8.206 1236 HE22 GLN 159 HE22 GLN 159 1.023 14.436 9.902 1237 H LYS 160 H LYS 160 1.681 14.537 3.260 1238 HA LYS 160 HA LYS 160 2.977 16.608 1.928 1239 HB2 LYS 160 HB3 LYS 160 0.962 15.315 1.142 1240 HB3 LYS 160 HB2 LYS 160 -0.014 16.312 2.211 1241 HG2 LYS 160 HG3 LYS 160 1.115 18.284 0.920 1242 HG3 LYS 160 HG2 LYS 160 1.393 17.048 -0.308 1243 HD2 LYS 160 HD3 LYS 160 -0.730 17.141 -0.972 1244 HD3 LYS 160 HD2 LYS 160 -1.310 16.901 0.677 1245 HE2 LYS 160 HE3 LYS 160 -2.128 19.004 -0.276 1246 HE3 LYS 160 HE2 LYS 160 -1.088 19.281 1.121 1247 HZ1 LYS 160 HZ1 LYS 160 0.648 20.015 -0.230 1248 HZ2 LYS 160 HZ2 LYS 160 -0.723 20.730 -0.913 1249 HZ3 LYS 160 HZ3 LYS 160 -0.031 19.368 -1.639 1250 H LYS 161 H LYS 161 2.885 18.825 2.041 1251 HA LYS 161 HA LYS 161 2.637 19.959 4.627 1252 HB2 LYS 161 HB3 LYS 161 2.875 21.297 1.926 1253 HB3 LYS 161 HB2 LYS 161 3.046 22.116 3.472 1254 HG2 LYS 161 HG3 LYS 161 5.069 21.090 3.940 1255 HG3 LYS 161 HG2 LYS 161 4.778 19.775 2.800 1256 HD2 LYS 161 HD3 LYS 161 6.356 21.087 1.703 1257 HD3 LYS 161 HD2 LYS 161 4.829 21.624 1.000 1258 HE2 LYS 161 HE3 LYS 161 6.027 23.594 1.473 1259 HE3 LYS 161 HE2 LYS 161 4.831 23.452 2.760 1260 HZ1 LYS 161 HZ1 LYS 161 6.908 22.149 3.824 1261 HZ2 LYS 161 HZ2 LYS 161 6.600 23.794 4.072 1262 HZ3 LYS 161 HZ3 LYS 161 7.718 23.312 2.898 1263 H ALA 162 H ALA 162 0.920 20.755 5.639 1264 HA ALA 162 HA ALA 162 -1.198 21.464 6.077 1265 HB1 ALA 162 HB1 ALA 162 -1.028 23.472 5.047 1266 HB2 ALA 162 HB2 ALA 162 -2.220 22.755 3.963 1267 HB3 ALA 162 HB3 ALA 162 -0.515 22.766 3.514 1268 H51A NDP 170 H51A NDP 170 -4.681 -1.976 -11.567 1269 H52A NDP 170 H52A NDP 170 -5.057 -0.741 -10.351 1270 H4B NDP 170 H4B NDP 170 -7.071 -2.532 -11.773 1271 H3B NDP 170 H3B NDP 170 -6.446 0.415 -12.047 1272 HO3A NDP 170 HO3A NDP 170 -6.910 -0.223 -14.244 1273 H2B NDP 170 H2B NDP 170 -8.781 0.764 -12.458 1274 H1B NDP 170 H1B NDP 170 -9.675 -0.850 -10.402 1275 H8A NDP 170 H8A NDP 170 -6.450 1.156 -9.819 1276 H61A NDP 170 H61A NDP 170 -10.189 5.262 -7.054 1277 H62A NDP 170 H62A NDP 170 -8.538 4.904 -7.502 1278 H2A NDP 170 H2A NDP 170 -12.747 2.039 -8.843 1279 H51N NDP 170 H51N NDP 170 -1.241 -4.468 -7.539 1280 H52N NDP 170 H52N NDP 170 -0.484 -3.489 -8.807 1281 H4D NDP 170 H4D NDP 170 0.972 -5.448 -9.389 1282 H3D NDP 170 H3D NDP 170 -0.422 -6.770 -7.049 1283 HO3N NDP 170 HO3N NDP 170 -0.206 -8.526 -8.525 1284 H2D NDP 170 H2D NDP 170 1.678 -7.836 -6.560 1285 HO2N NDP 170 HO2N NDP 170 3.194 -6.789 -8.581 1286 H1D NDP 170 H1D NDP 170 3.213 -5.561 -6.886 1287 H2N NDP 170 H2N NDP 170 3.746 -5.356 -4.559 1288 H71N NDP 170 H71N NDP 170 5.552 -4.756 -1.955 1289 H72N NDP 170 H72N NDP 170 5.126 -5.396 -3.520 1290 H41N NDP 170 H41N NDP 170 0.671 -4.177 -2.312 1291 H42N NDP 170 H42N NDP 170 0.737 -5.950 -2.021 1292 H5N NDP 170 H5N NDP 170 -1.124 -5.354 -3.568 1293 H6N NDP 170 H6N NDP 170 -0.386 -5.724 -5.930 Start of MODEL 27 1 H1 THR 1 HT1 THR 1 -4.984 9.809 5.035 2 H2 THR 1 HT2 THR 1 -5.343 8.181 5.447 3 H3 THR 1 HT3 THR 1 -6.467 9.107 4.539 4 HA THR 1 HA THR 1 -5.276 7.539 3.184 5 HB THR 1 HB THR 1 -4.253 9.501 1.690 6 HG1 THR 1 HG1 THR 1 -5.296 11.462 2.259 7 HG21 THR 1 HG21 THR 1 -7.194 9.630 2.199 8 HG22 THR 1 HG22 THR 1 -6.462 8.229 1.418 9 HG23 THR 1 HG23 THR 1 -6.313 9.826 0.685 10 H ALA 2 H ALA 2 -3.587 6.281 3.764 11 HA ALA 2 HA ALA 2 -0.935 7.561 3.849 12 HB1 ALA 2 HB1 ALA 2 -0.300 6.451 5.728 13 HB2 ALA 2 HB2 ALA 2 -1.342 5.067 5.398 14 HB3 ALA 2 HB3 ALA 2 -2.030 6.552 6.054 15 H PHE 3 H PHE 3 0.727 6.505 2.817 16 HA PHE 3 HA PHE 3 -0.077 4.245 1.112 17 HB2 PHE 3 HB3 PHE 3 1.722 6.578 0.738 18 HB3 PHE 3 HB2 PHE 3 2.224 5.068 -0.010 19 HD1 PHE 3 HD1 PHE 3 -1.297 6.063 0.409 20 HD2 PHE 3 HD2 PHE 3 2.009 5.792 -2.258 21 HE1 PHE 3 HE1 PHE 3 -2.796 6.511 -1.490 22 HE2 PHE 3 HE2 PHE 3 0.516 6.241 -4.160 23 HZ PHE 3 HZ PHE 3 -1.889 6.601 -3.778 24 H LEU 4 H LEU 4 0.889 2.302 1.356 25 HA LEU 4 HA LEU 4 3.508 2.145 2.618 26 HB2 LEU 4 HB3 LEU 4 2.077 1.986 4.523 27 HB3 LEU 4 HB2 LEU 4 1.027 0.840 3.713 28 HG LEU 4 HG LEU 4 3.028 -0.743 3.679 29 HD11 LEU 4 HD11 LEU 4 4.091 1.500 5.315 30 HD12 LEU 4 HD12 LEU 4 4.917 0.445 4.168 31 HD13 LEU 4 HD13 LEU 4 4.506 -0.150 5.777 32 HD21 LEU 4 HD21 LEU 4 2.302 -1.700 5.619 33 HD22 LEU 4 HD22 LEU 4 0.984 -0.564 5.330 34 HD23 LEU 4 HD23 LEU 4 2.253 -0.166 6.489 35 H TRP 5 H TRP 5 4.697 0.933 1.303 36 HA TRP 5 HA TRP 5 3.796 -1.674 0.499 37 HB2 TRP 5 HB3 TRP 5 3.673 -1.405 -1.820 38 HB3 TRP 5 HB2 TRP 5 2.842 0.018 -1.205 39 HD1 TRP 5 HD1 TRP 5 6.000 -1.042 -3.059 40 HE1 TRP 5 HE1 TRP 5 7.111 1.044 -4.074 41 HE3 TRP 5 HE3 TRP 5 3.115 2.562 -0.864 42 HZ2 TRP 5 HZ2 TRP 5 6.807 3.847 -3.959 43 HZ3 TRP 5 HZ3 TRP 5 3.592 4.923 -1.372 44 HH2 TRP 5 HH2 TRP 5 5.399 5.550 -2.886 45 H ALA 6 H ALA 6 5.481 -2.929 -0.574 46 HA ALA 6 HA ALA 6 8.145 -2.010 0.255 47 HB1 ALA 6 HB1 ALA 6 7.127 -4.238 1.024 48 HB2 ALA 6 HB2 ALA 6 8.789 -4.250 0.432 49 HB3 ALA 6 HB3 ALA 6 7.478 -4.806 -0.608 50 H GLN 7 H GLN 7 9.933 -2.102 -1.160 51 HA GLN 7 HA GLN 7 9.507 -2.853 -3.927 52 HB2 GLN 7 HB3 GLN 7 10.185 -0.616 -4.783 53 HB3 GLN 7 HB2 GLN 7 8.621 -0.617 -3.980 54 HG2 GLN 7 HG3 GLN 7 10.540 -0.042 -2.005 55 HG3 GLN 7 HG2 GLN 7 10.944 0.941 -3.412 56 HE21 GLN 7 HE21 GLN 7 8.426 0.157 -1.099 57 HE22 GLN 7 HE22 GLN 7 7.529 1.620 -1.295 58 H ASP 8 H ASP 8 11.506 -2.433 -5.255 59 HA ASP 8 HA ASP 8 13.892 -2.941 -3.610 60 HB2 ASP 8 HB3 ASP 8 14.580 -3.626 -6.214 61 HB3 ASP 8 HB2 ASP 8 14.119 -4.745 -4.941 62 H ARG 9 H ARG 9 15.855 -2.424 -5.574 63 HA ARG 9 HA ARG 9 15.955 0.434 -5.403 64 HB2 ARG 9 HB3 ARG 9 17.773 -1.617 -6.661 65 HB3 ARG 9 HB2 ARG 9 18.105 0.108 -6.713 66 HG2 ARG 9 HG3 ARG 9 17.592 -1.207 -4.087 67 HG3 ARG 9 HG2 ARG 9 19.167 -1.383 -4.864 68 HD2 ARG 9 HD3 ARG 9 17.855 1.284 -4.395 69 HD3 ARG 9 HD2 ARG 9 18.941 0.531 -3.229 70 HE ARG 9 HE ARG 9 20.399 0.511 -5.495 71 HH11 ARG 9 HH11 ARG 9 18.628 3.030 -3.851 72 HH12 ARG 9 HH12 ARG 9 19.677 4.295 -4.394 73 HH21 ARG 9 HH21 ARG 9 21.780 2.175 -6.210 74 HH22 ARG 9 HH22 ARG 9 21.467 3.810 -5.734 75 H ASP 10 H ASP 10 14.414 -1.589 -7.545 76 HA ASP 10 HA ASP 10 14.767 0.211 -9.835 77 HB2 ASP 10 HB3 ASP 10 14.018 -2.654 -9.541 78 HB3 ASP 10 HB2 ASP 10 13.316 -1.766 -10.890 79 H GLY 11 H GLY 11 12.815 0.049 -7.257 80 HA2 GLY 11 HA3 GLY 11 10.873 1.313 -6.901 81 HA3 GLY 11 HA2 GLY 11 10.670 1.444 -8.641 82 H LEU 12 H LEU 12 11.108 -1.627 -8.625 83 HA LEU 12 HA LEU 12 8.578 -2.513 -9.084 84 HB2 LEU 12 HB3 LEU 12 10.811 -3.709 -9.356 85 HB3 LEU 12 HB2 LEU 12 10.658 -4.160 -7.678 86 HG LEU 12 HG LEU 12 8.478 -5.311 -8.303 87 HD11 LEU 12 HD11 LEU 12 8.271 -4.094 -10.488 88 HD12 LEU 12 HD12 LEU 12 8.091 -5.845 -10.589 89 HD13 LEU 12 HD13 LEU 12 9.601 -5.083 -11.087 90 HD21 LEU 12 HD21 LEU 12 9.673 -7.196 -8.358 91 HD22 LEU 12 HD22 LEU 12 11.092 -6.147 -8.261 92 HD23 LEU 12 HD23 LEU 12 10.522 -6.724 -9.831 93 H ILE 13 H ILE 13 7.339 -4.166 -7.739 94 HA ILE 13 HA ILE 13 7.458 -3.825 -4.879 95 HB ILE 13 HB ILE 13 5.163 -3.103 -4.592 96 HG12 ILE 13 HG13 ILE 13 4.928 -2.490 -7.524 97 HG13 ILE 13 HG12 ILE 13 4.481 -4.080 -6.916 98 HG21 ILE 13 HG21 ILE 13 6.574 -1.221 -6.473 99 HG22 ILE 13 HG22 ILE 13 6.974 -1.424 -4.767 100 HG23 ILE 13 HG23 ILE 13 5.392 -0.800 -5.233 101 HD11 ILE 13 HD11 ILE 13 2.658 -3.289 -5.789 102 HD12 ILE 13 HD12 ILE 13 2.707 -2.176 -7.157 103 HD13 ILE 13 HD13 ILE 13 3.344 -1.677 -5.590 104 H GLY 14 H GLY 14 6.034 -5.218 -7.744 105 HA2 GLY 14 HA3 GLY 14 5.650 -7.729 -6.293 106 HA3 GLY 14 HA2 GLY 14 4.285 -7.053 -7.169 107 H LYS 15 H LYS 15 4.756 -9.385 -8.017 108 HA LYS 15 HA LYS 15 6.233 -9.056 -10.529 109 HB2 LYS 15 HB3 LYS 15 6.633 -11.652 -10.239 110 HB3 LYS 15 HB2 LYS 15 7.743 -10.482 -9.543 111 HG2 LYS 15 HG3 LYS 15 7.306 -12.200 -7.937 112 HG3 LYS 15 HG2 LYS 15 6.559 -10.701 -7.385 113 HD2 LYS 15 HD3 LYS 15 4.998 -12.457 -6.996 114 HD3 LYS 15 HD2 LYS 15 4.402 -11.525 -8.369 115 HE2 LYS 15 HE3 LYS 15 5.861 -13.358 -9.674 116 HE3 LYS 15 HE2 LYS 15 5.428 -14.296 -8.247 117 HZ1 LYS 15 HZ1 LYS 15 3.270 -14.372 -8.841 118 HZ2 LYS 15 HZ2 LYS 15 3.888 -14.124 -10.396 119 HZ3 LYS 15 HZ3 LYS 15 3.268 -12.820 -9.515 120 H ASP 16 H ASP 16 3.726 -8.472 -10.628 121 HA ASP 16 HA ASP 16 1.867 -8.928 -11.885 122 HB2 ASP 16 HB3 ASP 16 3.546 -10.765 -12.913 123 HB3 ASP 16 HB2 ASP 16 2.391 -11.842 -12.133 124 H GLY 17 H GLY 17 2.139 -9.158 -9.006 125 HA2 GLY 17 HA3 GLY 17 -0.425 -10.113 -8.367 126 HA3 GLY 17 HA2 GLY 17 0.749 -11.350 -7.941 127 H HIS 18 H HIS 18 2.777 -10.237 -6.795 128 HA HIS 18 HA HIS 18 2.333 -7.990 -5.151 129 HB2 HIS 18 HB3 HIS 18 1.984 -9.058 -2.990 130 HB3 HIS 18 HB2 HIS 18 0.680 -9.493 -4.089 131 HD1 HIS 18 HD1 HIS 18 3.123 -11.581 -5.320 132 HD2 HIS 18 HD2 HIS 18 1.047 -11.553 -1.721 133 HE1 HIS 18 HE1 HIS 18 3.285 -13.928 -4.433 134 HE2 HIS 18 HE2 HIS 18 2.099 -13.864 -2.211 135 H LEU 19 H LEU 19 3.879 -8.438 -2.990 136 HA LEU 19 HA LEU 19 6.485 -8.532 -4.081 137 HB2 LEU 19 HB3 LEU 19 7.237 -8.456 -1.711 138 HB3 LEU 19 HB2 LEU 19 6.103 -7.193 -2.146 139 HG LEU 19 HG LEU 19 4.371 -8.995 -1.163 140 HD11 LEU 19 HD11 LEU 19 6.992 -9.882 -0.287 141 HD12 LEU 19 HD12 LEU 19 5.427 -10.686 -0.170 142 HD13 LEU 19 HD13 LEU 19 5.917 -9.526 1.064 143 HD21 LEU 19 HD21 LEU 19 4.355 -7.692 0.864 144 HD22 LEU 19 HD22 LEU 19 4.663 -6.625 -0.506 145 HD23 LEU 19 HD23 LEU 19 5.991 -7.112 0.547 146 HA PRO 20 HA PRO 20 6.776 -13.015 -3.875 147 HB2 PRO 20 HB3 PRO 20 8.963 -13.298 -5.386 148 HB3 PRO 20 HB2 PRO 20 7.408 -12.836 -6.089 149 HG2 PRO 20 HG3 PRO 20 9.769 -11.127 -5.418 150 HG3 PRO 20 HG2 PRO 20 8.711 -11.068 -6.840 151 HD2 PRO 20 HD3 PRO 20 8.493 -9.399 -4.651 152 HD3 PRO 20 HD2 PRO 20 7.170 -9.761 -5.776 153 H TRP 21 H TRP 21 9.108 -10.709 -2.753 154 HA TRP 21 HA TRP 21 10.958 -12.647 -1.717 155 HB2 TRP 21 HB3 TRP 21 11.910 -10.628 -0.514 156 HB3 TRP 21 HB2 TRP 21 11.879 -10.529 -2.272 157 HD1 TRP 21 HD1 TRP 21 9.370 -9.521 0.531 158 HE1 TRP 21 HE1 TRP 21 8.478 -7.175 -0.030 159 HE3 TRP 21 HE3 TRP 21 11.943 -8.695 -3.804 160 HZ2 TRP 21 HZ2 TRP 21 8.822 -5.227 -2.047 161 HZ3 TRP 21 HZ3 TRP 21 11.606 -6.569 -4.989 162 HH2 TRP 21 HH2 TRP 21 10.076 -4.869 -4.128 163 H HIS 22 H HIS 22 11.389 -13.059 0.498 164 HA HIS 22 HA HIS 22 8.973 -13.008 2.142 165 HB2 HIS 22 HB3 HIS 22 11.432 -14.689 2.045 166 HB3 HIS 22 HB2 HIS 22 10.626 -14.507 3.598 167 HD1 HIS 22 HD1 HIS 22 10.016 -15.817 0.115 168 HD2 HIS 22 HD2 HIS 22 8.324 -15.988 3.906 169 HE1 HIS 22 HE1 HIS 22 8.214 -17.565 -0.032 170 HE2 HIS 22 HE2 HIS 22 7.141 -17.583 2.248 171 H LEU 23 H LEU 23 8.841 -11.090 3.176 172 HA LEU 23 HA LEU 23 11.216 -10.177 4.661 173 HB2 LEU 23 HB3 LEU 23 9.392 -8.799 2.934 174 HB3 LEU 23 HB2 LEU 23 9.275 -8.118 4.546 175 HG LEU 23 HG LEU 23 11.872 -8.014 4.422 176 HD11 LEU 23 HD11 LEU 23 12.642 -8.965 2.538 177 HD12 LEU 23 HD12 LEU 23 12.234 -7.409 1.813 178 HD13 LEU 23 HD13 LEU 23 11.111 -8.763 1.685 179 HD21 LEU 23 HD21 LEU 23 10.702 -6.002 4.591 180 HD22 LEU 23 HD22 LEU 23 9.926 -6.213 3.022 181 HD23 LEU 23 HD23 LEU 23 11.643 -5.823 3.111 182 HA PRO 24 HA PRO 24 8.372 -11.806 7.933 183 HB2 PRO 24 HB3 PRO 24 10.954 -11.451 9.376 184 HB3 PRO 24 HB2 PRO 24 9.819 -12.804 9.417 185 HG2 PRO 24 HG3 PRO 24 12.107 -12.992 8.069 186 HG3 PRO 24 HG2 PRO 24 10.612 -13.703 7.433 187 HD2 PRO 24 HD3 PRO 24 12.028 -11.210 6.607 188 HD3 PRO 24 HD2 PRO 24 11.133 -12.382 5.620 189 H ASP 25 H ASP 25 10.762 -9.190 8.103 190 HA ASP 25 HA ASP 25 9.662 -7.893 10.346 191 HB2 ASP 25 HB3 ASP 25 10.991 -5.925 9.446 192 HB3 ASP 25 HB2 ASP 25 11.906 -7.386 9.783 193 H ASP 26 H ASP 26 9.253 -7.376 6.855 194 HA ASP 26 HA ASP 26 7.612 -5.112 7.018 195 HB2 ASP 26 HB3 ASP 26 8.758 -6.257 4.963 196 HB3 ASP 26 HB2 ASP 26 7.240 -7.142 4.843 197 H LEU 27 H LEU 27 6.772 -8.559 6.882 198 HA LEU 27 HA LEU 27 3.976 -8.202 6.864 199 HB2 LEU 27 HB3 LEU 27 5.375 -10.559 8.098 200 HB3 LEU 27 HB2 LEU 27 3.806 -10.518 7.318 201 HG LEU 27 HG LEU 27 6.081 -9.776 5.592 202 HD11 LEU 27 HD11 LEU 27 6.536 -11.908 7.234 203 HD12 LEU 27 HD12 LEU 27 7.249 -11.681 5.637 204 HD13 LEU 27 HD13 LEU 27 5.805 -12.676 5.824 205 HD21 LEU 27 HD21 LEU 27 4.790 -11.476 4.144 206 HD22 LEU 27 HD22 LEU 27 4.043 -9.917 4.494 207 HD23 LEU 27 HD23 LEU 27 3.546 -11.354 5.388 208 H HIS 28 H HIS 28 6.145 -9.088 9.554 209 HA HIS 28 HA HIS 28 4.313 -9.076 11.612 210 HB2 HIS 28 HB3 HIS 28 7.125 -9.153 11.379 211 HB3 HIS 28 HB2 HIS 28 6.763 -7.871 12.531 212 HD1 HIS 28 HD1 HIS 28 5.645 -11.475 11.978 213 HD2 HIS 28 HD2 HIS 28 6.554 -8.822 15.044 214 HE1 HIS 28 HE1 HIS 28 5.418 -12.801 14.103 215 HE2 HIS 28 HE2 HIS 28 5.898 -11.155 15.949 216 H TYR 29 H TYR 29 6.156 -6.323 10.334 217 HA TYR 29 HA TYR 29 5.041 -4.430 12.143 218 HB2 TYR 29 HB3 TYR 29 7.209 -4.102 10.970 219 HB3 TYR 29 HB2 TYR 29 6.333 -3.934 9.452 220 HD1 TYR 29 HD1 TYR 29 6.899 -2.386 12.762 221 HD2 TYR 29 HD2 TYR 29 5.308 -1.881 8.850 222 HE1 TYR 29 HE1 TYR 29 6.642 0.023 13.183 223 HE2 TYR 29 HE2 TYR 29 5.049 0.530 9.259 224 HH TYR 29 HH TYR 29 5.354 1.909 12.370 225 H PHE 30 H PHE 30 4.129 -5.654 9.002 226 HA PHE 30 HA PHE 30 2.244 -3.632 8.361 227 HB2 PHE 30 HB3 PHE 30 3.254 -5.208 6.709 228 HB3 PHE 30 HB2 PHE 30 2.289 -6.503 7.409 229 HD1 PHE 30 HD1 PHE 30 1.276 -2.997 6.731 230 HD2 PHE 30 HD2 PHE 30 0.865 -7.098 5.668 231 HE1 PHE 30 HE1 PHE 30 -0.581 -2.417 5.227 232 HE2 PHE 30 HE2 PHE 30 -0.994 -6.525 4.161 233 HZ PHE 30 HZ PHE 30 -1.718 -4.182 3.938 234 H ARG 31 H ARG 31 1.771 -6.974 9.513 235 HA ARG 31 HA ARG 31 -0.995 -6.728 9.949 236 HB2 ARG 31 HB3 ARG 31 0.158 -8.891 9.753 237 HB3 ARG 31 HB2 ARG 31 0.977 -8.593 11.279 238 HG2 ARG 31 HG3 ARG 31 -1.466 -8.359 12.193 239 HG3 ARG 31 HG2 ARG 31 -1.864 -9.307 10.759 240 HD2 ARG 31 HD3 ARG 31 0.057 -10.061 12.957 241 HD3 ARG 31 HD2 ARG 31 -1.515 -10.789 12.630 242 HE ARG 31 HE ARG 31 0.958 -11.379 11.327 243 HH11 ARG 31 HH11 ARG 31 -2.500 -11.271 10.877 244 HH12 ARG 31 HH12 ARG 31 -2.500 -12.464 9.622 245 HH21 ARG 31 HH21 ARG 31 0.961 -12.948 9.676 246 HH22 ARG 31 HH22 ARG 31 -0.535 -13.417 8.940 247 H ALA 32 H ALA 32 1.755 -5.834 11.883 248 HA ALA 32 HA ALA 32 0.302 -5.590 14.346 249 HB1 ALA 32 HB1 ALA 32 2.449 -4.223 14.940 250 HB2 ALA 32 HB2 ALA 32 3.060 -4.911 13.436 251 HB3 ALA 32 HB3 ALA 32 2.534 -5.973 14.742 252 H GLN 33 H GLN 33 1.197 -3.444 11.715 253 HA GLN 33 HA GLN 33 0.249 -1.092 13.116 254 HB2 GLN 33 HB3 GLN 33 1.684 -1.649 10.595 255 HB3 GLN 33 HB2 GLN 33 0.621 -0.249 10.566 256 HG2 GLN 33 HG3 GLN 33 2.356 -0.420 12.921 257 HG3 GLN 33 HG2 GLN 33 3.202 -0.225 11.387 258 HE21 GLN 33 HE21 GLN 33 3.255 1.726 10.457 259 HE22 GLN 33 HE22 GLN 33 2.413 3.120 11.032 260 H THR 34 H THR 34 -0.932 -3.390 10.791 261 HA THR 34 HA THR 34 -3.216 -1.741 10.079 262 HB THR 34 HB THR 34 -3.842 -3.658 8.640 263 HG1 THR 34 HG1 THR 34 -1.439 -4.821 9.586 264 HG21 THR 34 HG21 THR 34 -1.106 -3.580 7.796 265 HG22 THR 34 HG22 THR 34 -1.654 -1.972 8.270 266 HG23 THR 34 HG23 THR 34 -2.537 -2.878 7.042 267 H VAL 35 H VAL 35 -2.866 -2.679 12.866 268 HA VAL 35 HA VAL 35 -4.990 -4.634 13.208 269 HB VAL 35 HB VAL 35 -3.476 -3.181 15.376 270 HG11 VAL 35 HG11 VAL 35 -5.132 -4.182 16.544 271 HG12 VAL 35 HG12 VAL 35 -4.089 -5.595 16.383 272 HG13 VAL 35 HG13 VAL 35 -5.450 -5.373 15.283 273 HG21 VAL 35 HG21 VAL 35 -2.816 -5.868 14.178 274 HG22 VAL 35 HG22 VAL 35 -1.934 -5.021 15.449 275 HG23 VAL 35 HG23 VAL 35 -1.955 -4.374 13.809 276 H GLY 36 H GLY 36 -7.037 -4.001 13.225 277 HA2 GLY 36 HA3 GLY 36 -8.935 -2.839 13.817 278 HA3 GLY 36 HA2 GLY 36 -7.955 -1.926 14.953 279 H LYS 37 H LYS 37 -7.010 -2.011 11.620 280 HA LYS 37 HA LYS 37 -8.011 0.746 11.306 281 HB2 LYS 37 HB3 LYS 37 -5.507 -0.423 10.081 282 HB3 LYS 37 HB2 LYS 37 -6.053 1.244 9.961 283 HG2 LYS 37 HG3 LYS 37 -5.579 0.089 12.661 284 HG3 LYS 37 HG2 LYS 37 -4.192 0.539 11.668 285 HD2 LYS 37 HD3 LYS 37 -6.121 2.639 11.556 286 HD3 LYS 37 HD2 LYS 37 -5.842 2.215 13.246 287 HE2 LYS 37 HE3 LYS 37 -3.620 2.741 11.283 288 HE3 LYS 37 HE2 LYS 37 -4.331 3.996 12.297 289 HZ1 LYS 37 HZ1 LYS 37 -2.228 2.691 13.072 290 HZ2 LYS 37 HZ2 LYS 37 -3.360 1.537 13.570 291 HZ3 LYS 37 HZ3 LYS 37 -3.431 3.111 14.185 292 H ILE 38 H ILE 38 -7.665 1.251 8.729 293 HA ILE 38 HA ILE 38 -9.083 -0.911 7.314 294 HB ILE 38 HB ILE 38 -9.698 1.563 6.053 295 HG12 ILE 38 HG13 ILE 38 -10.693 1.610 8.888 296 HG13 ILE 38 HG12 ILE 38 -9.175 2.394 8.467 297 HG21 ILE 38 HG21 ILE 38 -11.853 0.763 6.112 298 HG22 ILE 38 HG22 ILE 38 -11.659 0.051 7.713 299 HG23 ILE 38 HG23 ILE 38 -10.924 -0.723 6.309 300 HD11 ILE 38 HD11 ILE 38 -10.607 4.142 8.244 301 HD12 ILE 38 HD12 ILE 38 -11.953 3.122 7.738 302 HD13 ILE 38 HD13 ILE 38 -10.660 3.503 6.602 303 H MET 39 H MET 39 -8.156 -1.603 5.509 304 HA MET 39 HA MET 39 -6.054 0.072 4.297 305 HB2 MET 39 HB3 MET 39 -5.089 -1.895 5.298 306 HB3 MET 39 HB2 MET 39 -6.267 -2.933 4.511 307 HG2 MET 39 HG3 MET 39 -5.211 -1.892 2.330 308 HG3 MET 39 HG2 MET 39 -3.843 -1.624 3.408 309 HE1 MET 39 HE1 MET 39 -6.465 -4.171 2.261 310 HE2 MET 39 HE2 MET 39 -6.260 -4.825 3.887 311 HE3 MET 39 HE3 MET 39 -5.690 -5.738 2.489 312 H VAL 40 H VAL 40 -6.131 0.494 2.163 313 HA VAL 40 HA VAL 40 -8.487 -0.429 0.692 314 HB VAL 40 HB VAL 40 -6.498 1.669 -0.170 315 HG11 VAL 40 HG11 VAL 40 -8.338 0.430 -1.677 316 HG12 VAL 40 HG12 VAL 40 -7.865 2.112 -1.917 317 HG13 VAL 40 HG13 VAL 40 -9.329 1.727 -1.010 318 HG21 VAL 40 HG21 VAL 40 -7.273 2.735 1.686 319 HG22 VAL 40 HG22 VAL 40 -8.779 1.818 1.720 320 HG23 VAL 40 HG23 VAL 40 -8.581 3.146 0.577 321 H VAL 41 H VAL 41 -8.383 -1.728 -1.055 322 HA VAL 41 HA VAL 41 -5.716 -2.406 -2.094 323 HB VAL 41 HB VAL 41 -7.121 -4.107 -0.517 324 HG11 VAL 41 HG11 VAL 41 -8.940 -4.291 -2.178 325 HG12 VAL 41 HG12 VAL 41 -8.155 -5.833 -1.839 326 HG13 VAL 41 HG13 VAL 41 -7.786 -4.965 -3.329 327 HG21 VAL 41 HG21 VAL 41 -5.129 -5.044 -0.783 328 HG22 VAL 41 HG22 VAL 41 -4.901 -4.255 -2.343 329 HG23 VAL 41 HG23 VAL 41 -5.746 -5.801 -2.252 330 H GLY 42 H GLY 42 -5.546 -2.762 -4.280 331 HA2 GLY 42 HA3 GLY 42 -7.558 -1.594 -5.933 332 HA3 GLY 42 HA2 GLY 42 -6.079 -2.366 -6.487 333 H ARG 43 H ARG 43 -8.342 -2.715 -7.953 334 HA ARG 43 HA ARG 43 -9.981 -4.849 -7.276 335 HB2 ARG 43 HB3 ARG 43 -9.960 -5.146 -9.922 336 HB3 ARG 43 HB2 ARG 43 -10.823 -3.842 -9.130 337 HG2 ARG 43 HG3 ARG 43 -9.359 -2.250 -9.858 338 HG3 ARG 43 HG2 ARG 43 -8.003 -3.374 -9.944 339 HD2 ARG 43 HD3 ARG 43 -8.686 -2.728 -12.177 340 HD3 ARG 43 HD2 ARG 43 -9.032 -4.436 -11.910 341 HE ARG 43 HE ARG 43 -11.291 -2.844 -11.289 342 HH11 ARG 43 HH11 ARG 43 -9.476 -4.108 -13.989 343 HH12 ARG 43 HH12 ARG 43 -10.834 -4.104 -15.064 344 HH21 ARG 43 HH21 ARG 43 -13.078 -2.838 -12.702 345 HH22 ARG 43 HH22 ARG 43 -12.878 -3.383 -14.334 346 H ARG 44 H ARG 44 -7.148 -4.975 -9.448 347 HA ARG 44 HA ARG 44 -7.037 -7.765 -9.621 348 HB2 ARG 44 HB3 ARG 44 -4.804 -5.741 -9.871 349 HB3 ARG 44 HB2 ARG 44 -4.696 -7.424 -10.369 350 HG2 ARG 44 HG3 ARG 44 -6.514 -5.319 -11.519 351 HG3 ARG 44 HG2 ARG 44 -5.096 -6.034 -12.288 352 HD2 ARG 44 HD3 ARG 44 -6.525 -7.476 -13.219 353 HD3 ARG 44 HD2 ARG 44 -6.601 -8.234 -11.628 354 HE ARG 44 HE ARG 44 -8.480 -6.305 -11.466 355 HH11 ARG 44 HH11 ARG 44 -7.870 -8.827 -13.799 356 HH12 ARG 44 HH12 ARG 44 -9.537 -9.003 -14.232 357 HH21 ARG 44 HH21 ARG 44 -10.674 -6.534 -12.034 358 HH22 ARG 44 HH22 ARG 44 -11.129 -7.701 -13.231 359 H THR 45 H THR 45 -6.182 -5.641 -7.070 360 HA THR 45 HA THR 45 -4.230 -7.291 -5.816 361 HB THR 45 HB THR 45 -5.812 -5.415 -4.159 362 HG1 THR 45 HG1 THR 45 -4.088 -4.452 -6.185 363 HG21 THR 45 HG21 THR 45 -3.884 -6.144 -3.098 364 HG22 THR 45 HG22 THR 45 -3.435 -4.563 -3.738 365 HG23 THR 45 HG23 THR 45 -2.916 -6.030 -4.568 366 H TYR 46 H TYR 46 -7.654 -6.597 -4.964 367 HA TYR 46 HA TYR 46 -7.875 -8.338 -2.845 368 HB2 TYR 46 HB3 TYR 46 -10.257 -8.336 -3.170 369 HB3 TYR 46 HB2 TYR 46 -9.651 -6.740 -3.587 370 HD1 TYR 46 HD2 TYR 46 -10.400 -10.003 -5.272 371 HD2 TYR 46 HD1 TYR 46 -10.507 -5.755 -5.489 372 HE1 TYR 46 HE2 TYR 46 -11.516 -10.148 -7.446 373 HE2 TYR 46 HE1 TYR 46 -11.641 -5.896 -7.664 374 HH TYR 46 HH TYR 46 -11.660 -7.900 -9.605 375 H GLU 47 H GLU 47 -8.121 -9.069 -6.294 376 HA GLU 47 HA GLU 47 -8.734 -11.845 -5.839 377 HB2 GLU 47 HB3 GLU 47 -8.669 -10.045 -8.076 378 HB3 GLU 47 HB2 GLU 47 -7.737 -11.485 -8.465 379 HG2 GLU 47 HG3 GLU 47 -9.566 -12.886 -8.239 380 HG3 GLU 47 HG2 GLU 47 -10.462 -11.717 -7.273 381 H SER 48 H SER 48 -5.906 -9.904 -6.168 382 HA SER 48 HA SER 48 -4.193 -12.252 -6.524 383 HB2 SER 48 HB3 SER 48 -3.787 -10.262 -7.950 384 HB3 SER 48 HB2 SER 48 -3.431 -9.324 -6.499 385 HG SER 48 HG SER 48 -2.022 -11.617 -7.407 386 H PHE 49 H PHE 49 -5.650 -11.131 -3.967 387 HA PHE 49 HA PHE 49 -3.283 -11.073 -2.228 388 HB2 PHE 49 HB3 PHE 49 -5.337 -9.321 -2.268 389 HB3 PHE 49 HB2 PHE 49 -5.950 -10.474 -1.088 390 HD1 PHE 49 HD1 PHE 49 -3.114 -8.222 -1.859 391 HD2 PHE 49 HD2 PHE 49 -5.127 -10.519 1.107 392 HE1 PHE 49 HE1 PHE 49 -1.734 -7.173 -0.114 393 HE2 PHE 49 HE2 PHE 49 -3.751 -9.471 2.857 394 HZ PHE 49 HZ PHE 49 -2.052 -7.796 2.247 395 HA PRO 50 HA PRO 50 -4.534 -15.196 -1.030 396 HB2 PRO 50 HB3 PRO 50 -2.505 -15.731 0.638 397 HB3 PRO 50 HB2 PRO 50 -2.268 -15.644 -1.112 398 HG2 PRO 50 HG3 PRO 50 -1.673 -13.592 0.985 399 HG3 PRO 50 HG2 PRO 50 -0.697 -14.079 -0.413 400 HD2 PRO 50 HD3 PRO 50 -2.287 -11.846 -0.361 401 HD3 PRO 50 HD2 PRO 50 -1.853 -12.717 -1.845 402 H LYS 51 H LYS 51 -4.046 -12.527 1.161 403 HA LYS 51 HA LYS 51 -5.596 -13.962 3.215 404 HB2 LYS 51 HB3 LYS 51 -3.268 -12.154 3.382 405 HB3 LYS 51 HB2 LYS 51 -4.525 -11.872 4.579 406 HG2 LYS 51 HG3 LYS 51 -2.900 -13.359 5.505 407 HG3 LYS 51 HG2 LYS 51 -4.388 -14.263 5.215 408 HD2 LYS 51 HD3 LYS 51 -3.387 -15.019 3.039 409 HD3 LYS 51 HD2 LYS 51 -1.869 -14.285 3.560 410 HE2 LYS 51 HE3 LYS 51 -3.242 -16.202 5.381 411 HE3 LYS 51 HE2 LYS 51 -2.369 -16.834 3.986 412 HZ1 LYS 51 HZ1 LYS 51 -0.370 -16.170 4.819 413 HZ2 LYS 51 HZ2 LYS 51 -1.181 -16.465 6.273 414 HZ3 LYS 51 HZ3 LYS 51 -1.018 -14.881 5.703 415 H ARG 52 H ARG 52 -7.328 -13.152 1.598 416 HA ARG 52 HA ARG 52 -8.231 -10.500 2.502 417 HB2 ARG 52 HB3 ARG 52 -9.418 -10.290 0.337 418 HB3 ARG 52 HB2 ARG 52 -7.672 -10.384 0.156 419 HG2 ARG 52 HG3 ARG 52 -7.839 -12.159 -1.156 420 HG3 ARG 52 HG2 ARG 52 -8.829 -13.011 0.029 421 HD2 ARG 52 HD3 ARG 52 -10.203 -10.870 -1.446 422 HD3 ARG 52 HD2 ARG 52 -9.687 -12.240 -2.427 423 HE ARG 52 HE ARG 52 -11.769 -12.208 -0.438 424 HH11 ARG 52 HH11 ARG 52 -9.532 -14.207 -2.222 425 HH12 ARG 52 HH12 ARG 52 -10.476 -15.646 -2.037 426 HH21 ARG 52 HH21 ARG 52 -13.011 -14.101 -0.192 427 HH22 ARG 52 HH22 ARG 52 -12.451 -15.587 -0.885 428 HA PRO 53 HA PRO 53 -9.494 -9.545 3.422 429 HB2 PRO 53 HB3 PRO 53 -11.166 -9.429 5.679 430 HB3 PRO 53 HB2 PRO 53 -11.499 -8.740 4.090 431 HG2 PRO 53 HG3 PRO 53 -12.874 -10.864 5.324 432 HG3 PRO 53 HG2 PRO 53 -13.026 -10.340 3.641 433 HD2 PRO 53 HD3 PRO 53 -11.474 -12.601 4.790 434 HD3 PRO 53 HD2 PRO 53 -12.246 -12.449 3.197 435 H LEU 54 H LEU 54 -8.183 -8.756 5.106 436 HA LEU 54 HA LEU 54 -6.688 -10.715 6.508 437 HB2 LEU 54 HB3 LEU 54 -6.725 -7.712 6.557 438 HB3 LEU 54 HB2 LEU 54 -5.693 -8.629 7.637 439 HG LEU 54 HG LEU 54 -5.543 -9.207 4.717 440 HD11 LEU 54 HD11 LEU 54 -4.108 -6.886 5.988 441 HD12 LEU 54 HD12 LEU 54 -5.526 -6.725 4.951 442 HD13 LEU 54 HD13 LEU 54 -4.033 -7.406 4.304 443 HD21 LEU 54 HD21 LEU 54 -3.156 -8.906 6.413 444 HD22 LEU 54 HD22 LEU 54 -3.569 -10.158 5.241 445 HD23 LEU 54 HD23 LEU 54 -4.256 -10.208 6.865 446 HA PRO 55 HA PRO 55 -9.096 -11.044 10.201 447 HB2 PRO 55 HB3 PRO 55 -7.249 -12.082 11.872 448 HB3 PRO 55 HB2 PRO 55 -7.955 -13.011 10.543 449 HG2 PRO 55 HG3 PRO 55 -5.320 -11.593 10.672 450 HG3 PRO 55 HG2 PRO 55 -5.693 -13.202 10.028 451 HD2 PRO 55 HD3 PRO 55 -5.393 -11.013 8.447 452 HD3 PRO 55 HD2 PRO 55 -6.470 -12.362 8.033 453 H GLU 56 H GLU 56 -9.431 -10.147 12.222 454 HA GLU 56 HA GLU 56 -9.507 -8.412 13.690 455 HB2 GLU 56 HB3 GLU 56 -6.927 -9.675 13.839 456 HB3 GLU 56 HB2 GLU 56 -6.782 -7.973 14.254 457 HG2 GLU 56 HG3 GLU 56 -9.025 -9.426 15.497 458 HG3 GLU 56 HG2 GLU 56 -7.406 -9.891 16.016 459 H ARG 57 H ARG 57 -9.210 -7.648 10.842 460 HA ARG 57 HA ARG 57 -8.548 -4.876 11.347 461 HB2 ARG 57 HB3 ARG 57 -6.843 -4.609 9.787 462 HB3 ARG 57 HB2 ARG 57 -6.433 -6.124 10.569 463 HG2 ARG 57 HG3 ARG 57 -6.092 -6.653 8.371 464 HG3 ARG 57 HG2 ARG 57 -7.760 -7.184 8.590 465 HD2 ARG 57 HD3 ARG 57 -7.139 -5.766 6.510 466 HD3 ARG 57 HD2 ARG 57 -8.620 -5.409 7.390 467 HE ARG 57 HE ARG 57 -7.721 -3.399 8.061 468 HH11 ARG 57 HH11 ARG 57 -5.244 -5.346 6.557 469 HH12 ARG 57 HH12 ARG 57 -4.104 -4.046 6.468 470 HH21 ARG 57 HH21 ARG 57 -6.222 -1.694 7.950 471 HH22 ARG 57 HH22 ARG 57 -4.658 -1.974 7.259 472 H THR 58 H THR 58 -9.147 -3.461 9.492 473 HA THR 58 HA THR 58 -11.543 -4.544 8.192 474 HB THR 58 HB THR 58 -10.756 -1.639 8.353 475 HG1 THR 58 HG1 THR 58 -10.868 -2.295 10.460 476 HG21 THR 58 HG21 THR 58 -13.454 -2.948 8.125 477 HG22 THR 58 HG22 THR 58 -12.574 -2.170 6.810 478 HG23 THR 58 HG23 THR 58 -13.130 -1.216 8.185 479 H ASN 59 H ASN 59 -11.602 -4.883 6.058 480 HA ASN 59 HA ASN 59 -9.331 -3.919 4.465 481 HB2 ASN 59 HB3 ASN 59 -11.215 -6.243 4.063 482 HB3 ASN 59 HB2 ASN 59 -10.062 -5.714 2.841 483 HD21 ASN 59 HD21 ASN 59 -10.167 -6.532 6.285 484 HD22 ASN 59 HD22 ASN 59 -8.677 -7.400 6.304 485 H VAL 60 H VAL 60 -9.638 -3.063 2.403 486 HA VAL 60 HA VAL 60 -12.365 -2.229 1.711 487 HB VAL 60 HB VAL 60 -9.942 -0.431 1.861 488 HG11 VAL 60 HG11 VAL 60 -10.778 0.493 -0.018 489 HG12 VAL 60 HG12 VAL 60 -11.925 1.230 1.100 490 HG13 VAL 60 HG13 VAL 60 -12.372 -0.225 0.209 491 HG21 VAL 60 HG21 VAL 60 -10.868 0.500 3.676 492 HG22 VAL 60 HG22 VAL 60 -11.799 -0.995 3.770 493 HG23 VAL 60 HG23 VAL 60 -12.496 0.431 3.002 494 H VAL 61 H VAL 61 -12.834 -2.450 -0.406 495 HA VAL 61 HA VAL 61 -10.626 -3.211 -2.199 496 HB VAL 61 HB VAL 61 -13.549 -3.968 -2.344 497 HG11 VAL 61 HG11 VAL 61 -12.928 -3.919 -4.571 498 HG12 VAL 61 HG12 VAL 61 -12.564 -5.585 -4.122 499 HG13 VAL 61 HG13 VAL 61 -11.265 -4.396 -4.226 500 HG21 VAL 61 HG21 VAL 61 -11.941 -5.031 -0.604 501 HG22 VAL 61 HG22 VAL 61 -11.277 -5.881 -2.000 502 HG23 VAL 61 HG23 VAL 61 -12.979 -6.073 -1.577 503 H LEU 62 H LEU 62 -10.382 -2.237 -4.142 504 HA LEU 62 HA LEU 62 -12.299 -0.121 -4.858 505 HB2 LEU 62 HB3 LEU 62 -10.065 0.651 -3.870 506 HB3 LEU 62 HB2 LEU 62 -9.337 0.069 -5.354 507 HG LEU 62 HG LEU 62 -10.782 1.634 -6.635 508 HD11 LEU 62 HD11 LEU 62 -11.637 3.552 -5.025 509 HD12 LEU 62 HD12 LEU 62 -11.785 2.200 -3.902 510 HD13 LEU 62 HD13 LEU 62 -12.646 2.166 -5.441 511 HD21 LEU 62 HD21 LEU 62 -8.793 2.545 -4.616 512 HD22 LEU 62 HD22 LEU 62 -9.656 3.750 -5.573 513 HD23 LEU 62 HD23 LEU 62 -8.685 2.516 -6.376 514 H THR 63 H THR 63 -13.345 -1.102 -6.505 515 HA THR 63 HA THR 63 -11.719 -1.915 -8.813 516 HB THR 63 HB THR 63 -12.565 -3.928 -7.672 517 HG1 THR 63 HG1 THR 63 -13.411 -4.857 -9.493 518 HG21 THR 63 HG21 THR 63 -14.666 -2.786 -6.797 519 HG22 THR 63 HG22 THR 63 -14.818 -4.442 -7.385 520 HG23 THR 63 HG23 THR 63 -15.349 -3.096 -8.393 521 H HIS 64 H HIS 64 -12.602 -1.466 -10.845 522 HA HIS 64 HA HIS 64 -14.283 0.819 -10.960 523 HB2 HIS 64 HB3 HIS 64 -12.797 -0.857 -12.871 524 HB3 HIS 64 HB2 HIS 64 -14.247 -0.107 -13.531 525 HD1 HIS 64 HD1 HIS 64 -13.493 1.873 -14.804 526 HD2 HIS 64 HD2 HIS 64 -11.482 1.502 -11.186 527 HE1 HIS 64 HE1 HIS 64 -12.025 3.908 -14.639 528 HE2 HIS 64 HE2 HIS 64 -10.758 3.621 -12.481 529 H GLN 65 H GLN 65 -14.830 -2.616 -11.317 530 HA GLN 65 HA GLN 65 -17.241 -2.695 -12.640 531 HB2 GLN 65 HB3 GLN 65 -16.027 -4.403 -10.504 532 HB3 GLN 65 HB2 GLN 65 -17.680 -4.712 -11.018 533 HG2 GLN 65 HG3 GLN 65 -17.027 -5.672 -12.914 534 HG3 GLN 65 HG2 GLN 65 -15.846 -4.408 -13.252 535 HE21 GLN 65 HE21 GLN 65 -13.927 -4.508 -11.634 536 HE22 GLN 65 HE22 GLN 65 -13.227 -6.075 -11.435 537 H GLU 66 H GLU 66 -19.245 -2.049 -12.228 538 HA GLU 66 HA GLU 66 -19.806 -0.689 -9.737 539 HB2 GLU 66 HB3 GLU 66 -22.041 -0.251 -10.861 540 HB3 GLU 66 HB2 GLU 66 -20.626 0.430 -11.652 541 HG2 GLU 66 HG3 GLU 66 -21.283 -2.234 -12.611 542 HG3 GLU 66 HG2 GLU 66 -22.589 -1.074 -12.844 543 H ASP 67 H ASP 67 -20.702 -3.649 -11.370 544 HA ASP 67 HA ASP 67 -22.621 -4.311 -9.274 545 HB2 ASP 67 HB3 ASP 67 -22.693 -4.738 -11.963 546 HB3 ASP 67 HB2 ASP 67 -22.110 -6.297 -11.388 547 H TYR 68 H TYR 68 -19.535 -4.354 -9.016 548 HA TYR 68 HA TYR 68 -18.989 -7.154 -8.572 549 HB2 TYR 68 HB3 TYR 68 -17.203 -5.591 -9.285 550 HB3 TYR 68 HB2 TYR 68 -17.360 -4.738 -7.752 551 HD1 TYR 68 HD2 TYR 68 -16.853 -6.001 -5.615 552 HD2 TYR 68 HD1 TYR 68 -15.855 -7.513 -9.464 553 HE1 TYR 68 HE2 TYR 68 -15.252 -7.557 -4.583 554 HE2 TYR 68 HE1 TYR 68 -14.254 -9.075 -8.442 555 HH TYR 68 HH TYR 68 -13.802 -10.128 -6.328 556 H GLN 69 H GLN 69 -18.660 -8.164 -6.568 557 HA GLN 69 HA GLN 69 -19.652 -6.689 -4.223 558 HB2 GLN 69 HB3 GLN 69 -20.389 -9.519 -4.987 559 HB3 GLN 69 HB2 GLN 69 -20.857 -8.712 -3.496 560 HG2 GLN 69 HG3 GLN 69 -21.632 -7.821 -6.264 561 HG3 GLN 69 HG2 GLN 69 -22.653 -8.753 -5.169 562 HE21 GLN 69 HE21 GLN 69 -21.897 -5.712 -6.242 563 HE22 GLN 69 HE22 GLN 69 -22.583 -4.785 -4.955 564 H ALA 70 H ALA 70 -18.042 -6.565 -2.824 565 HA ALA 70 HA ALA 70 -16.134 -8.789 -2.617 566 HB1 ALA 70 HB1 ALA 70 -14.530 -7.293 -1.855 567 HB2 ALA 70 HB2 ALA 70 -15.734 -6.114 -1.333 568 HB3 ALA 70 HB3 ALA 70 -15.413 -6.345 -3.051 569 H GLN 71 H GLN 71 -17.141 -10.199 -1.254 570 HA GLN 71 HA GLN 71 -18.515 -9.406 1.107 571 HB2 GLN 71 HB3 GLN 71 -17.441 -12.108 0.281 572 HB3 GLN 71 HB2 GLN 71 -18.527 -11.825 1.634 573 HG2 GLN 71 HG3 GLN 71 -20.326 -11.685 0.320 574 HG3 GLN 71 HG2 GLN 71 -19.482 -10.734 -0.902 575 HE21 GLN 71 HE21 GLN 71 -18.784 -11.709 -2.705 576 HE22 GLN 71 HE22 GLN 71 -18.908 -13.403 -3.022 577 H GLY 72 H GLY 72 -17.727 -8.914 3.038 578 HA2 GLY 72 HA3 GLY 72 -16.317 -9.396 4.914 579 HA3 GLY 72 HA2 GLY 72 -15.088 -9.965 3.796 580 H ALA 73 H ALA 73 -15.512 -7.563 2.029 581 HA ALA 73 HA ALA 73 -14.290 -5.533 3.780 582 HB1 ALA 73 HB1 ALA 73 -12.805 -4.939 1.862 583 HB2 ALA 73 HB2 ALA 73 -13.376 -6.392 1.041 584 HB3 ALA 73 HB3 ALA 73 -12.491 -6.528 2.561 585 H VAL 74 H VAL 74 -14.233 -3.337 2.647 586 HA VAL 74 HA VAL 74 -16.921 -2.745 1.761 587 HB VAL 74 HB VAL 74 -14.759 -0.677 1.791 588 HG11 VAL 74 HG11 VAL 74 -16.456 0.798 1.942 589 HG12 VAL 74 HG12 VAL 74 -17.395 -0.228 3.026 590 HG13 VAL 74 HG13 VAL 74 -17.403 -0.540 1.290 591 HG21 VAL 74 HG21 VAL 74 -15.729 -2.213 4.130 592 HG22 VAL 74 HG22 VAL 74 -15.616 -0.463 4.318 593 HG23 VAL 74 HG23 VAL 74 -14.188 -1.396 3.868 594 H VAL 75 H VAL 75 -17.536 -1.966 -0.232 595 HA VAL 75 HA VAL 75 -15.503 -2.192 -2.354 596 HB VAL 75 HB VAL 75 -18.470 -2.653 -2.641 597 HG11 VAL 75 HG11 VAL 75 -17.353 -1.884 -4.685 598 HG12 VAL 75 HG12 VAL 75 -17.895 -3.556 -4.827 599 HG13 VAL 75 HG13 VAL 75 -16.191 -3.203 -4.541 600 HG21 VAL 75 HG21 VAL 75 -18.194 -4.761 -1.991 601 HG22 VAL 75 HG22 VAL 75 -16.578 -4.320 -1.440 602 HG23 VAL 75 HG23 VAL 75 -16.809 -4.969 -3.063 603 H VAL 76 H VAL 76 -15.263 -0.636 -3.814 604 HA VAL 76 HA VAL 76 -17.214 1.429 -4.251 605 HB VAL 76 HB VAL 76 -15.816 3.320 -3.647 606 HG11 VAL 76 HG11 VAL 76 -17.357 2.296 -1.967 607 HG12 VAL 76 HG12 VAL 76 -16.024 3.219 -1.272 608 HG13 VAL 76 HG13 VAL 76 -15.964 1.456 -1.286 609 HG21 VAL 76 HG21 VAL 76 -13.618 3.117 -3.448 610 HG22 VAL 76 HG22 VAL 76 -13.750 1.363 -3.565 611 HG23 VAL 76 HG23 VAL 76 -13.841 2.150 -1.989 612 H HIS 77 H HIS 77 -16.562 2.854 -6.053 613 HA HIS 77 HA HIS 77 -14.468 1.594 -7.702 614 HB2 HIS 77 HB3 HIS 77 -16.698 2.978 -9.081 615 HB3 HIS 77 HB2 HIS 77 -15.813 1.526 -9.540 616 HD1 HIS 77 HD1 HIS 77 -16.403 -0.488 -7.517 617 HD2 HIS 77 HD2 HIS 77 -19.268 2.305 -8.638 618 HE1 HIS 77 HE1 HIS 77 -18.613 -1.500 -6.877 619 HE2 HIS 77 HE2 HIS 77 -20.324 0.252 -7.472 620 H ASP 78 H ASP 78 -15.566 4.513 -6.310 621 HA ASP 78 HA ASP 78 -13.774 6.026 -8.091 622 HB2 ASP 78 HB3 ASP 78 -16.455 6.485 -7.657 623 HB3 ASP 78 HB2 ASP 78 -15.687 7.620 -6.551 624 H VAL 79 H VAL 79 -12.826 7.994 -7.065 625 HA VAL 79 HA VAL 79 -11.491 7.238 -4.643 626 HB VAL 79 HB VAL 79 -11.342 9.892 -6.067 627 HG11 VAL 79 HG11 VAL 79 -10.404 9.401 -3.654 628 HG12 VAL 79 HG12 VAL 79 -9.488 10.361 -4.816 629 HG13 VAL 79 HG13 VAL 79 -9.088 8.662 -4.567 630 HG21 VAL 79 HG21 VAL 79 -10.503 7.300 -6.957 631 HG22 VAL 79 HG22 VAL 79 -9.091 8.320 -6.680 632 HG23 VAL 79 HG23 VAL 79 -10.367 8.857 -7.773 633 H ALA 80 H ALA 80 -13.893 9.633 -5.571 634 HA ALA 80 HA ALA 80 -13.993 10.941 -3.046 635 HB1 ALA 80 HB1 ALA 80 -16.416 11.488 -4.089 636 HB2 ALA 80 HB2 ALA 80 -15.557 11.005 -5.551 637 HB3 ALA 80 HB3 ALA 80 -14.941 12.330 -4.564 638 H ALA 81 H ALA 81 -15.653 8.234 -4.507 639 HA ALA 81 HA ALA 81 -17.737 7.872 -2.692 640 HB1 ALA 81 HB1 ALA 81 -17.190 5.322 -3.325 641 HB2 ALA 81 HB2 ALA 81 -16.280 6.141 -4.594 642 HB3 ALA 81 HB3 ALA 81 -18.010 6.434 -4.421 643 H VAL 82 H VAL 82 -14.727 5.955 -2.716 644 HA VAL 82 HA VAL 82 -14.943 4.805 -0.242 645 HB VAL 82 HB VAL 82 -13.149 4.493 -2.084 646 HG11 VAL 82 HG11 VAL 82 -11.249 5.742 -2.088 647 HG12 VAL 82 HG12 VAL 82 -11.376 6.146 -0.376 648 HG13 VAL 82 HG13 VAL 82 -12.392 6.974 -1.555 649 HG21 VAL 82 HG21 VAL 82 -11.736 3.324 -0.587 650 HG22 VAL 82 HG22 VAL 82 -13.361 3.250 0.096 651 HG23 VAL 82 HG23 VAL 82 -12.175 4.376 0.758 652 H PHE 83 H PHE 83 -13.965 8.084 -1.014 653 HA PHE 83 HA PHE 83 -12.788 8.760 1.443 654 HB2 PHE 83 HB3 PHE 83 -13.833 10.206 -0.894 655 HB3 PHE 83 HB2 PHE 83 -13.928 11.116 0.610 656 HD1 PHE 83 HD2 PHE 83 -11.590 10.542 2.071 657 HD2 PHE 83 HD1 PHE 83 -12.039 10.863 -2.149 658 HE1 PHE 83 HE2 PHE 83 -9.209 11.129 1.866 659 HE2 PHE 83 HE1 PHE 83 -9.658 11.449 -2.362 660 HZ PHE 83 HZ PHE 83 -8.241 11.583 -0.352 661 H ALA 84 H ALA 84 -16.159 8.867 0.364 662 HA ALA 84 HA ALA 84 -17.221 10.151 2.625 663 HB1 ALA 84 HB1 ALA 84 -18.378 9.632 0.399 664 HB2 ALA 84 HB2 ALA 84 -19.341 9.483 1.869 665 HB3 ALA 84 HB3 ALA 84 -18.702 8.039 1.084 666 H TYR 85 H TYR 85 -16.531 6.781 1.923 667 HA TYR 85 HA TYR 85 -17.691 5.671 4.235 668 HB2 TYR 85 HB3 TYR 85 -17.011 3.760 3.276 669 HB3 TYR 85 HB2 TYR 85 -16.195 4.708 2.044 670 HD1 TYR 85 HD1 TYR 85 -15.590 3.500 5.541 671 HD2 TYR 85 HD2 TYR 85 -13.973 4.281 1.688 672 HE1 TYR 85 HE1 TYR 85 -13.427 2.580 6.267 673 HE2 TYR 85 HE2 TYR 85 -11.806 3.367 2.401 674 HH TYR 85 HH TYR 85 -10.570 3.000 4.505 675 H ALA 86 H ALA 86 -14.243 6.405 3.616 676 HA ALA 86 HA ALA 86 -13.155 6.027 6.049 677 HB1 ALA 86 HB1 ALA 86 -11.699 8.090 5.521 678 HB2 ALA 86 HB2 ALA 86 -12.627 8.167 4.023 679 HB3 ALA 86 HB3 ALA 86 -11.679 6.728 4.399 680 H LYS 87 H LYS 87 -15.224 8.748 5.157 681 HA LYS 87 HA LYS 87 -14.796 10.311 7.469 682 HB2 LYS 87 HB3 LYS 87 -16.231 10.636 5.175 683 HB3 LYS 87 HB2 LYS 87 -17.523 10.324 6.326 684 HG2 LYS 87 HG3 LYS 87 -17.316 12.636 6.329 685 HG3 LYS 87 HG2 LYS 87 -16.415 12.136 7.762 686 HD2 LYS 87 HD3 LYS 87 -14.357 12.561 6.769 687 HD3 LYS 87 HD2 LYS 87 -15.019 12.478 5.135 688 HE2 LYS 87 HE3 LYS 87 -16.382 14.559 5.834 689 HE3 LYS 87 HE2 LYS 87 -15.205 14.697 7.140 690 HZ1 LYS 87 HZ1 LYS 87 -14.581 14.660 4.236 691 HZ2 LYS 87 HZ2 LYS 87 -13.440 14.766 5.480 692 HZ3 LYS 87 HZ3 LYS 87 -14.548 16.021 5.241 693 H GLN 88 H GLN 88 -17.213 7.887 6.661 694 HA GLN 88 HA GLN 88 -18.650 7.889 9.061 695 HB2 GLN 88 HB3 GLN 88 -18.845 6.524 6.702 696 HB3 GLN 88 HB2 GLN 88 -18.333 5.246 7.796 697 HG2 GLN 88 HG3 GLN 88 -20.487 5.019 8.284 698 HG3 GLN 88 HG2 GLN 88 -20.306 6.498 9.226 699 HE21 GLN 88 HE21 GLN 88 -20.222 8.462 7.463 700 HE22 GLN 88 HE22 GLN 88 -21.651 8.516 6.493 701 H HIS 89 H HIS 89 -15.526 6.674 8.320 702 HA HIS 89 HA HIS 89 -15.385 5.312 10.928 703 HB2 HIS 89 HB3 HIS 89 -14.218 4.710 8.262 704 HB3 HIS 89 HB2 HIS 89 -13.202 4.382 9.663 705 HD1 HIS 89 HD1 HIS 89 -15.238 3.244 11.616 706 HD2 HIS 89 HD2 HIS 89 -15.128 2.251 7.583 707 HE1 HIS 89 HE1 HIS 89 -16.384 1.012 11.442 708 HE2 HIS 89 HE2 HIS 89 -16.388 0.476 8.980 709 HA PRO 90 HA PRO 90 -12.796 9.184 11.108 710 HB2 PRO 90 HB3 PRO 90 -13.519 9.845 13.646 711 HB3 PRO 90 HB2 PRO 90 -14.430 10.341 12.215 712 HG2 PRO 90 HG3 PRO 90 -14.949 8.072 14.098 713 HG3 PRO 90 HG2 PRO 90 -16.096 9.226 13.394 714 HD2 PRO 90 HD3 PRO 90 -15.794 6.725 12.425 715 HD3 PRO 90 HD2 PRO 90 -16.179 8.105 11.376 716 H ASP 91 H ASP 91 -13.289 6.814 13.752 717 HA ASP 91 HA ASP 91 -10.762 7.300 14.936 718 HB2 ASP 91 HB3 ASP 91 -12.570 4.889 15.187 719 HB3 ASP 91 HB2 ASP 91 -11.225 5.280 16.255 720 H GLN 92 H GLN 92 -11.605 5.637 12.109 721 HA GLN 92 HA GLN 92 -9.238 3.913 12.257 722 HB2 GLN 92 HB3 GLN 92 -11.306 3.898 10.068 723 HB3 GLN 92 HB2 GLN 92 -10.165 2.630 10.496 724 HG2 GLN 92 HG3 GLN 92 -11.491 2.749 12.792 725 HG3 GLN 92 HG2 GLN 92 -12.759 3.347 11.724 726 HE21 GLN 92 HE21 GLN 92 -10.243 0.862 11.418 727 HE22 GLN 92 HE22 GLN 92 -11.317 -0.413 10.966 728 H GLU 93 H GLU 93 -7.639 3.945 10.664 729 HA GLU 93 HA GLU 93 -7.483 6.476 9.178 730 HB2 GLU 93 HB3 GLU 93 -5.572 4.915 10.708 731 HB3 GLU 93 HB2 GLU 93 -4.973 5.256 9.091 732 HG2 GLU 93 HG3 GLU 93 -5.870 7.690 9.751 733 HG3 GLU 93 HG2 GLU 93 -5.472 7.075 11.355 734 H LEU 94 H LEU 94 -6.434 6.426 7.056 735 HA LEU 94 HA LEU 94 -7.248 4.038 5.561 736 HB2 LEU 94 HB3 LEU 94 -7.004 6.930 4.920 737 HB3 LEU 94 HB2 LEU 94 -6.707 5.790 3.622 738 HG LEU 94 HG LEU 94 -8.972 4.784 4.137 739 HD11 LEU 94 HD11 LEU 94 -9.775 7.322 5.413 740 HD12 LEU 94 HD12 LEU 94 -8.882 6.181 6.419 741 HD13 LEU 94 HD13 LEU 94 -10.389 5.685 5.649 742 HD21 LEU 94 HD21 LEU 94 -10.092 7.064 3.246 743 HD22 LEU 94 HD22 LEU 94 -9.154 5.971 2.228 744 HD23 LEU 94 HD23 LEU 94 -8.393 7.404 2.919 745 H VAL 95 H VAL 95 -5.791 2.731 4.651 746 HA VAL 95 HA VAL 95 -3.074 3.732 4.177 747 HB VAL 95 HB VAL 95 -3.608 1.056 5.467 748 HG11 VAL 95 HG11 VAL 95 -1.564 0.731 4.559 749 HG12 VAL 95 HG12 VAL 95 -1.034 1.624 5.984 750 HG13 VAL 95 HG13 VAL 95 -1.221 2.457 4.441 751 HG21 VAL 95 HG21 VAL 95 -3.216 3.738 6.642 752 HG22 VAL 95 HG22 VAL 95 -2.295 2.420 7.368 753 HG23 VAL 95 HG23 VAL 95 -4.054 2.326 7.286 754 H ILE 96 H ILE 96 -2.864 3.556 2.041 755 HA ILE 96 HA ILE 96 -4.168 1.455 0.548 756 HB ILE 96 HB ILE 96 -2.126 3.344 -0.592 757 HG12 ILE 96 HG13 ILE 96 -3.633 4.767 0.661 758 HG13 ILE 96 HG12 ILE 96 -4.002 4.919 -1.053 759 HG21 ILE 96 HG21 ILE 96 -4.605 2.617 -2.017 760 HG22 ILE 96 HG22 ILE 96 -3.448 1.314 -1.744 761 HG23 ILE 96 HG23 ILE 96 -2.952 2.767 -2.613 762 HD11 ILE 96 HD11 ILE 96 -5.990 4.794 0.428 763 HD12 ILE 96 HD12 ILE 96 -5.521 3.144 0.837 764 HD13 ILE 96 HD13 ILE 96 -5.942 3.554 -0.825 765 H ALA 97 H ALA 97 -3.312 -0.464 0.075 766 HA ALA 97 HA ALA 97 -0.425 -0.836 0.502 767 HB1 ALA 97 HB1 ALA 97 -2.794 -2.536 0.993 768 HB2 ALA 97 HB2 ALA 97 -1.292 -2.386 1.906 769 HB3 ALA 97 HB3 ALA 97 -1.335 -3.355 0.433 770 H GLY 98 H GLY 98 -3.000 -1.147 -1.828 771 HA2 GLY 98 HA3 GLY 98 -1.274 -1.206 -4.035 772 HA3 GLY 98 HA2 GLY 98 -1.734 -2.861 -3.668 773 H GLY 99 H GLY 99 -4.139 -1.719 -6.176 774 HA2 GLY 99 HA3 GLY 99 -1.413 -2.610 -5.746 775 HA3 GLY 99 HA2 GLY 99 -2.288 -2.601 -7.267 776 H ALA 100 H ALA 100 -0.228 -1.806 -8.116 777 HA ALA 100 HA ALA 100 0.892 0.662 -7.391 778 HB1 ALA 100 HB1 ALA 100 0.967 -0.627 -10.114 779 HB2 ALA 100 HB2 ALA 100 2.020 -1.062 -8.767 780 HB3 ALA 100 HB3 ALA 100 2.103 0.556 -9.466 781 H GLN 101 H GLN 101 -1.739 -0.163 -9.566 782 HA GLN 101 HA GLN 101 -1.927 2.385 -10.811 783 HB2 GLN 101 HB3 GLN 101 -3.313 -0.136 -10.926 784 HB3 GLN 101 HB2 GLN 101 -4.476 1.181 -10.846 785 HG2 GLN 101 HG3 GLN 101 -2.287 1.642 -12.725 786 HG3 GLN 101 HG2 GLN 101 -3.296 0.250 -13.116 787 HE21 GLN 101 HE21 GLN 101 -4.161 3.307 -11.572 788 HE22 GLN 101 HE22 GLN 101 -5.301 3.797 -12.774 789 H ILE 102 H ILE 102 -3.355 0.950 -7.938 790 HA ILE 102 HA ILE 102 -5.271 2.964 -7.436 791 HB ILE 102 HB ILE 102 -3.879 1.248 -5.377 792 HG12 ILE 102 HG13 ILE 102 -4.817 -0.137 -7.178 793 HG13 ILE 102 HG12 ILE 102 -5.725 -0.337 -5.684 794 HG21 ILE 102 HG21 ILE 102 -5.093 2.972 -4.300 795 HG22 ILE 102 HG22 ILE 102 -6.095 1.524 -4.202 796 HG23 ILE 102 HG23 ILE 102 -6.469 2.777 -5.385 797 HD11 ILE 102 HD11 ILE 102 -7.599 0.258 -6.690 798 HD12 ILE 102 HD12 ILE 102 -6.715 0.287 -8.215 799 HD13 ILE 102 HD13 ILE 102 -6.874 1.761 -7.261 800 H PHE 103 H PHE 103 -1.884 2.588 -6.543 801 HA PHE 103 HA PHE 103 -1.704 4.708 -4.715 802 HB2 PHE 103 HB3 PHE 103 0.341 3.445 -6.542 803 HB3 PHE 103 HB2 PHE 103 0.753 4.713 -5.394 804 HD1 PHE 103 HD1 PHE 103 -0.917 3.930 -3.082 805 HD2 PHE 103 HD2 PHE 103 1.441 1.574 -5.727 806 HE1 PHE 103 HE1 PHE 103 -0.635 2.239 -1.318 807 HE2 PHE 103 HE2 PHE 103 1.726 -0.122 -3.968 808 HZ PHE 103 HZ PHE 103 0.686 0.209 -1.760 809 H THR 104 H THR 104 -1.400 4.599 -8.229 810 HA THR 104 HA THR 104 -0.485 7.183 -8.695 811 HB THR 104 HB THR 104 -2.400 5.566 -10.386 812 HG1 THR 104 HG1 THR 104 -0.474 4.457 -9.988 813 HG21 THR 104 HG21 THR 104 -0.478 7.255 -11.756 814 HG22 THR 104 HG22 THR 104 -1.653 8.166 -10.805 815 HG23 THR 104 HG23 THR 104 -2.204 7.033 -12.039 816 H ALA 105 H ALA 105 -3.849 6.017 -8.511 817 HA ALA 105 HA ALA 105 -5.099 8.468 -8.993 818 HB1 ALA 105 HB1 ALA 105 -6.439 6.677 -7.074 819 HB2 ALA 105 HB2 ALA 105 -5.986 5.952 -8.617 820 HB3 ALA 105 HB3 ALA 105 -7.030 7.374 -8.583 821 H PHE 106 H PHE 106 -4.559 6.920 -5.794 822 HA PHE 106 HA PHE 106 -5.328 9.208 -4.354 823 HB2 PHE 106 HB3 PHE 106 -3.831 6.700 -3.654 824 HB3 PHE 106 HB2 PHE 106 -4.032 7.989 -2.473 825 HD1 PHE 106 HD2 PHE 106 -6.116 6.060 -4.901 826 HD2 PHE 106 HD1 PHE 106 -5.801 7.808 -1.033 827 HE1 PHE 106 HE2 PHE 106 -8.339 5.172 -4.322 828 HE2 PHE 106 HE1 PHE 106 -8.020 6.923 -0.448 829 HZ PHE 106 HZ PHE 106 -9.291 5.604 -2.093 830 H LYS 107 H LYS 107 -2.471 8.548 -6.092 831 HA LYS 107 HA LYS 107 -0.422 9.614 -4.640 832 HB2 LYS 107 HB3 LYS 107 0.731 9.806 -6.605 833 HB3 LYS 107 HB2 LYS 107 -0.596 8.798 -7.159 834 HG2 LYS 107 HG3 LYS 107 -1.746 10.854 -7.955 835 HG3 LYS 107 HG2 LYS 107 -0.303 11.771 -7.521 836 HD2 LYS 107 HD3 LYS 107 1.020 10.606 -9.118 837 HD3 LYS 107 HD2 LYS 107 -0.257 9.423 -9.406 838 HE2 LYS 107 HE3 LYS 107 -1.527 10.897 -10.650 839 HE3 LYS 107 HE2 LYS 107 -0.793 12.316 -9.905 840 HZ1 LYS 107 HZ1 LYS 107 0.830 12.361 -11.417 841 HZ2 LYS 107 HZ2 LYS 107 -0.168 11.355 -12.341 842 HZ3 LYS 107 HZ3 LYS 107 1.060 10.684 -11.392 843 H ASP 108 H ASP 108 -3.007 11.365 -6.252 844 HA ASP 108 HA ASP 108 -1.898 13.942 -5.491 845 HB2 ASP 108 HB3 ASP 108 -3.561 13.079 -7.562 846 HB3 ASP 108 HB2 ASP 108 -4.617 14.021 -6.514 847 H ASP 109 H ASP 109 -4.597 11.834 -4.647 848 HA ASP 109 HA ASP 109 -5.607 13.711 -2.677 849 HB2 ASP 109 HB3 ASP 109 -6.551 11.219 -3.933 850 HB3 ASP 109 HB2 ASP 109 -7.030 11.431 -2.251 851 H VAL 110 H VAL 110 -2.970 11.910 -2.556 852 HA VAL 110 HA VAL 110 -3.408 10.551 -0.036 853 HB VAL 110 HB VAL 110 -1.955 9.527 -1.724 854 HG11 VAL 110 HG11 VAL 110 -1.011 12.026 -2.195 855 HG12 VAL 110 HG12 VAL 110 -0.218 10.542 -2.724 856 HG13 VAL 110 HG13 VAL 110 0.302 11.339 -1.240 857 HG21 VAL 110 HG21 VAL 110 -0.184 8.855 -0.264 858 HG22 VAL 110 HG22 VAL 110 -1.627 9.115 0.717 859 HG23 VAL 110 HG23 VAL 110 -0.345 10.327 0.694 860 H ASP 111 H ASP 111 -2.072 10.927 1.846 861 HA ASP 111 HA ASP 111 -1.174 13.721 2.099 862 HB2 ASP 111 HB3 ASP 111 -3.397 12.734 3.323 863 HB3 ASP 111 HB2 ASP 111 -2.175 12.422 4.552 864 H THR 112 H THR 112 -0.801 10.384 3.206 865 HA THR 112 HA THR 112 1.853 11.109 4.256 866 HB THR 112 HB THR 112 0.151 8.747 5.068 867 HG1 THR 112 HG1 THR 112 -0.300 9.919 6.908 868 HG21 THR 112 HG21 THR 112 1.771 9.011 7.116 869 HG22 THR 112 HG22 THR 112 2.838 9.702 5.894 870 HG23 THR 112 HG23 THR 112 2.226 8.059 5.703 871 H LEU 113 H LEU 113 3.555 9.511 3.994 872 HA LEU 113 HA LEU 113 3.124 7.563 1.855 873 HB2 LEU 113 HB3 LEU 113 4.284 10.025 1.393 874 HB3 LEU 113 HB2 LEU 113 5.668 8.976 1.623 875 HG LEU 113 HG LEU 113 5.029 7.591 -0.218 876 HD11 LEU 113 HD11 LEU 113 2.820 8.912 -1.367 877 HD12 LEU 113 HD12 LEU 113 2.412 8.609 0.321 878 HD13 LEU 113 HD13 LEU 113 2.893 7.272 -0.723 879 HD21 LEU 113 HD21 LEU 113 4.607 9.615 -1.947 880 HD22 LEU 113 HD22 LEU 113 6.178 9.237 -1.239 881 HD23 LEU 113 HD23 LEU 113 5.179 10.511 -0.539 882 H LEU 114 H LEU 114 4.046 5.672 2.288 883 HA LEU 114 HA LEU 114 6.401 5.568 4.031 884 HB2 LEU 114 HB3 LEU 114 4.091 3.656 4.337 885 HB3 LEU 114 HB2 LEU 114 5.511 3.789 5.355 886 HG LEU 114 HG LEU 114 3.750 6.175 5.148 887 HD11 LEU 114 HD11 LEU 114 2.938 3.560 6.274 888 HD12 LEU 114 HD12 LEU 114 1.958 4.854 5.584 889 HD13 LEU 114 HD13 LEU 114 2.579 5.000 7.228 890 HD21 LEU 114 HD21 LEU 114 4.753 6.776 7.075 891 HD22 LEU 114 HD22 LEU 114 5.982 5.621 6.555 892 HD23 LEU 114 HD23 LEU 114 4.747 5.133 7.716 893 H VAL 115 H VAL 115 7.962 4.543 2.953 894 HA VAL 115 HA VAL 115 7.197 2.278 1.235 895 HB VAL 115 HB VAL 115 8.868 2.985 -0.433 896 HG11 VAL 115 HG11 VAL 115 6.394 3.628 -0.473 897 HG12 VAL 115 HG12 VAL 115 7.488 4.534 -1.520 898 HG13 VAL 115 HG13 VAL 115 6.935 5.239 -0.001 899 HG21 VAL 115 HG21 VAL 115 10.358 4.302 0.891 900 HG22 VAL 115 HG22 VAL 115 9.070 5.428 1.319 901 HG23 VAL 115 HG23 VAL 115 9.661 5.355 -0.340 902 H THR 116 H THR 116 8.580 0.586 1.119 903 HA THR 116 HA THR 116 10.921 0.663 2.907 904 HB THR 116 HB THR 116 9.109 -1.628 2.121 905 HG1 THR 116 HG1 THR 116 8.633 -1.658 4.298 906 HG21 THR 116 HG21 THR 116 11.727 -1.688 3.574 907 HG22 THR 116 HG22 THR 116 11.189 -2.680 2.218 908 HG23 THR 116 HG23 THR 116 10.487 -2.918 3.819 909 H ARG 117 H ARG 117 12.547 1.205 1.517 910 HA ARG 117 HA ARG 117 12.718 0.026 -1.103 911 HB2 ARG 117 HB3 ARG 117 14.929 1.339 -1.095 912 HB3 ARG 117 HB2 ARG 117 13.428 2.244 -1.086 913 HG2 ARG 117 HG3 ARG 117 13.846 3.144 0.920 914 HG3 ARG 117 HG2 ARG 117 14.491 1.637 1.573 915 HD2 ARG 117 HD3 ARG 117 16.039 3.268 -0.412 916 HD3 ARG 117 HD2 ARG 117 16.086 3.639 1.311 917 HE ARG 117 HE ARG 117 16.660 1.002 1.244 918 HH11 ARG 117 HH11 ARG 117 17.972 3.759 -0.445 919 HH12 ARG 117 HH12 ARG 117 19.557 3.075 -0.589 920 HH21 ARG 117 HH21 ARG 117 18.743 0.101 1.057 921 HH22 ARG 117 HH22 ARG 117 19.995 0.998 0.264 922 H LEU 118 H LEU 118 13.366 -2.009 -1.268 923 HA LEU 118 HA LEU 118 15.125 -3.262 0.614 924 HB2 LEU 118 HB3 LEU 118 13.564 -4.055 -1.751 925 HB3 LEU 118 HB2 LEU 118 15.055 -4.951 -1.536 926 HG LEU 118 HG LEU 118 14.279 -5.444 0.825 927 HD11 LEU 118 HD11 LEU 118 12.351 -3.569 0.273 928 HD12 LEU 118 HD12 LEU 118 12.315 -4.724 1.604 929 HD13 LEU 118 HD13 LEU 118 11.481 -5.093 0.095 930 HD21 LEU 118 HD21 LEU 118 12.301 -6.595 -1.067 931 HD22 LEU 118 HD22 LEU 118 13.319 -7.392 0.133 932 HD23 LEU 118 HD23 LEU 118 14.015 -6.853 -1.395 933 H ALA 119 H ALA 119 17.273 -3.729 0.415 934 HA ALA 119 HA ALA 119 18.879 -2.091 -1.217 935 HB1 ALA 119 HB1 ALA 119 19.305 -3.683 0.978 936 HB2 ALA 119 HB2 ALA 119 20.554 -2.840 0.061 937 HB3 ALA 119 HB3 ALA 119 20.188 -4.529 -0.293 938 H GLY 120 H GLY 120 17.904 -5.481 -1.499 939 HA2 GLY 120 HA3 GLY 120 19.499 -6.189 -3.681 940 HA3 GLY 120 HA2 GLY 120 17.965 -6.937 -3.267 941 H SER 121 H SER 121 19.077 -6.391 -5.883 942 HA SER 121 HA SER 121 17.195 -4.388 -6.922 943 HB2 SER 121 HB3 SER 121 19.868 -5.335 -7.766 944 HB3 SER 121 HB2 SER 121 18.723 -5.028 -9.071 945 HG SER 121 HG SER 121 19.067 -2.989 -8.777 946 H PHE 122 H PHE 122 15.349 -5.154 -7.694 947 HA PHE 122 HA PHE 122 15.359 -7.799 -8.992 948 HB2 PHE 122 HB3 PHE 122 13.172 -6.569 -7.304 949 HB3 PHE 122 HB2 PHE 122 13.027 -8.081 -8.193 950 HD1 PHE 122 HD2 PHE 122 15.032 -6.417 -5.545 951 HD2 PHE 122 HD1 PHE 122 13.643 -10.084 -7.199 952 HE1 PHE 122 HE2 PHE 122 15.954 -7.633 -3.615 953 HE2 PHE 122 HE1 PHE 122 14.561 -11.306 -5.272 954 HZ PHE 122 HZ PHE 122 15.719 -10.080 -3.476 955 H GLU 123 H GLU 123 13.549 -8.110 -10.538 956 HA GLU 123 HA GLU 123 12.670 -5.621 -11.817 957 HB2 GLU 123 HB3 GLU 123 13.276 -6.444 -14.023 958 HB3 GLU 123 HB2 GLU 123 14.699 -6.378 -12.992 959 HG2 GLU 123 HG3 GLU 123 13.592 -8.953 -12.701 960 HG3 GLU 123 HG2 GLU 123 13.613 -8.588 -14.425 961 H GLY 124 H GLY 124 10.649 -5.685 -12.679 962 HA2 GLY 124 HA3 GLY 124 9.326 -8.222 -13.163 963 HA3 GLY 124 HA2 GLY 124 8.689 -7.302 -11.808 964 H ASP 125 H ASP 125 6.697 -6.867 -12.689 965 HA ASP 125 HA ASP 125 6.711 -5.132 -15.071 966 HB2 ASP 125 HB3 ASP 125 5.568 -7.574 -15.004 967 HB3 ASP 125 HB2 ASP 125 4.222 -6.599 -14.421 968 H THR 126 H THR 126 5.995 -5.326 -11.773 969 HA THR 126 HA THR 126 4.063 -3.116 -11.953 970 HB THR 126 HB THR 126 4.659 -4.719 -9.475 971 HG1 THR 126 HG1 THR 126 2.632 -5.280 -11.372 972 HG21 THR 126 HG21 THR 126 1.932 -3.918 -9.860 973 HG22 THR 126 HG22 THR 126 3.010 -2.524 -9.935 974 HG23 THR 126 HG23 THR 126 3.029 -3.578 -8.522 975 H LYS 127 H LYS 127 5.139 -1.240 -11.946 976 HA LYS 127 HA LYS 127 7.234 -0.856 -9.909 977 HB2 LYS 127 HB3 LYS 127 6.939 0.463 -12.613 978 HB3 LYS 127 HB2 LYS 127 8.138 0.916 -11.409 979 HG2 LYS 127 HG3 LYS 127 9.186 -1.243 -11.564 980 HG3 LYS 127 HG2 LYS 127 7.918 -1.818 -12.648 981 HD2 LYS 127 HD3 LYS 127 9.352 -1.223 -14.275 982 HD3 LYS 127 HD2 LYS 127 8.764 0.410 -13.955 983 HE2 LYS 127 HE3 LYS 127 10.623 0.908 -12.577 984 HE3 LYS 127 HE2 LYS 127 11.116 -0.784 -12.509 985 HZ1 LYS 127 HZ1 LYS 127 10.985 0.401 -15.159 986 HZ2 LYS 127 HZ2 LYS 127 12.127 -0.660 -14.502 987 HZ3 LYS 127 HZ3 LYS 127 12.208 0.993 -14.150 988 H MET 128 H MET 128 7.463 1.454 -9.195 989 HA MET 128 HA MET 128 4.906 2.406 -8.312 990 HB2 MET 128 HB3 MET 128 7.011 2.428 -6.933 991 HB3 MET 128 HB2 MET 128 7.599 3.728 -7.959 992 HG2 MET 128 HG3 MET 128 6.648 4.519 -5.833 993 HG3 MET 128 HG2 MET 128 5.823 5.172 -7.246 994 HE1 MET 128 HE1 MET 128 4.532 5.790 -4.948 995 HE2 MET 128 HE2 MET 128 3.042 4.930 -4.562 996 HE3 MET 128 HE3 MET 128 3.225 5.719 -6.129 997 H ILE 129 H ILE 129 4.337 4.751 -8.453 998 HA ILE 129 HA ILE 129 4.817 5.722 -11.190 999 HB ILE 129 HB ILE 129 2.698 6.954 -10.976 1000 HG12 ILE 129 HG13 ILE 129 1.325 5.820 -8.899 1001 HG13 ILE 129 HG12 ILE 129 2.928 6.002 -8.197 1002 HG21 ILE 129 HG21 ILE 129 1.630 4.372 -10.278 1003 HG22 ILE 129 HG22 ILE 129 3.049 4.203 -11.312 1004 HG23 ILE 129 HG23 ILE 129 1.682 5.180 -11.845 1005 HD11 ILE 129 HD11 ILE 129 1.185 7.898 -7.957 1006 HD12 ILE 129 HD12 ILE 129 1.663 8.302 -9.606 1007 HD13 ILE 129 HD13 ILE 129 2.864 8.292 -8.316 1008 HA PRO 130 HA PRO 130 6.843 9.415 -9.902 1009 HB2 PRO 130 HB3 PRO 130 4.910 10.949 -11.556 1010 HB3 PRO 130 HB2 PRO 130 6.675 10.911 -11.631 1011 HG2 PRO 130 HG3 PRO 130 5.210 9.676 -13.481 1012 HG3 PRO 130 HG2 PRO 130 6.712 8.953 -12.874 1013 HD2 PRO 130 HD3 PRO 130 3.875 8.270 -12.212 1014 HD3 PRO 130 HD2 PRO 130 5.270 7.196 -12.445 1015 H LEU 131 H LEU 131 6.663 11.147 -8.472 1016 HA LEU 131 HA LEU 131 4.007 11.943 -7.561 1017 HB2 LEU 131 HB3 LEU 131 5.865 11.395 -5.344 1018 HB3 LEU 131 HB2 LEU 131 4.133 11.152 -5.446 1019 HG LEU 131 HG LEU 131 5.833 9.280 -7.004 1020 HD11 LEU 131 HD11 LEU 131 5.898 7.920 -4.763 1021 HD12 LEU 131 HD12 LEU 131 5.892 9.528 -4.039 1022 HD13 LEU 131 HD13 LEU 131 7.174 9.071 -5.160 1023 HD21 LEU 131 HD21 LEU 131 3.605 8.559 -5.157 1024 HD22 LEU 131 HD22 LEU 131 4.084 7.821 -6.686 1025 HD23 LEU 131 HD23 LEU 131 3.239 9.369 -6.681 1026 H ASN 132 H ASN 132 3.999 13.878 -6.278 1027 HA ASN 132 HA ASN 132 6.137 15.692 -7.007 1028 HB2 ASN 132 HB3 ASN 132 3.377 15.955 -6.480 1029 HB3 ASN 132 HB2 ASN 132 4.197 16.849 -5.204 1030 HD21 ASN 132 HD21 ASN 132 4.488 18.896 -5.656 1031 HD22 ASN 132 HD22 ASN 132 4.746 19.574 -7.223 1032 H TRP 133 H TRP 133 7.817 14.732 -5.781 1033 HA TRP 133 HA TRP 133 7.746 14.240 -3.043 1034 HB2 TRP 133 HB3 TRP 133 10.093 14.937 -4.810 1035 HB3 TRP 133 HB2 TRP 133 10.225 14.294 -3.174 1036 HD1 TRP 133 HD1 TRP 133 9.046 13.264 -6.692 1037 HE1 TRP 133 HE1 TRP 133 9.035 10.693 -6.824 1038 HE3 TRP 133 HE3 TRP 133 10.143 12.193 -1.813 1039 HZ2 TRP 133 HZ2 TRP 133 9.442 8.503 -5.093 1040 HZ3 TRP 133 HZ3 TRP 133 10.312 9.834 -1.134 1041 HH2 TRP 133 HH2 TRP 133 9.967 8.028 -2.741 1042 H ASP 134 H ASP 134 8.487 17.277 -4.755 1043 HA ASP 134 HA ASP 134 9.613 18.668 -2.630 1044 HB2 ASP 134 HB3 ASP 134 9.044 19.259 -5.213 1045 HB3 ASP 134 HB2 ASP 134 7.807 20.207 -4.393 1046 H ASP 135 H ASP 135 6.203 18.279 -3.523 1047 HA ASP 135 HA ASP 135 5.232 19.979 -1.452 1048 HB2 ASP 135 HB3 ASP 135 4.132 18.496 -3.652 1049 HB3 ASP 135 HB2 ASP 135 3.186 18.174 -2.201 1050 H PHE 136 H PHE 136 6.680 17.026 -1.224 1051 HA PHE 136 HA PHE 136 5.213 16.400 1.253 1052 HB2 PHE 136 HB3 PHE 136 6.417 14.486 -0.754 1053 HB3 PHE 136 HB2 PHE 136 5.875 14.003 0.850 1054 HD1 PHE 136 HD2 PHE 136 3.391 14.894 1.395 1055 HD2 PHE 136 HD1 PHE 136 4.967 14.107 -2.478 1056 HE1 PHE 136 HE2 PHE 136 1.107 14.590 0.532 1057 HE2 PHE 136 HE1 PHE 136 2.686 13.802 -3.349 1058 HZ PHE 136 HZ PHE 136 0.752 14.043 -1.843 1059 H THR 137 H THR 137 6.377 16.216 3.051 1060 HA THR 137 HA THR 137 9.313 16.337 2.805 1061 HB THR 137 HB THR 137 7.503 17.433 4.966 1062 HG1 THR 137 HG1 THR 137 8.116 19.399 4.181 1063 HG21 THR 137 HG21 THR 137 9.453 18.400 5.993 1064 HG22 THR 137 HG22 THR 137 10.497 17.655 4.782 1065 HG23 THR 137 HG23 THR 137 9.618 16.645 5.930 1066 H LYS 138 H LYS 138 10.581 15.003 4.032 1067 HA LYS 138 HA LYS 138 9.477 12.526 4.816 1068 HB2 LYS 138 HB3 LYS 138 11.824 12.919 3.994 1069 HB3 LYS 138 HB2 LYS 138 12.193 13.589 5.578 1070 HG2 LYS 138 HG3 LYS 138 12.420 11.575 6.481 1071 HG3 LYS 138 HG2 LYS 138 10.911 11.001 5.774 1072 HD2 LYS 138 HD3 LYS 138 12.793 9.678 4.977 1073 HD3 LYS 138 HD2 LYS 138 12.064 10.590 3.654 1074 HE2 LYS 138 HE3 LYS 138 14.279 11.009 3.258 1075 HE3 LYS 138 HE2 LYS 138 13.889 12.366 4.314 1076 HZ1 LYS 138 HZ1 LYS 138 14.940 11.361 6.115 1077 HZ2 LYS 138 HZ2 LYS 138 15.980 11.036 4.821 1078 HZ3 LYS 138 HZ3 LYS 138 14.945 9.828 5.398 1079 H VAL 139 H VAL 139 8.414 12.056 6.596 1080 HA VAL 139 HA VAL 139 8.561 13.818 8.901 1081 HB VAL 139 HB VAL 139 6.960 11.318 9.028 1082 HG11 VAL 139 HG11 VAL 139 6.880 14.075 10.082 1083 HG12 VAL 139 HG12 VAL 139 6.489 12.545 10.867 1084 HG13 VAL 139 HG13 VAL 139 5.325 13.301 9.779 1085 HG21 VAL 139 HG21 VAL 139 6.378 11.811 6.820 1086 HG22 VAL 139 HG22 VAL 139 6.408 13.551 7.101 1087 HG23 VAL 139 HG23 VAL 139 5.108 12.569 7.777 1088 H SER 140 H SER 140 9.564 10.612 7.919 1089 HA SER 140 HA SER 140 11.361 10.460 10.167 1090 HB2 SER 140 HB3 SER 140 8.899 9.499 10.730 1091 HB3 SER 140 HB2 SER 140 9.639 8.053 10.042 1092 HG SER 140 HG SER 140 10.007 9.142 12.463 1093 H SER 141 H SER 141 12.738 8.516 10.082 1094 HA SER 141 HA SER 141 12.732 6.953 7.662 1095 HB2 SER 141 HB3 SER 141 14.993 7.677 6.941 1096 HB3 SER 141 HB2 SER 141 13.807 8.978 6.833 1097 HG SER 141 HG SER 141 16.066 8.807 8.342 1098 H ARG 142 H ARG 142 13.386 4.978 8.192 1099 HA ARG 142 HA ARG 142 15.455 4.654 10.244 1100 HB2 ARG 142 HB3 ARG 142 13.063 4.353 11.142 1101 HB3 ARG 142 HB2 ARG 142 13.027 2.875 10.189 1102 HG2 ARG 142 HG3 ARG 142 14.749 1.892 11.460 1103 HG3 ARG 142 HG2 ARG 142 15.173 3.430 12.215 1104 HD2 ARG 142 HD3 ARG 142 12.493 3.094 12.833 1105 HD3 ARG 142 HD2 ARG 142 13.168 1.471 12.975 1106 HE ARG 142 HE ARG 142 14.334 2.150 14.828 1107 HH11 ARG 142 HH11 ARG 142 13.125 4.961 13.149 1108 HH12 ARG 142 HH12 ARG 142 13.569 6.060 14.411 1109 HH21 ARG 142 HH21 ARG 142 14.920 3.595 16.489 1110 HH22 ARG 142 HH22 ARG 142 14.589 5.285 16.307 1111 H THR 143 H THR 143 17.044 3.420 9.504 1112 HA THR 143 HA THR 143 16.570 1.746 7.159 1113 HB THR 143 HB THR 143 19.200 2.398 8.496 1114 HG1 THR 143 HG1 THR 143 18.550 4.330 7.813 1115 HG21 THR 143 HG21 THR 143 19.844 2.101 5.948 1116 HG22 THR 143 HG22 THR 143 18.452 1.019 5.989 1117 HG23 THR 143 HG23 THR 143 19.814 0.747 7.077 1118 H VAL 144 H VAL 144 15.929 -0.263 7.572 1119 HA VAL 144 HA VAL 144 17.036 -1.664 9.907 1120 HB VAL 144 HB VAL 144 14.666 -2.481 8.221 1121 HG11 VAL 144 HG11 VAL 144 16.058 -3.628 10.557 1122 HG12 VAL 144 HG12 VAL 144 15.146 -4.422 9.274 1123 HG13 VAL 144 HG13 VAL 144 14.296 -3.649 10.612 1124 HG21 VAL 144 HG21 VAL 144 13.277 -1.232 9.471 1125 HG22 VAL 144 HG22 VAL 144 14.721 -0.277 9.807 1126 HG23 VAL 144 HG23 VAL 144 14.194 -1.511 10.951 1127 H GLU 145 H GLU 145 18.388 -3.339 9.654 1128 HA GLU 145 HA GLU 145 18.666 -4.496 6.960 1129 HB2 GLU 145 HB3 GLU 145 21.115 -4.845 7.625 1130 HB3 GLU 145 HB2 GLU 145 20.615 -3.215 7.199 1131 HG2 GLU 145 HG3 GLU 145 21.064 -2.417 9.223 1132 HG3 GLU 145 HG2 GLU 145 20.347 -3.808 10.036 1133 H ASP 146 H ASP 146 19.063 -6.682 6.810 1134 HA ASP 146 HA ASP 146 18.656 -8.204 9.298 1135 HB2 ASP 146 HB3 ASP 146 17.535 -8.448 6.585 1136 HB3 ASP 146 HB2 ASP 146 18.056 -9.971 7.298 1137 H THR 147 H THR 147 19.366 -10.689 8.603 1138 HA THR 147 HA THR 147 22.167 -10.659 8.745 1139 HB THR 147 HB THR 147 21.713 -13.189 7.961 1140 HG1 THR 147 HG1 THR 147 19.491 -12.656 7.492 1141 HG21 THR 147 HG21 THR 147 22.340 -12.185 10.286 1142 HG22 THR 147 HG22 THR 147 21.694 -13.821 10.156 1143 HG23 THR 147 HG23 THR 147 20.641 -12.494 10.645 1144 H ASN 148 H ASN 148 19.975 -11.265 6.035 1145 HA ASN 148 HA ASN 148 22.140 -11.714 4.186 1146 HB2 ASN 148 HB3 ASN 148 19.196 -11.846 4.119 1147 HB3 ASN 148 HB2 ASN 148 19.944 -11.334 2.609 1148 HD21 ASN 148 HD21 ASN 148 18.516 -13.801 3.318 1149 HD22 ASN 148 HD22 ASN 148 19.603 -15.091 2.947 1150 HA PRO 149 HA PRO 149 22.937 -7.477 3.173 1151 HB2 PRO 149 HB3 PRO 149 23.789 -7.838 0.581 1152 HB3 PRO 149 HB2 PRO 149 24.799 -8.097 2.006 1153 HG2 PRO 149 HG3 PRO 149 23.303 -10.092 0.355 1154 HG3 PRO 149 HG2 PRO 149 24.931 -10.207 1.050 1155 HD2 PRO 149 HD3 PRO 149 22.831 -11.438 2.180 1156 HD3 PRO 149 HD2 PRO 149 24.129 -10.725 3.162 1157 H ALA 150 H ALA 150 21.011 -9.492 1.016 1158 HA ALA 150 HA ALA 150 19.874 -7.234 -0.373 1159 HB1 ALA 150 HB1 ALA 150 20.233 -9.802 -1.089 1160 HB2 ALA 150 HB2 ALA 150 19.052 -8.731 -1.843 1161 HB3 ALA 150 HB3 ALA 150 18.545 -9.855 -0.582 1162 H LEU 151 H LEU 151 19.244 -8.855 2.553 1163 HA LEU 151 HA LEU 151 16.406 -8.284 2.577 1164 HB2 LEU 151 HB3 LEU 151 18.284 -9.453 4.619 1165 HB3 LEU 151 HB2 LEU 151 16.596 -9.124 4.963 1166 HG LEU 151 HG LEU 151 17.719 -11.116 3.002 1167 HD11 LEU 151 HD11 LEU 151 15.711 -11.613 5.165 1168 HD12 LEU 151 HD12 LEU 151 17.438 -11.580 5.521 1169 HD13 LEU 151 HD13 LEU 151 16.797 -12.750 4.367 1170 HD21 LEU 151 HD21 LEU 151 15.885 -10.065 1.875 1171 HD22 LEU 151 HD22 LEU 151 14.879 -10.159 3.320 1172 HD23 LEU 151 HD23 LEU 151 15.341 -11.634 2.471 1173 H THR 152 H THR 152 18.826 -6.240 2.693 1174 HA THR 152 HA THR 152 18.134 -4.785 5.103 1175 HB THR 152 HB THR 152 19.936 -3.815 2.889 1176 HG1 THR 152 HG1 THR 152 20.483 -5.662 4.954 1177 HG21 THR 152 HG21 THR 152 19.375 -2.971 5.625 1178 HG22 THR 152 HG22 THR 152 20.080 -2.079 4.277 1179 HG23 THR 152 HG23 THR 152 21.091 -3.141 5.258 1180 H HIS 153 H HIS 153 16.513 -3.382 5.194 1181 HA HIS 153 HA HIS 153 15.732 -1.975 2.727 1182 HB2 HIS 153 HB3 HIS 153 13.556 -2.351 4.654 1183 HB3 HIS 153 HB2 HIS 153 13.565 -2.569 2.909 1184 HD1 HIS 153 HD1 HIS 153 12.803 -4.440 5.706 1185 HD2 HIS 153 HD2 HIS 153 15.287 -5.167 2.456 1186 HE1 HIS 153 HE1 HIS 153 13.051 -6.939 5.596 1187 HE2 HIS 153 HE2 HIS 153 14.608 -7.353 3.660 1188 H THR 154 H THR 154 14.422 0.014 3.186 1189 HA THR 154 HA THR 154 15.189 1.281 5.723 1190 HB THR 154 HB THR 154 15.337 2.689 3.056 1191 HG1 THR 154 HG1 THR 154 17.611 2.467 3.320 1192 HG21 THR 154 HG21 THR 154 16.670 3.477 5.621 1193 HG22 THR 154 HG22 THR 154 15.062 4.046 5.174 1194 HG23 THR 154 HG23 THR 154 16.448 4.431 4.155 1195 H TYR 155 H TYR 155 13.479 2.082 6.733 1196 HA TYR 155 HA TYR 155 10.985 2.443 5.267 1197 HB2 TYR 155 HB3 TYR 155 11.742 2.014 8.101 1198 HB3 TYR 155 HB2 TYR 155 10.322 3.017 7.822 1199 HD1 TYR 155 HD1 TYR 155 8.351 2.071 6.656 1200 HD2 TYR 155 HD2 TYR 155 11.688 -0.343 7.725 1201 HE1 TYR 155 HE1 TYR 155 6.982 0.052 6.348 1202 HE2 TYR 155 HE2 TYR 155 10.328 -2.369 7.421 1203 HH TYR 155 HH TYR 155 7.232 -2.300 5.936 1204 H GLU 156 H GLU 156 10.174 4.377 4.729 1205 HA GLU 156 HA GLU 156 11.270 6.764 6.052 1206 HB2 GLU 156 HB3 GLU 156 10.749 6.503 3.087 1207 HB3 GLU 156 HB2 GLU 156 11.358 7.930 3.915 1208 HG2 GLU 156 HG3 GLU 156 13.296 6.422 4.658 1209 HG3 GLU 156 HG2 GLU 156 12.741 5.329 3.392 1210 H VAL 157 H VAL 157 9.850 8.347 6.528 1211 HA VAL 157 HA VAL 157 7.041 7.893 5.769 1212 HB VAL 157 HB VAL 157 7.955 9.508 8.145 1213 HG11 VAL 157 HG11 VAL 157 5.377 8.707 6.979 1214 HG12 VAL 157 HG12 VAL 157 5.788 10.094 7.989 1215 HG13 VAL 157 HG13 VAL 157 5.500 8.519 8.729 1216 HG21 VAL 157 HG21 VAL 157 8.752 7.152 8.306 1217 HG22 VAL 157 HG22 VAL 157 7.073 6.625 8.185 1218 HG23 VAL 157 HG23 VAL 157 7.594 7.603 9.557 1219 H TRP 158 H TRP 158 5.788 9.637 5.162 1220 HA TRP 158 HA TRP 158 7.072 12.234 4.793 1221 HB2 TRP 158 HB3 TRP 158 5.778 10.819 2.461 1222 HB3 TRP 158 HB2 TRP 158 6.569 12.390 2.438 1223 HD1 TRP 158 HD1 TRP 158 7.510 8.676 3.059 1224 HE1 TRP 158 HE1 TRP 158 9.923 8.327 2.234 1225 HE3 TRP 158 HE3 TRP 158 8.623 13.489 1.739 1226 HZ2 TRP 158 HZ2 TRP 158 12.020 9.885 1.164 1227 HZ3 TRP 158 HZ3 TRP 158 10.853 13.975 0.822 1228 HH2 TRP 158 HH2 TRP 158 12.516 12.209 0.542 1229 H GLN 159 H GLN 159 5.719 13.920 4.975 1230 HA GLN 159 HA GLN 159 2.828 13.446 4.805 1231 HB2 GLN 159 HB3 GLN 159 4.373 14.285 7.183 1232 HB3 GLN 159 HB2 GLN 159 2.919 15.217 6.858 1233 HG2 GLN 159 HG3 GLN 159 2.283 12.465 6.585 1234 HG3 GLN 159 HG2 GLN 159 3.158 12.686 8.099 1235 HE21 GLN 159 HE21 GLN 159 0.297 12.100 7.447 1236 HE22 GLN 159 HE22 GLN 159 -0.603 13.287 8.322 1237 H LYS 160 H LYS 160 1.857 14.936 3.577 1238 HA LYS 160 HA LYS 160 3.240 16.977 2.283 1239 HB2 LYS 160 HB3 LYS 160 0.748 15.833 2.059 1240 HB3 LYS 160 HB2 LYS 160 0.365 17.469 2.576 1241 HG2 LYS 160 HG3 LYS 160 2.247 16.972 0.302 1242 HG3 LYS 160 HG2 LYS 160 0.499 16.969 0.064 1243 HD2 LYS 160 HD3 LYS 160 1.571 19.254 1.584 1244 HD3 LYS 160 HD2 LYS 160 2.049 19.178 -0.113 1245 HE2 LYS 160 HE3 LYS 160 -0.815 18.801 0.661 1246 HE3 LYS 160 HE2 LYS 160 -0.133 20.424 0.563 1247 HZ1 LYS 160 HZ1 LYS 160 0.095 20.295 -1.680 1248 HZ2 LYS 160 HZ2 LYS 160 -1.236 19.266 -1.505 1249 HZ3 LYS 160 HZ3 LYS 160 0.314 18.617 -1.693 1250 H LYS 161 H LYS 161 3.498 19.135 2.625 1251 HA LYS 161 HA LYS 161 3.341 20.079 5.306 1252 HB2 LYS 161 HB3 LYS 161 4.101 21.332 2.683 1253 HB3 LYS 161 HB2 LYS 161 3.963 22.309 4.139 1254 HG2 LYS 161 HG3 LYS 161 5.727 21.179 5.196 1255 HG3 LYS 161 HG2 LYS 161 5.691 19.859 4.024 1256 HD2 LYS 161 HD3 LYS 161 7.579 21.222 3.508 1257 HD3 LYS 161 HD2 LYS 161 6.358 21.521 2.269 1258 HE2 LYS 161 HE3 LYS 161 6.309 23.280 4.649 1259 HE3 LYS 161 HE2 LYS 161 7.666 23.481 3.542 1260 HZ1 LYS 161 HZ1 LYS 161 4.779 23.758 2.938 1261 HZ2 LYS 161 HZ2 LYS 161 5.957 23.648 1.730 1262 HZ3 LYS 161 HZ3 LYS 161 5.984 24.940 2.821 1263 H ALA 162 H ALA 162 2.030 21.661 6.201 1264 HA ALA 162 HA ALA 162 0.098 22.798 6.594 1265 HB1 ALA 162 HB1 ALA 162 1.077 23.857 4.340 1266 HB2 ALA 162 HB2 ALA 162 -0.436 24.390 5.074 1267 HB3 ALA 162 HB3 ALA 162 -0.462 23.252 3.726 1268 H51A NDP 170 H51A NDP 170 -4.981 -1.536 -11.898 1269 H52A NDP 170 H52A NDP 170 -5.151 -0.352 -10.588 1270 H4B NDP 170 H4B NDP 170 -7.433 -1.777 -12.008 1271 H3B NDP 170 H3B NDP 170 -6.435 1.073 -12.202 1272 HO3A NDP 170 HO3A NDP 170 -7.468 -0.877 -14.026 1273 H2B NDP 170 H2B NDP 170 -8.721 1.737 -12.499 1274 H1B NDP 170 H1B NDP 170 -9.732 0.178 -10.455 1275 H8A NDP 170 H8A NDP 170 -6.257 1.827 -10.130 1276 H61A NDP 170 H61A NDP 170 -9.282 6.092 -6.791 1277 H62A NDP 170 H62A NDP 170 -7.716 5.399 -7.105 1278 H2A NDP 170 H2A NDP 170 -12.286 3.167 -8.341 1279 H51N NDP 170 H51N NDP 170 -1.349 -4.445 -7.332 1280 H52N NDP 170 H52N NDP 170 -0.743 -3.350 -8.587 1281 H4D NDP 170 H4D NDP 170 0.824 -5.158 -9.348 1282 H3D NDP 170 H3D NDP 170 -0.333 -6.699 -7.014 1283 HO3N NDP 170 HO3N NDP 170 0.097 -7.022 -9.759 1284 H2D NDP 170 H2D NDP 170 1.866 -7.612 -6.681 1285 HO2N NDP 170 HO2N NDP 170 3.226 -7.862 -8.254 1286 H1D NDP 170 H1D NDP 170 3.198 -5.212 -6.940 1287 H2N NDP 170 H2N NDP 170 3.808 -5.225 -4.611 1288 H71N NDP 170 H71N NDP 170 5.673 -4.787 -2.016 1289 H72N NDP 170 H72N NDP 170 5.215 -5.291 -3.622 1290 H41N NDP 170 H41N NDP 170 0.779 -4.279 -2.196 1291 H42N NDP 170 H42N NDP 170 0.877 -6.068 -2.052 1292 H5N NDP 170 H5N NDP 170 -1.031 -5.371 -3.498 1293 H6N NDP 170 H6N NDP 170 -0.353 -5.546 -5.898 Start of MODEL 28 1 H1 THR 1 HT1 THR 1 -4.006 10.082 5.407 2 H2 THR 1 HT2 THR 1 -4.635 8.567 5.913 3 H3 THR 1 HT3 THR 1 -5.647 9.691 5.102 4 HA THR 1 HA THR 1 -4.800 7.775 3.783 5 HB THR 1 HB THR 1 -4.009 10.444 2.651 6 HG1 THR 1 HG1 THR 1 -5.831 11.142 3.460 7 HG21 THR 1 HG21 THR 1 -4.999 7.905 1.592 8 HG22 THR 1 HG22 THR 1 -4.048 9.173 0.818 9 HG23 THR 1 HG23 THR 1 -5.800 9.337 0.946 10 H ALA 2 H ALA 2 -3.031 6.551 4.206 11 HA ALA 2 HA ALA 2 -0.423 7.726 3.521 12 HB1 ALA 2 HB1 ALA 2 -0.684 5.698 5.715 13 HB2 ALA 2 HB2 ALA 2 -0.842 7.425 6.036 14 HB3 ALA 2 HB3 ALA 2 0.658 6.787 5.365 15 H PHE 3 H PHE 3 1.026 6.361 2.477 16 HA PHE 3 HA PHE 3 -0.174 3.894 1.418 17 HB2 PHE 3 HB3 PHE 3 2.145 5.540 0.390 18 HB3 PHE 3 HB2 PHE 3 1.527 4.081 -0.371 19 HD1 PHE 3 HD1 PHE 3 -1.360 5.484 0.739 20 HD2 PHE 3 HD2 PHE 3 1.737 6.258 -2.078 21 HE1 PHE 3 HE1 PHE 3 -2.912 6.853 -0.590 22 HE2 PHE 3 HE2 PHE 3 0.188 7.626 -3.410 23 HZ PHE 3 HZ PHE 3 -2.137 7.925 -2.666 24 H LEU 4 H LEU 4 0.734 1.929 1.786 25 HA LEU 4 HA LEU 4 3.413 1.847 2.976 26 HB2 LEU 4 HB3 LEU 4 1.938 1.664 4.845 27 HB3 LEU 4 HB2 LEU 4 0.934 0.492 4.013 28 HG LEU 4 HG LEU 4 2.777 -1.143 4.108 29 HD11 LEU 4 HD11 LEU 4 4.854 -0.677 4.814 30 HD12 LEU 4 HD12 LEU 4 4.288 0.375 6.111 31 HD13 LEU 4 HD13 LEU 4 4.414 0.994 4.464 32 HD21 LEU 4 HD21 LEU 4 1.019 -0.527 6.030 33 HD22 LEU 4 HD22 LEU 4 2.522 -0.272 6.918 34 HD23 LEU 4 HD23 LEU 4 2.190 -1.838 6.177 35 H TRP 5 H TRP 5 4.641 0.704 1.621 36 HA TRP 5 HA TRP 5 3.869 -1.955 0.864 37 HB2 TRP 5 HB3 TRP 5 3.672 -1.722 -1.454 38 HB3 TRP 5 HB2 TRP 5 2.785 -0.333 -0.837 39 HD1 TRP 5 HD1 TRP 5 5.921 -1.262 -2.785 40 HE1 TRP 5 HE1 TRP 5 6.922 0.867 -3.826 41 HE3 TRP 5 HE3 TRP 5 2.978 2.230 -0.484 42 HZ2 TRP 5 HZ2 TRP 5 6.522 3.656 -3.687 43 HZ3 TRP 5 HZ3 TRP 5 3.354 4.608 -0.998 44 HH2 TRP 5 HH2 TRP 5 5.087 5.304 -2.566 45 H ALA 6 H ALA 6 5.595 -3.084 -0.332 46 HA ALA 6 HA ALA 6 8.227 -2.027 0.437 47 HB1 ALA 6 HB1 ALA 6 8.044 -4.108 1.424 48 HB2 ALA 6 HB2 ALA 6 8.875 -4.499 -0.082 49 HB3 ALA 6 HB3 ALA 6 7.141 -4.787 0.070 50 H GLN 7 H GLN 7 9.889 -1.823 -1.062 51 HA GLN 7 HA GLN 7 9.369 -2.635 -3.817 52 HB2 GLN 7 HB3 GLN 7 9.992 -0.352 -4.640 53 HB3 GLN 7 HB2 GLN 7 8.440 -0.434 -3.819 54 HG2 GLN 7 HG3 GLN 7 10.447 0.155 -1.892 55 HG3 GLN 7 HG2 GLN 7 10.642 1.246 -3.263 56 HE21 GLN 7 HE21 GLN 7 8.293 0.023 -0.930 57 HE22 GLN 7 HE22 GLN 7 7.297 1.434 -0.924 58 H ASP 8 H ASP 8 11.247 -2.516 -5.206 59 HA ASP 8 HA ASP 8 13.707 -2.958 -3.691 60 HB2 ASP 8 HB3 ASP 8 14.554 -4.022 -5.714 61 HB3 ASP 8 HB2 ASP 8 12.976 -4.684 -5.306 62 H ARG 9 H ARG 9 15.626 -2.416 -5.589 63 HA ARG 9 HA ARG 9 16.007 0.353 -5.272 64 HB2 ARG 9 HB3 ARG 9 17.421 -1.868 -6.584 65 HB3 ARG 9 HB2 ARG 9 17.719 -0.291 -7.301 66 HG2 ARG 9 HG3 ARG 9 18.046 -0.903 -4.374 67 HG3 ARG 9 HG2 ARG 9 19.356 -0.948 -5.556 68 HD2 ARG 9 HD3 ARG 9 17.692 1.436 -4.762 69 HD3 ARG 9 HD2 ARG 9 19.403 1.173 -4.428 70 HE ARG 9 HE ARG 9 19.296 1.086 -7.122 71 HH11 ARG 9 HH11 ARG 9 18.112 3.384 -4.777 72 HH12 ARG 9 HH12 ARG 9 18.277 4.742 -5.839 73 HH21 ARG 9 HH21 ARG 9 19.514 2.871 -8.520 74 HH22 ARG 9 HH22 ARG 9 19.072 4.451 -7.964 75 H ASP 10 H ASP 10 14.548 -1.517 -7.827 76 HA ASP 10 HA ASP 10 14.519 0.715 -9.679 77 HB2 ASP 10 HB3 ASP 10 13.807 -2.166 -9.796 78 HB3 ASP 10 HB2 ASP 10 12.951 -1.088 -10.894 79 H GLY 11 H GLY 11 12.769 0.070 -7.006 80 HA2 GLY 11 HA3 GLY 11 10.870 1.227 -6.275 81 HA3 GLY 11 HA2 GLY 11 10.549 1.700 -7.936 82 H LEU 12 H LEU 12 11.155 -1.527 -7.991 83 HA LEU 12 HA LEU 12 8.691 -2.391 -8.804 84 HB2 LEU 12 HB3 LEU 12 11.073 -3.535 -8.627 85 HB3 LEU 12 HB2 LEU 12 10.382 -4.231 -7.177 86 HG LEU 12 HG LEU 12 8.603 -5.263 -8.491 87 HD11 LEU 12 HD11 LEU 12 8.803 -5.214 -10.987 88 HD12 LEU 12 HD12 LEU 12 9.946 -3.883 -10.802 89 HD13 LEU 12 HD13 LEU 12 8.280 -3.699 -10.251 90 HD21 LEU 12 HD21 LEU 12 11.452 -5.785 -8.897 91 HD22 LEU 12 HD22 LEU 12 10.400 -6.489 -10.126 92 HD23 LEU 12 HD23 LEU 12 10.151 -6.877 -8.425 93 H ILE 13 H ILE 13 7.507 -4.278 -7.551 94 HA ILE 13 HA ILE 13 7.181 -3.788 -4.728 95 HB ILE 13 HB ILE 13 4.841 -3.302 -4.746 96 HG12 ILE 13 HG13 ILE 13 4.793 -3.115 -7.751 97 HG13 ILE 13 HG12 ILE 13 4.449 -4.640 -6.944 98 HG21 ILE 13 HG21 ILE 13 6.479 -1.440 -5.060 99 HG22 ILE 13 HG22 ILE 13 4.838 -1.084 -5.601 100 HG23 ILE 13 HG23 ILE 13 6.091 -1.472 -6.780 101 HD11 ILE 13 HD11 ILE 13 2.980 -2.123 -6.263 102 HD12 ILE 13 HD12 ILE 13 2.534 -3.794 -5.912 103 HD13 ILE 13 HD13 ILE 13 2.474 -3.193 -7.570 104 H GLY 14 H GLY 14 6.139 -5.454 -7.642 105 HA2 GLY 14 HA3 GLY 14 6.595 -8.019 -6.824 106 HA3 GLY 14 HA2 GLY 14 4.964 -7.672 -6.263 107 H LYS 15 H LYS 15 5.819 -9.604 -8.271 108 HA LYS 15 HA LYS 15 4.458 -8.468 -10.627 109 HB2 LYS 15 HB3 LYS 15 5.667 -10.348 -11.871 110 HB3 LYS 15 HB2 LYS 15 6.639 -8.987 -11.329 111 HG2 LYS 15 HG3 LYS 15 7.814 -10.232 -9.862 112 HG3 LYS 15 HG2 LYS 15 6.434 -11.254 -9.457 113 HD2 LYS 15 HD3 LYS 15 7.089 -11.749 -12.167 114 HD3 LYS 15 HD2 LYS 15 8.594 -11.783 -11.246 115 HE2 LYS 15 HE3 LYS 15 6.266 -13.205 -10.089 116 HE3 LYS 15 HE2 LYS 15 7.012 -13.918 -11.519 117 HZ1 LYS 15 HZ1 LYS 15 8.834 -13.064 -9.423 118 HZ2 LYS 15 HZ2 LYS 15 8.871 -14.449 -10.393 119 HZ3 LYS 15 HZ3 LYS 15 7.850 -14.389 -9.047 120 H ASP 16 H ASP 16 2.386 -9.032 -10.168 121 HA ASP 16 HA ASP 16 0.533 -10.358 -10.195 122 HB2 ASP 16 HB3 ASP 16 2.553 -11.994 -11.486 123 HB3 ASP 16 HB2 ASP 16 1.416 -12.987 -10.580 124 H GLY 17 H GLY 17 0.187 -10.016 -8.000 125 HA2 GLY 17 HA3 GLY 17 -0.571 -11.531 -6.177 126 HA3 GLY 17 HA2 GLY 17 1.035 -12.240 -6.249 127 H HIS 18 H HIS 18 2.854 -10.887 -5.652 128 HA HIS 18 HA HIS 18 2.570 -8.350 -4.467 129 HB2 HIS 18 HB3 HIS 18 2.720 -8.883 -2.111 130 HB3 HIS 18 HB2 HIS 18 1.310 -9.694 -2.780 131 HD1 HIS 18 HD1 HIS 18 3.525 -10.397 -0.318 132 HD2 HIS 18 HD2 HIS 18 2.595 -12.462 -3.802 133 HE1 HIS 18 HE1 HIS 18 4.212 -12.778 0.108 134 HE2 HIS 18 HE2 HIS 18 3.721 -13.990 -2.045 135 H LEU 19 H LEU 19 4.582 -8.650 -2.437 136 HA LEU 19 HA LEU 19 6.899 -8.501 -4.036 137 HB2 LEU 19 HB3 LEU 19 8.074 -8.568 -1.770 138 HB3 LEU 19 HB2 LEU 19 6.979 -7.237 -2.085 139 HG LEU 19 HG LEU 19 5.444 -9.275 -0.855 140 HD11 LEU 19 HD11 LEU 19 6.593 -9.646 1.230 141 HD12 LEU 19 HD12 LEU 19 7.973 -8.699 0.676 142 HD13 LEU 19 HD13 LEU 19 7.585 -10.232 -0.104 143 HD21 LEU 19 HD21 LEU 19 6.527 -6.671 0.212 144 HD22 LEU 19 HD22 LEU 19 5.205 -7.598 0.922 145 HD23 LEU 19 HD23 LEU 19 5.023 -6.890 -0.683 146 HA PRO 20 HA PRO 20 7.545 -12.957 -4.278 147 HB2 PRO 20 HB3 PRO 20 9.966 -12.216 -5.765 148 HB3 PRO 20 HB2 PRO 20 8.572 -13.163 -6.290 149 HG2 PRO 20 HG3 PRO 20 9.041 -10.680 -7.215 150 HG3 PRO 20 HG2 PRO 20 7.399 -11.305 -6.976 151 HD2 PRO 20 HD3 PRO 20 8.991 -9.446 -5.250 152 HD3 PRO 20 HD2 PRO 20 7.269 -9.390 -5.682 153 H TRP 21 H TRP 21 9.575 -10.574 -2.854 154 HA TRP 21 HA TRP 21 11.614 -12.470 -2.049 155 HB2 TRP 21 HB3 TRP 21 12.508 -10.480 -0.756 156 HB3 TRP 21 HB2 TRP 21 12.438 -10.290 -2.505 157 HD1 TRP 21 HD1 TRP 21 10.036 -9.480 0.447 158 HE1 TRP 21 HE1 TRP 21 9.029 -7.151 0.021 159 HE3 TRP 21 HE3 TRP 21 12.293 -8.426 -4.014 160 HZ2 TRP 21 HZ2 TRP 21 9.167 -5.135 -1.950 161 HZ3 TRP 21 HZ3 TRP 21 11.801 -6.277 -5.107 162 HH2 TRP 21 HH2 TRP 21 10.269 -4.666 -4.094 163 H HIS 22 H HIS 22 12.018 -13.153 0.058 164 HA HIS 22 HA HIS 22 9.650 -13.377 1.703 165 HB2 HIS 22 HB3 HIS 22 11.270 -15.274 1.235 166 HB3 HIS 22 HB2 HIS 22 12.399 -14.462 2.315 167 HD1 HIS 22 HD1 HIS 22 9.363 -16.578 2.286 168 HD2 HIS 22 HD2 HIS 22 11.618 -14.453 5.054 169 HE1 HIS 22 HE1 HIS 22 8.605 -17.396 4.540 170 HE2 HIS 22 HE2 HIS 22 9.929 -16.041 6.201 171 H LEU 23 H LEU 23 9.334 -11.301 2.518 172 HA LEU 23 HA LEU 23 11.391 -10.344 4.395 173 HB2 LEU 23 HB3 LEU 23 9.883 -9.003 2.359 174 HB3 LEU 23 HB2 LEU 23 9.477 -8.315 3.920 175 HG LEU 23 HG LEU 23 12.024 -8.140 4.277 176 HD11 LEU 23 HD11 LEU 23 12.936 -7.658 1.793 177 HD12 LEU 23 HD12 LEU 23 11.849 -9.009 1.471 178 HD13 LEU 23 HD13 LEU 23 13.157 -9.189 2.640 179 HD21 LEU 23 HD21 LEU 23 10.440 -6.444 2.368 180 HD22 LEU 23 HD22 LEU 23 12.063 -6.008 2.904 181 HD23 LEU 23 HD23 LEU 23 10.758 -6.164 4.080 182 HA PRO 24 HA PRO 24 8.008 -11.775 7.144 183 HB2 PRO 24 HB3 PRO 24 9.619 -12.040 9.330 184 HB3 PRO 24 HB2 PRO 24 9.420 -13.299 8.108 185 HG2 PRO 24 HG3 PRO 24 11.616 -11.291 8.420 186 HG3 PRO 24 HG2 PRO 24 11.723 -13.014 8.013 187 HD2 PRO 24 HD3 PRO 24 11.918 -11.079 6.143 188 HD3 PRO 24 HD2 PRO 24 11.174 -12.654 5.798 189 H ASP 25 H ASP 25 10.537 -9.388 7.836 190 HA ASP 25 HA ASP 25 9.240 -8.101 9.963 191 HB2 ASP 25 HB3 ASP 25 10.771 -6.180 9.308 192 HB3 ASP 25 HB2 ASP 25 11.557 -7.702 9.695 193 H ASP 26 H ASP 26 8.855 -7.876 6.513 194 HA ASP 26 HA ASP 26 7.442 -5.371 6.573 195 HB2 ASP 26 HB3 ASP 26 8.777 -6.576 4.613 196 HB3 ASP 26 HB2 ASP 26 7.183 -7.240 4.265 197 H LEU 27 H LEU 27 6.581 -8.789 6.420 198 HA LEU 27 HA LEU 27 3.787 -8.330 6.052 199 HB2 LEU 27 HB3 LEU 27 4.965 -10.828 7.229 200 HB3 LEU 27 HB2 LEU 27 3.517 -10.658 6.256 201 HG LEU 27 HG LEU 27 6.052 -9.899 4.933 202 HD11 LEU 27 HD11 LEU 27 5.522 -12.791 4.899 203 HD12 LEU 27 HD12 LEU 27 6.204 -12.158 6.398 204 HD13 LEU 27 HD13 LEU 27 7.051 -11.912 4.871 205 HD21 LEU 27 HD21 LEU 27 3.419 -11.076 4.253 206 HD22 LEU 27 HD22 LEU 27 4.794 -11.507 3.236 207 HD23 LEU 27 HD23 LEU 27 4.344 -9.814 3.440 208 H HIS 28 H HIS 28 5.679 -9.479 8.848 209 HA HIS 28 HA HIS 28 3.629 -9.544 10.710 210 HB2 HIS 28 HB3 HIS 28 6.573 -9.387 10.812 211 HB3 HIS 28 HB2 HIS 28 5.748 -8.816 12.259 212 HD1 HIS 28 HD1 HIS 28 3.479 -10.826 12.485 213 HD2 HIS 28 HD2 HIS 28 7.381 -11.877 11.517 214 HE1 HIS 28 HE1 HIS 28 3.695 -13.253 13.106 215 HE2 HIS 28 HE2 HIS 28 6.038 -13.890 12.432 216 H TYR 29 H TYR 29 5.710 -6.829 9.790 217 HA TYR 29 HA TYR 29 4.660 -5.021 11.711 218 HB2 TYR 29 HB3 TYR 29 6.874 -4.855 10.423 219 HB3 TYR 29 HB2 TYR 29 5.915 -4.211 9.094 220 HD1 TYR 29 HD1 TYR 29 6.486 -3.654 12.745 221 HD2 TYR 29 HD2 TYR 29 5.628 -1.921 8.955 222 HE1 TYR 29 HE1 TYR 29 6.617 -1.413 13.747 223 HE2 TYR 29 HE2 TYR 29 5.757 0.326 9.947 224 HH TYR 29 HH TYR 29 5.868 0.835 13.338 225 H PHE 30 H PHE 30 3.673 -5.993 8.517 226 HA PHE 30 HA PHE 30 2.065 -3.835 7.791 227 HB2 PHE 30 HB3 PHE 30 2.531 -6.499 6.873 228 HB3 PHE 30 HB2 PHE 30 0.792 -6.233 6.926 229 HD1 PHE 30 HD2 PHE 30 3.830 -4.313 5.903 230 HD2 PHE 30 HD1 PHE 30 -0.145 -5.513 4.971 231 HE1 PHE 30 HE2 PHE 30 3.961 -3.083 3.776 232 HE2 PHE 30 HE1 PHE 30 -0.021 -4.286 2.842 233 HZ PHE 30 HZ PHE 30 2.034 -3.068 2.243 234 H ARG 31 H ARG 31 0.946 -6.905 9.233 235 HA ARG 31 HA ARG 31 -1.648 -5.962 9.805 236 HB2 ARG 31 HB3 ARG 31 -0.033 -8.345 10.502 237 HB3 ARG 31 HB2 ARG 31 -1.372 -7.977 11.580 238 HG2 ARG 31 HG3 ARG 31 -2.962 -8.244 9.886 239 HG3 ARG 31 HG2 ARG 31 -1.746 -8.143 8.611 240 HD2 ARG 31 HD3 ARG 31 -2.418 -10.432 8.833 241 HD3 ARG 31 HD2 ARG 31 -0.776 -10.272 9.454 242 HE ARG 31 HE ARG 31 -2.808 -10.043 11.475 243 HH11 ARG 31 HH11 ARG 31 -0.800 -12.256 9.672 244 HH12 ARG 31 HH12 ARG 31 -0.877 -13.501 10.874 245 HH21 ARG 31 HH21 ARG 31 -2.910 -11.679 13.057 246 HH22 ARG 31 HH22 ARG 31 -2.075 -13.173 12.795 247 H ALA 32 H ALA 32 1.332 -5.994 11.669 248 HA ALA 32 HA ALA 32 0.252 -5.331 14.176 249 HB1 ALA 32 HB1 ALA 32 2.927 -5.271 12.931 250 HB2 ALA 32 HB2 ALA 32 2.401 -5.963 14.466 251 HB3 ALA 32 HB3 ALA 32 2.694 -4.228 14.335 252 H GLN 33 H GLN 33 1.130 -3.360 11.409 253 HA GLN 33 HA GLN 33 0.685 -0.892 12.880 254 HB2 GLN 33 HB3 GLN 33 1.932 -1.652 10.343 255 HB3 GLN 33 HB2 GLN 33 0.970 -0.185 10.232 256 HG2 GLN 33 HG3 GLN 33 2.943 -0.510 12.446 257 HG3 GLN 33 HG2 GLN 33 3.485 -0.043 10.835 258 HE21 GLN 33 HE21 GLN 33 3.070 1.985 10.087 259 HE22 GLN 33 HE22 GLN 33 2.367 3.235 11.051 260 H THR 34 H THR 34 -0.881 -2.855 10.418 261 HA THR 34 HA THR 34 -3.044 -0.921 10.141 262 HB THR 34 HB THR 34 -3.881 -2.419 8.387 263 HG1 THR 34 HG1 THR 34 -1.636 -4.035 9.001 264 HG21 THR 34 HG21 THR 34 -1.978 -0.779 7.939 265 HG22 THR 34 HG22 THR 34 -2.258 -2.064 6.764 266 HG23 THR 34 HG23 THR 34 -0.935 -2.201 7.923 267 H VAL 35 H VAL 35 -2.725 -2.196 12.699 268 HA VAL 35 HA VAL 35 -4.875 -4.153 12.845 269 HB VAL 35 HB VAL 35 -2.837 -4.526 14.174 270 HG11 VAL 35 HG11 VAL 35 -2.824 -1.878 14.658 271 HG12 VAL 35 HG12 VAL 35 -1.955 -3.057 15.640 272 HG13 VAL 35 HG13 VAL 35 -3.532 -2.466 16.162 273 HG21 VAL 35 HG21 VAL 35 -5.166 -3.995 16.005 274 HG22 VAL 35 HG22 VAL 35 -3.916 -5.229 16.166 275 HG23 VAL 35 HG23 VAL 35 -5.113 -5.349 14.876 276 H GLY 36 H GLY 36 -6.891 -3.411 12.887 277 HA2 GLY 36 HA3 GLY 36 -8.735 -2.367 13.855 278 HA3 GLY 36 HA2 GLY 36 -7.644 -1.448 14.881 279 H LYS 37 H LYS 37 -7.024 -1.486 11.483 280 HA LYS 37 HA LYS 37 -8.220 1.196 11.235 281 HB2 LYS 37 HB3 LYS 37 -5.663 0.350 9.878 282 HB3 LYS 37 HB2 LYS 37 -6.335 1.970 9.999 283 HG2 LYS 37 HG3 LYS 37 -5.987 1.036 12.634 284 HG3 LYS 37 HG2 LYS 37 -4.515 0.638 11.746 285 HD2 LYS 37 HD3 LYS 37 -5.641 3.348 11.339 286 HD3 LYS 37 HD2 LYS 37 -4.910 3.013 12.910 287 HE2 LYS 37 HE3 LYS 37 -2.863 2.255 11.758 288 HE3 LYS 37 HE2 LYS 37 -3.598 2.681 10.213 289 HZ1 LYS 37 HZ1 LYS 37 -3.485 4.747 12.279 290 HZ2 LYS 37 HZ2 LYS 37 -3.354 4.891 10.599 291 HZ3 LYS 37 HZ3 LYS 37 -2.037 4.337 11.504 292 H ILE 38 H ILE 38 -7.642 1.621 8.552 293 HA ILE 38 HA ILE 38 -9.049 -0.590 7.209 294 HB ILE 38 HB ILE 38 -9.605 1.861 5.840 295 HG12 ILE 38 HG13 ILE 38 -11.001 2.002 8.451 296 HG13 ILE 38 HG12 ILE 38 -9.326 2.536 8.447 297 HG21 ILE 38 HG21 ILE 38 -10.820 -0.534 6.323 298 HG22 ILE 38 HG22 ILE 38 -11.570 0.851 5.532 299 HG23 ILE 38 HG23 ILE 38 -11.813 0.584 7.258 300 HD11 ILE 38 HD11 ILE 38 -10.428 4.488 8.005 301 HD12 ILE 38 HD12 ILE 38 -11.683 3.692 7.055 302 HD13 ILE 38 HD13 ILE 38 -10.073 3.923 6.373 303 H MET 39 H MET 39 -8.126 -1.326 5.407 304 HA MET 39 HA MET 39 -5.948 0.279 4.233 305 HB2 MET 39 HB3 MET 39 -5.093 -1.736 5.275 306 HB3 MET 39 HB2 MET 39 -6.252 -2.724 4.397 307 HG2 MET 39 HG3 MET 39 -4.349 -1.036 2.856 308 HG3 MET 39 HG2 MET 39 -3.762 -2.517 3.610 309 HE1 MET 39 HE1 MET 39 -6.620 -4.855 2.442 310 HE2 MET 39 HE2 MET 39 -5.475 -4.432 3.714 311 HE3 MET 39 HE3 MET 39 -4.917 -5.282 2.273 312 H VAL 40 H VAL 40 -6.227 0.955 2.218 313 HA VAL 40 HA VAL 40 -8.478 -0.016 0.658 314 HB VAL 40 HB VAL 40 -6.470 2.071 -0.182 315 HG11 VAL 40 HG11 VAL 40 -9.349 2.084 -0.931 316 HG12 VAL 40 HG12 VAL 40 -8.274 0.933 -1.725 317 HG13 VAL 40 HG13 VAL 40 -7.945 2.663 -1.828 318 HG21 VAL 40 HG21 VAL 40 -9.033 2.527 1.343 319 HG22 VAL 40 HG22 VAL 40 -7.919 3.764 0.761 320 HG23 VAL 40 HG23 VAL 40 -7.412 2.645 2.027 321 H VAL 41 H VAL 41 -8.331 -1.526 -0.861 322 HA VAL 41 HA VAL 41 -5.687 -2.059 -2.043 323 HB VAL 41 HB VAL 41 -6.939 -3.771 -0.357 324 HG11 VAL 41 HG11 VAL 41 -7.698 -4.733 -3.109 325 HG12 VAL 41 HG12 VAL 41 -8.822 -4.096 -1.908 326 HG13 VAL 41 HG13 VAL 41 -7.940 -5.589 -1.586 327 HG21 VAL 41 HG21 VAL 41 -4.863 -4.502 -0.709 328 HG22 VAL 41 HG22 VAL 41 -4.855 -3.950 -2.383 329 HG23 VAL 41 HG23 VAL 41 -5.574 -5.507 -1.972 330 H GLY 42 H GLY 42 -5.591 -2.485 -4.228 331 HA2 GLY 42 HA3 GLY 42 -7.762 -1.485 -5.808 332 HA3 GLY 42 HA2 GLY 42 -6.239 -2.118 -6.415 333 H ARG 43 H ARG 43 -8.314 -2.744 -7.904 334 HA ARG 43 HA ARG 43 -9.841 -4.970 -7.170 335 HB2 ARG 43 HB3 ARG 43 -10.412 -3.600 -9.099 336 HB3 ARG 43 HB2 ARG 43 -8.934 -4.093 -9.914 337 HG2 ARG 43 HG3 ARG 43 -10.105 -6.498 -9.359 338 HG3 ARG 43 HG2 ARG 43 -11.499 -5.467 -9.681 339 HD2 ARG 43 HD3 ARG 43 -9.106 -5.758 -11.491 340 HD3 ARG 43 HD2 ARG 43 -10.640 -6.602 -11.699 341 HE ARG 43 HE ARG 43 -10.711 -3.688 -11.602 342 HH11 ARG 43 HH11 ARG 43 -10.796 -6.594 -13.549 343 HH12 ARG 43 HH12 ARG 43 -11.526 -5.808 -14.906 344 HH21 ARG 43 HH21 ARG 43 -11.669 -2.665 -13.393 345 HH22 ARG 43 HH22 ARG 43 -12.020 -3.581 -14.820 346 H ARG 44 H ARG 44 -7.007 -4.908 -9.333 347 HA ARG 44 HA ARG 44 -6.650 -7.662 -9.501 348 HB2 ARG 44 HB3 ARG 44 -4.951 -5.276 -9.973 349 HB3 ARG 44 HB2 ARG 44 -4.111 -6.808 -9.774 350 HG2 ARG 44 HG3 ARG 44 -4.412 -6.758 -12.041 351 HG3 ARG 44 HG2 ARG 44 -5.844 -7.657 -11.533 352 HD2 ARG 44 HD3 ARG 44 -6.720 -6.102 -13.009 353 HD3 ARG 44 HD2 ARG 44 -6.975 -5.334 -11.443 354 HE ARG 44 HE ARG 44 -5.571 -3.661 -12.095 355 HH11 ARG 44 HH11 ARG 44 -4.974 -6.443 -14.116 356 HH12 ARG 44 HH12 ARG 44 -3.872 -5.607 -15.157 357 HH21 ARG 44 HH21 ARG 44 -4.122 -2.558 -13.465 358 HH22 ARG 44 HH22 ARG 44 -3.387 -3.402 -14.787 359 H THR 45 H THR 45 -5.967 -5.491 -6.922 360 HA THR 45 HA THR 45 -3.980 -7.059 -5.621 361 HB THR 45 HB THR 45 -5.601 -5.292 -3.928 362 HG1 THR 45 HG1 THR 45 -4.160 -4.166 -6.090 363 HG21 THR 45 HG21 THR 45 -2.694 -5.568 -4.587 364 HG22 THR 45 HG22 THR 45 -3.515 -5.861 -3.054 365 HG23 THR 45 HG23 THR 45 -3.316 -4.212 -3.647 366 H TYR 46 H TYR 46 -7.416 -6.453 -4.763 367 HA TYR 46 HA TYR 46 -7.637 -8.184 -2.655 368 HB2 TYR 46 HB3 TYR 46 -9.998 -8.222 -2.999 369 HB3 TYR 46 HB2 TYR 46 -9.437 -6.643 -3.527 370 HD1 TYR 46 HD2 TYR 46 -9.997 -10.040 -5.024 371 HD2 TYR 46 HD1 TYR 46 -10.398 -5.821 -5.462 372 HE1 TYR 46 HE2 TYR 46 -11.086 -10.376 -7.188 373 HE2 TYR 46 HE1 TYR 46 -11.507 -6.157 -7.628 374 HH TYR 46 HH TYR 46 -12.715 -7.853 -8.840 375 H GLU 47 H GLU 47 -7.622 -8.970 -6.065 376 HA GLU 47 HA GLU 47 -8.196 -11.774 -5.576 377 HB2 GLU 47 HB3 GLU 47 -7.452 -11.750 -8.158 378 HB3 GLU 47 HB2 GLU 47 -9.080 -11.361 -7.627 379 HG2 GLU 47 HG3 GLU 47 -8.757 -9.074 -7.937 380 HG3 GLU 47 HG2 GLU 47 -7.001 -9.231 -7.946 381 H SER 48 H SER 48 -5.482 -9.712 -6.068 382 HA SER 48 HA SER 48 -3.669 -12.003 -6.326 383 HB2 SER 48 HB3 SER 48 -3.086 -9.048 -6.628 384 HB3 SER 48 HB2 SER 48 -1.950 -10.361 -6.934 385 HG SER 48 HG SER 48 -3.349 -11.078 -8.595 386 H PHE 49 H PHE 49 -5.054 -11.143 -3.803 387 HA PHE 49 HA PHE 49 -2.680 -10.526 -2.177 388 HB2 PHE 49 HB3 PHE 49 -5.098 -9.248 -2.172 389 HB3 PHE 49 HB2 PHE 49 -5.306 -10.396 -0.856 390 HD1 PHE 49 HD1 PHE 49 -2.838 -7.909 -2.128 391 HD2 PHE 49 HD2 PHE 49 -4.609 -9.796 1.251 392 HE1 PHE 49 HE1 PHE 49 -1.571 -6.418 -0.636 393 HE2 PHE 49 HE2 PHE 49 -3.346 -8.308 2.749 394 HZ PHE 49 HZ PHE 49 -1.825 -6.616 1.806 395 HA PRO 50 HA PRO 50 -3.023 -14.667 -0.592 396 HB2 PRO 50 HB3 PRO 50 -1.126 -14.554 1.291 397 HB3 PRO 50 HB2 PRO 50 -0.720 -14.487 -0.428 398 HG2 PRO 50 HG3 PRO 50 -0.909 -12.263 1.562 399 HG3 PRO 50 HG2 PRO 50 0.294 -12.526 0.288 400 HD2 PRO 50 HD3 PRO 50 -1.854 -10.813 0.073 401 HD3 PRO 50 HD2 PRO 50 -1.014 -11.545 -1.307 402 H LYS 51 H LYS 51 -3.352 -11.842 1.454 403 HA LYS 51 HA LYS 51 -4.835 -13.468 3.415 404 HB2 LYS 51 HB3 LYS 51 -2.648 -12.037 3.991 405 HB3 LYS 51 HB2 LYS 51 -3.848 -10.763 4.158 406 HG2 LYS 51 HG3 LYS 51 -3.677 -11.599 6.304 407 HG3 LYS 51 HG2 LYS 51 -5.091 -12.443 5.670 408 HD2 LYS 51 HD3 LYS 51 -3.682 -14.014 6.840 409 HD3 LYS 51 HD2 LYS 51 -3.640 -14.370 5.112 410 HE2 LYS 51 HE3 LYS 51 -1.569 -12.503 5.722 411 HE3 LYS 51 HE2 LYS 51 -1.471 -13.852 6.854 412 HZ1 LYS 51 HZ1 LYS 51 -0.915 -15.292 5.230 413 HZ2 LYS 51 HZ2 LYS 51 -0.360 -13.896 4.454 414 HZ3 LYS 51 HZ3 LYS 51 -1.873 -14.540 4.056 415 H ARG 52 H ARG 52 -6.633 -13.174 1.850 416 HA ARG 52 HA ARG 52 -7.956 -10.573 2.255 417 HB2 ARG 52 HB3 ARG 52 -9.157 -11.075 0.095 418 HB3 ARG 52 HB2 ARG 52 -7.439 -10.736 -0.060 419 HG2 ARG 52 HG3 ARG 52 -6.993 -12.761 -0.883 420 HG3 ARG 52 HG2 ARG 52 -8.032 -13.570 0.291 421 HD2 ARG 52 HD3 ARG 52 -8.823 -12.287 -2.313 422 HD3 ARG 52 HD2 ARG 52 -8.958 -13.983 -1.857 423 HE ARG 52 HE ARG 52 -10.509 -12.744 -0.030 424 HH11 ARG 52 HH11 ARG 52 -10.379 -12.605 -3.515 425 HH12 ARG 52 HH12 ARG 52 -12.067 -12.261 -3.689 426 HH21 ARG 52 HH21 ARG 52 -12.730 -12.292 -0.257 427 HH22 ARG 52 HH22 ARG 52 -13.402 -12.083 -1.840 428 HA PRO 53 HA PRO 53 -9.232 -9.722 3.196 429 HB2 PRO 53 HB3 PRO 53 -10.879 -9.484 5.434 430 HB3 PRO 53 HB2 PRO 53 -11.343 -9.124 3.771 431 HG2 PRO 53 HG3 PRO 53 -12.322 -11.217 5.422 432 HG3 PRO 53 HG2 PRO 53 -12.689 -10.929 3.716 433 HD2 PRO 53 HD3 PRO 53 -10.792 -12.842 4.943 434 HD3 PRO 53 HD2 PRO 53 -11.635 -12.925 3.382 435 H LEU 54 H LEU 54 -8.134 -8.545 4.881 436 HA LEU 54 HA LEU 54 -6.322 -10.145 6.369 437 HB2 LEU 54 HB3 LEU 54 -6.870 -7.194 6.272 438 HB3 LEU 54 HB2 LEU 54 -5.701 -7.871 7.388 439 HG LEU 54 HG LEU 54 -5.458 -8.529 4.487 440 HD11 LEU 54 HD11 LEU 54 -4.463 -6.536 3.896 441 HD12 LEU 54 HD12 LEU 54 -4.161 -6.067 5.569 442 HD13 LEU 54 HD13 LEU 54 -5.796 -5.988 4.913 443 HD21 LEU 54 HD21 LEU 54 -3.482 -8.086 6.722 444 HD22 LEU 54 HD22 LEU 54 -3.070 -8.538 5.068 445 HD23 LEU 54 HD23 LEU 54 -4.003 -9.643 6.078 446 HA PRO 55 HA PRO 55 -8.772 -10.662 10.033 447 HB2 PRO 55 HB3 PRO 55 -6.885 -11.675 11.662 448 HB3 PRO 55 HB2 PRO 55 -7.555 -12.597 10.311 449 HG2 PRO 55 HG3 PRO 55 -4.975 -11.088 10.479 450 HG3 PRO 55 HG2 PRO 55 -5.291 -12.690 9.787 451 HD2 PRO 55 HD3 PRO 55 -5.078 -10.426 8.283 452 HD3 PRO 55 HD2 PRO 55 -6.069 -11.820 7.810 453 H GLU 56 H GLU 56 -9.182 -9.709 11.981 454 HA GLU 56 HA GLU 56 -9.263 -8.021 13.494 455 HB2 GLU 56 HB3 GLU 56 -6.964 -9.409 13.903 456 HB3 GLU 56 HB2 GLU 56 -6.335 -7.779 13.710 457 HG2 GLU 56 HG3 GLU 56 -7.294 -7.028 15.627 458 HG3 GLU 56 HG2 GLU 56 -8.650 -8.149 15.520 459 H ARG 57 H ARG 57 -9.008 -7.231 10.646 460 HA ARG 57 HA ARG 57 -8.424 -4.445 11.169 461 HB2 ARG 57 HB3 ARG 57 -6.750 -4.109 9.582 462 HB3 ARG 57 HB2 ARG 57 -6.274 -5.603 10.367 463 HG2 ARG 57 HG3 ARG 57 -5.925 -6.101 8.157 464 HG3 ARG 57 HG2 ARG 57 -7.547 -6.741 8.412 465 HD2 ARG 57 HD3 ARG 57 -6.997 -5.254 6.320 466 HD3 ARG 57 HD2 ARG 57 -8.539 -5.103 7.154 467 HE ARG 57 HE ARG 57 -7.939 -2.989 7.819 468 HH11 ARG 57 HH11 ARG 57 -5.125 -4.641 6.583 469 HH12 ARG 57 HH12 ARG 57 -4.138 -3.217 6.580 470 HH21 ARG 57 HH21 ARG 57 -6.646 -1.119 7.819 471 HH22 ARG 57 HH22 ARG 57 -5.002 -1.217 7.283 472 H THR 58 H THR 58 -9.180 -3.011 9.456 473 HA THR 58 HA THR 58 -11.565 -4.109 8.202 474 HB THR 58 HB THR 58 -10.655 -1.233 8.172 475 HG1 THR 58 HG1 THR 58 -11.790 -0.960 10.069 476 HG21 THR 58 HG21 THR 58 -12.496 -1.670 6.681 477 HG22 THR 58 HG22 THR 58 -13.057 -0.753 8.079 478 HG23 THR 58 HG23 THR 58 -13.382 -2.483 7.971 479 H ASN 59 H ASN 59 -11.486 -4.851 6.197 480 HA ASN 59 HA ASN 59 -9.316 -4.005 4.440 481 HB2 ASN 59 HB3 ASN 59 -11.151 -5.964 3.304 482 HB3 ASN 59 HB2 ASN 59 -9.411 -6.060 3.537 483 HD21 ASN 59 HD21 ASN 59 -8.692 -6.547 5.769 484 HD22 ASN 59 HD22 ASN 59 -9.631 -7.666 6.691 485 H VAL 60 H VAL 60 -9.633 -3.206 2.357 486 HA VAL 60 HA VAL 60 -12.347 -2.359 1.652 487 HB VAL 60 HB VAL 60 -9.947 -0.527 1.733 488 HG11 VAL 60 HG11 VAL 60 -12.134 1.030 1.151 489 HG12 VAL 60 HG12 VAL 60 -12.403 -0.410 0.169 490 HG13 VAL 60 HG13 VAL 60 -10.905 0.506 0.000 491 HG21 VAL 60 HG21 VAL 60 -11.999 0.682 3.095 492 HG22 VAL 60 HG22 VAL 60 -10.654 -0.193 3.826 493 HG23 VAL 60 HG23 VAL 60 -12.186 -1.016 3.534 494 H VAL 61 H VAL 61 -12.805 -2.585 -0.460 495 HA VAL 61 HA VAL 61 -10.576 -3.287 -2.254 496 HB VAL 61 HB VAL 61 -13.469 -4.138 -2.439 497 HG11 VAL 61 HG11 VAL 61 -11.993 -5.791 -4.065 498 HG12 VAL 61 HG12 VAL 61 -11.264 -4.210 -4.344 499 HG13 VAL 61 HG13 VAL 61 -12.993 -4.441 -4.602 500 HG21 VAL 61 HG21 VAL 61 -12.954 -6.045 -1.366 501 HG22 VAL 61 HG22 VAL 61 -11.620 -5.098 -0.708 502 HG23 VAL 61 HG23 VAL 61 -11.354 -6.147 -2.100 503 H LEU 62 H LEU 62 -10.306 -2.236 -4.126 504 HA LEU 62 HA LEU 62 -12.325 -0.233 -4.887 505 HB2 LEU 62 HB3 LEU 62 -10.162 0.660 -3.873 506 HB3 LEU 62 HB2 LEU 62 -9.360 0.078 -5.320 507 HG LEU 62 HG LEU 62 -11.016 1.540 -6.622 508 HD11 LEU 62 HD11 LEU 62 -11.780 2.133 -3.876 509 HD12 LEU 62 HD12 LEU 62 -12.640 2.441 -5.385 510 HD13 LEU 62 HD13 LEU 62 -11.413 3.576 -4.820 511 HD21 LEU 62 HD21 LEU 62 -9.643 3.653 -5.819 512 HD22 LEU 62 HD22 LEU 62 -8.888 2.351 -6.738 513 HD23 LEU 62 HD23 LEU 62 -8.698 2.419 -4.986 514 H THR 63 H THR 63 -13.305 -1.223 -6.567 515 HA THR 63 HA THR 63 -11.607 -2.006 -8.835 516 HB THR 63 HB THR 63 -12.427 -4.026 -7.703 517 HG1 THR 63 HG1 THR 63 -13.988 -3.870 -10.019 518 HG21 THR 63 HG21 THR 63 -15.021 -2.631 -7.869 519 HG22 THR 63 HG22 THR 63 -14.406 -3.760 -6.661 520 HG23 THR 63 HG23 THR 63 -15.024 -4.363 -8.198 521 H HIS 64 H HIS 64 -12.414 -1.526 -10.883 522 HA HIS 64 HA HIS 64 -14.123 0.709 -11.084 523 HB2 HIS 64 HB3 HIS 64 -12.793 -1.131 -13.009 524 HB3 HIS 64 HB2 HIS 64 -14.130 -0.162 -13.613 525 HD1 HIS 64 HD1 HIS 64 -13.158 2.272 -11.573 526 HD2 HIS 64 HD2 HIS 64 -11.059 0.411 -14.639 527 HE1 HIS 64 HE1 HIS 64 -11.383 3.912 -12.268 528 HE2 HIS 64 HE2 HIS 64 -10.075 2.731 -14.066 529 H GLN 65 H GLN 65 -14.684 -2.732 -11.352 530 HA GLN 65 HA GLN 65 -17.111 -2.837 -12.645 531 HB2 GLN 65 HB3 GLN 65 -15.789 -4.516 -10.574 532 HB3 GLN 65 HB2 GLN 65 -17.494 -4.807 -10.890 533 HG2 GLN 65 HG3 GLN 65 -17.115 -5.640 -12.963 534 HG3 GLN 65 HG2 GLN 65 -15.696 -4.630 -13.233 535 HE21 GLN 65 HE21 GLN 65 -13.704 -5.262 -12.291 536 HE22 GLN 65 HE22 GLN 65 -13.404 -6.914 -11.882 537 H GLU 66 H GLU 66 -19.131 -2.245 -12.206 538 HA GLU 66 HA GLU 66 -19.668 -0.810 -9.756 539 HB2 GLU 66 HB3 GLU 66 -21.934 -0.462 -10.836 540 HB3 GLU 66 HB2 GLU 66 -20.557 0.204 -11.703 541 HG2 GLU 66 HG3 GLU 66 -20.932 -1.065 -13.489 542 HG3 GLU 66 HG2 GLU 66 -21.183 -2.513 -12.516 543 H ASP 67 H ASP 67 -20.532 -3.865 -11.234 544 HA ASP 67 HA ASP 67 -22.368 -4.476 -9.054 545 HB2 ASP 67 HB3 ASP 67 -22.580 -6.651 -10.522 546 HB3 ASP 67 HB2 ASP 67 -23.406 -5.172 -10.983 547 H TYR 68 H TYR 68 -19.307 -4.422 -8.877 548 HA TYR 68 HA TYR 68 -18.486 -7.121 -8.502 549 HB2 TYR 68 HB3 TYR 68 -16.883 -5.290 -8.919 550 HB3 TYR 68 HB2 TYR 68 -17.290 -4.589 -7.356 551 HD1 TYR 68 HD1 TYR 68 -16.274 -7.941 -8.682 552 HD2 TYR 68 HD2 TYR 68 -15.760 -4.970 -5.681 553 HE1 TYR 68 HE1 TYR 68 -14.543 -9.324 -7.617 554 HE2 TYR 68 HE2 TYR 68 -14.026 -6.344 -4.608 555 HH TYR 68 HH TYR 68 -13.468 -8.881 -4.543 556 H GLN 69 H GLN 69 -18.185 -8.282 -6.575 557 HA GLN 69 HA GLN 69 -19.536 -7.183 -4.204 558 HB2 GLN 69 HB3 GLN 69 -19.843 -9.982 -5.300 559 HB3 GLN 69 HB2 GLN 69 -20.498 -9.420 -3.768 560 HG2 GLN 69 HG3 GLN 69 -21.255 -8.476 -6.521 561 HG3 GLN 69 HG2 GLN 69 -22.238 -9.427 -5.409 562 HE21 GLN 69 HE21 GLN 69 -22.129 -6.543 -6.691 563 HE22 GLN 69 HE22 GLN 69 -22.675 -5.555 -5.382 564 H ALA 70 H ALA 70 -17.875 -6.868 -2.857 565 HA ALA 70 HA ALA 70 -15.881 -9.003 -2.534 566 HB1 ALA 70 HB1 ALA 70 -15.226 -6.565 -3.043 567 HB2 ALA 70 HB2 ALA 70 -14.361 -7.415 -1.763 568 HB3 ALA 70 HB3 ALA 70 -15.628 -6.259 -1.353 569 H GLN 71 H GLN 71 -16.864 -10.404 -1.146 570 HA GLN 71 HA GLN 71 -18.346 -9.603 1.140 571 HB2 GLN 71 HB3 GLN 71 -17.227 -12.208 0.160 572 HB3 GLN 71 HB2 GLN 71 -17.901 -12.092 1.780 573 HG2 GLN 71 HG3 GLN 71 -19.718 -12.801 0.587 574 HG3 GLN 71 HG2 GLN 71 -19.949 -11.054 0.555 575 HE21 GLN 71 HE21 GLN 71 -19.185 -9.916 -1.363 576 HE22 GLN 71 HE22 GLN 71 -19.258 -10.716 -2.893 577 H GLY 72 H GLY 72 -17.654 -8.983 3.070 578 HA2 GLY 72 HA3 GLY 72 -16.283 -9.299 5.008 579 HA3 GLY 72 HA2 GLY 72 -14.985 -9.840 3.956 580 H ALA 73 H ALA 73 -15.407 -7.577 2.058 581 HA ALA 73 HA ALA 73 -14.360 -5.406 3.758 582 HB1 ALA 73 HB1 ALA 73 -12.680 -4.922 2.206 583 HB2 ALA 73 HB2 ALA 73 -13.450 -5.877 0.939 584 HB3 ALA 73 HB3 ALA 73 -12.681 -6.683 2.306 585 H VAL 74 H VAL 74 -14.418 -3.246 2.571 586 HA VAL 74 HA VAL 74 -17.105 -2.842 1.582 587 HB VAL 74 HB VAL 74 -16.104 -0.388 1.375 588 HG11 VAL 74 HG11 VAL 74 -17.850 -0.467 2.807 589 HG12 VAL 74 HG12 VAL 74 -16.568 -0.322 4.009 590 HG13 VAL 74 HG13 VAL 74 -17.248 -1.905 3.633 591 HG21 VAL 74 HG21 VAL 74 -13.803 -1.153 1.928 592 HG22 VAL 74 HG22 VAL 74 -14.378 -1.562 3.544 593 HG23 VAL 74 HG23 VAL 74 -14.416 0.112 2.992 594 H VAL 75 H VAL 75 -17.682 -2.225 -0.458 595 HA VAL 75 HA VAL 75 -15.539 -2.340 -2.476 596 HB VAL 75 HB VAL 75 -18.455 -2.976 -2.902 597 HG11 VAL 75 HG11 VAL 75 -17.551 -4.063 -4.974 598 HG12 VAL 75 HG12 VAL 75 -16.004 -3.291 -4.625 599 HG13 VAL 75 HG13 VAL 75 -17.430 -2.304 -4.946 600 HG21 VAL 75 HG21 VAL 75 -16.687 -5.231 -3.128 601 HG22 VAL 75 HG22 VAL 75 -18.122 -5.030 -2.122 602 HG23 VAL 75 HG23 VAL 75 -16.548 -4.500 -1.529 603 H VAL 76 H VAL 76 -15.304 -0.786 -3.932 604 HA VAL 76 HA VAL 76 -17.380 1.180 -4.413 605 HB VAL 76 HB VAL 76 -15.917 3.108 -4.014 606 HG11 VAL 76 HG11 VAL 76 -16.156 1.369 -1.562 607 HG12 VAL 76 HG12 VAL 76 -17.462 2.329 -2.257 608 HG13 VAL 76 HG13 VAL 76 -16.033 3.128 -1.599 609 HG21 VAL 76 HG21 VAL 76 -13.982 1.719 -2.337 610 HG22 VAL 76 HG22 VAL 76 -13.738 2.972 -3.556 611 HG23 VAL 76 HG23 VAL 76 -13.861 1.282 -4.043 612 H HIS 77 H HIS 77 -16.368 2.869 -6.096 613 HA HIS 77 HA HIS 77 -14.555 1.422 -7.891 614 HB2 HIS 77 HB3 HIS 77 -16.855 2.806 -9.168 615 HB3 HIS 77 HB2 HIS 77 -15.972 1.372 -9.685 616 HD1 HIS 77 HD1 HIS 77 -16.406 -0.649 -7.618 617 HD2 HIS 77 HD2 HIS 77 -19.388 2.070 -8.608 618 HE1 HIS 77 HE1 HIS 77 -18.555 -1.705 -6.855 619 HE2 HIS 77 HE2 HIS 77 -20.337 -0.003 -7.384 620 H ASP 78 H ASP 78 -15.571 4.408 -6.549 621 HA ASP 78 HA ASP 78 -13.642 5.786 -8.291 622 HB2 ASP 78 HB3 ASP 78 -16.323 6.243 -8.423 623 HB3 ASP 78 HB2 ASP 78 -15.839 7.443 -7.229 624 H VAL 79 H VAL 79 -12.646 7.684 -7.351 625 HA VAL 79 HA VAL 79 -11.687 7.253 -4.767 626 HB VAL 79 HB VAL 79 -10.937 9.712 -4.999 627 HG11 VAL 79 HG11 VAL 79 -9.312 8.069 -5.285 628 HG12 VAL 79 HG12 VAL 79 -9.238 9.001 -6.781 629 HG13 VAL 79 HG13 VAL 79 -10.072 7.447 -6.750 630 HG21 VAL 79 HG21 VAL 79 -11.606 9.279 -7.886 631 HG22 VAL 79 HG22 VAL 79 -11.078 10.758 -7.086 632 HG23 VAL 79 HG23 VAL 79 -12.699 10.131 -6.796 633 H ALA 80 H ALA 80 -14.270 9.294 -5.992 634 HA ALA 80 HA ALA 80 -14.741 10.726 -3.597 635 HB1 ALA 80 HB1 ALA 80 -17.052 10.248 -5.361 636 HB2 ALA 80 HB2 ALA 80 -15.641 10.975 -6.130 637 HB3 ALA 80 HB3 ALA 80 -16.390 11.760 -4.740 638 H ALA 81 H ALA 81 -16.082 7.736 -4.922 639 HA ALA 81 HA ALA 81 -18.100 7.283 -3.063 640 HB1 ALA 81 HB1 ALA 81 -18.229 5.731 -4.716 641 HB2 ALA 81 HB2 ALA 81 -17.332 4.767 -3.544 642 HB3 ALA 81 HB3 ALA 81 -16.478 5.576 -4.858 643 H VAL 82 H VAL 82 -14.908 5.684 -3.005 644 HA VAL 82 HA VAL 82 -15.000 4.668 -0.468 645 HB VAL 82 HB VAL 82 -13.191 4.437 -2.318 646 HG11 VAL 82 HG11 VAL 82 -11.568 6.299 -0.675 647 HG12 VAL 82 HG12 VAL 82 -12.648 6.992 -1.884 648 HG13 VAL 82 HG13 VAL 82 -11.403 5.843 -2.371 649 HG21 VAL 82 HG21 VAL 82 -11.686 3.453 -0.776 650 HG22 VAL 82 HG22 VAL 82 -13.303 3.263 -0.096 651 HG23 VAL 82 HG23 VAL 82 -12.224 4.510 0.529 652 H PHE 83 H PHE 83 -14.346 7.996 -1.416 653 HA PHE 83 HA PHE 83 -13.242 8.856 1.026 654 HB2 PHE 83 HB3 PHE 83 -14.539 10.205 -1.303 655 HB3 PHE 83 HB2 PHE 83 -14.316 11.128 0.176 656 HD1 PHE 83 HD2 PHE 83 -11.703 9.981 1.082 657 HD2 PHE 83 HD1 PHE 83 -13.042 11.236 -2.759 658 HE1 PHE 83 HE2 PHE 83 -9.379 10.447 0.426 659 HE2 PHE 83 HE1 PHE 83 -10.720 11.705 -3.419 660 HZ PHE 83 HZ PHE 83 -8.885 11.311 -1.826 661 H ALA 84 H ALA 84 -16.574 8.588 -0.102 662 HA ALA 84 HA ALA 84 -17.785 9.918 2.072 663 HB1 ALA 84 HB1 ALA 84 -19.057 7.639 0.576 664 HB2 ALA 84 HB2 ALA 84 -18.854 9.234 -0.147 665 HB3 ALA 84 HB3 ALA 84 -19.833 9.043 1.307 666 H TYR 85 H TYR 85 -16.752 6.618 1.548 667 HA TYR 85 HA TYR 85 -17.904 5.485 3.859 668 HB2 TYR 85 HB3 TYR 85 -17.011 3.610 3.012 669 HB3 TYR 85 HB2 TYR 85 -16.247 4.580 1.763 670 HD1 TYR 85 HD1 TYR 85 -15.647 3.604 5.334 671 HD2 TYR 85 HD2 TYR 85 -13.988 4.334 1.489 672 HE1 TYR 85 HE1 TYR 85 -13.432 2.932 6.168 673 HE2 TYR 85 HE2 TYR 85 -11.769 3.668 2.309 674 HH TYR 85 HH TYR 85 -10.775 2.372 4.075 675 H ALA 86 H ALA 86 -14.518 6.520 3.330 676 HA ALA 86 HA ALA 86 -13.499 6.335 5.814 677 HB1 ALA 86 HB1 ALA 86 -12.120 8.372 5.286 678 HB2 ALA 86 HB2 ALA 86 -13.096 8.560 3.829 679 HB3 ALA 86 HB3 ALA 86 -12.113 7.112 4.052 680 H LYS 87 H LYS 87 -15.773 8.819 4.743 681 HA LYS 87 HA LYS 87 -15.568 10.484 7.021 682 HB2 LYS 87 HB3 LYS 87 -16.915 10.644 4.664 683 HB3 LYS 87 HB2 LYS 87 -18.231 10.232 5.756 684 HG2 LYS 87 HG3 LYS 87 -18.274 12.530 5.793 685 HG3 LYS 87 HG2 LYS 87 -17.288 12.163 7.210 686 HD2 LYS 87 HD3 LYS 87 -15.362 12.298 5.345 687 HD3 LYS 87 HD2 LYS 87 -16.534 13.410 4.637 688 HE2 LYS 87 HE3 LYS 87 -16.628 14.492 6.954 689 HE3 LYS 87 HE2 LYS 87 -15.161 13.578 7.302 690 HZ1 LYS 87 HZ1 LYS 87 -15.545 15.881 5.571 691 HZ2 LYS 87 HZ2 LYS 87 -14.494 14.690 4.988 692 HZ3 LYS 87 HZ3 LYS 87 -14.195 15.423 6.483 693 H GLN 88 H GLN 88 -17.736 7.836 6.191 694 HA GLN 88 HA GLN 88 -19.268 7.795 8.535 695 HB2 GLN 88 HB3 GLN 88 -19.324 6.395 6.218 696 HB3 GLN 88 HB2 GLN 88 -18.667 5.174 7.298 697 HG2 GLN 88 HG3 GLN 88 -20.656 4.788 8.187 698 HG3 GLN 88 HG2 GLN 88 -20.907 6.501 8.518 699 HE21 GLN 88 HE21 GLN 88 -21.563 7.820 6.605 700 HE22 GLN 88 HE22 GLN 88 -22.687 7.112 5.501 701 H HIS 89 H HIS 89 -16.034 6.809 7.938 702 HA HIS 89 HA HIS 89 -15.896 5.495 10.569 703 HB2 HIS 89 HB3 HIS 89 -14.515 5.001 7.974 704 HB3 HIS 89 HB2 HIS 89 -13.606 4.706 9.454 705 HD1 HIS 89 HD1 HIS 89 -15.833 3.466 11.183 706 HD2 HIS 89 HD2 HIS 89 -15.125 2.461 7.214 707 HE1 HIS 89 HE1 HIS 89 -16.806 1.166 10.888 708 HE2 HIS 89 HE2 HIS 89 -16.434 0.611 8.459 709 HA PRO 90 HA PRO 90 -13.631 9.517 10.946 710 HB2 PRO 90 HB3 PRO 90 -14.426 10.029 13.487 711 HB3 PRO 90 HB2 PRO 90 -15.396 10.454 12.072 712 HG2 PRO 90 HG3 PRO 90 -15.645 8.096 13.901 713 HG3 PRO 90 HG2 PRO 90 -16.920 9.134 13.234 714 HD2 PRO 90 HD3 PRO 90 -16.331 6.702 12.200 715 HD3 PRO 90 HD2 PRO 90 -16.913 8.048 11.200 716 H ASP 91 H ASP 91 -13.935 7.014 13.485 717 HA ASP 91 HA ASP 91 -11.403 7.661 14.641 718 HB2 ASP 91 HB3 ASP 91 -13.495 6.506 15.707 719 HB3 ASP 91 HB2 ASP 91 -12.768 5.030 15.078 720 H GLN 92 H GLN 92 -12.280 5.910 11.884 721 HA GLN 92 HA GLN 92 -9.876 4.237 12.004 722 HB2 GLN 92 HB3 GLN 92 -12.504 3.886 10.909 723 HB3 GLN 92 HB2 GLN 92 -11.318 3.737 9.621 724 HG2 GLN 92 HG3 GLN 92 -10.553 1.780 10.380 725 HG3 GLN 92 HG2 GLN 92 -10.617 2.295 12.065 726 HE21 GLN 92 HE21 GLN 92 -12.748 1.403 9.377 727 HE22 GLN 92 HE22 GLN 92 -13.905 0.561 10.345 728 H GLU 93 H GLU 93 -8.147 4.586 10.742 729 HA GLU 93 HA GLU 93 -8.174 6.956 9.033 730 HB2 GLU 93 HB3 GLU 93 -5.843 5.263 9.949 731 HB3 GLU 93 HB2 GLU 93 -5.736 6.797 9.097 732 HG2 GLU 93 HG3 GLU 93 -7.326 6.965 11.525 733 HG3 GLU 93 HG2 GLU 93 -5.669 6.440 11.819 734 H LEU 94 H LEU 94 -7.151 6.905 6.926 735 HA LEU 94 HA LEU 94 -7.665 4.360 5.559 736 HB2 LEU 94 HB3 LEU 94 -7.826 7.217 4.779 737 HB3 LEU 94 HB2 LEU 94 -7.337 6.086 3.532 738 HG LEU 94 HG LEU 94 -9.429 4.766 4.056 739 HD11 LEU 94 HD11 LEU 94 -11.145 5.691 5.344 740 HD12 LEU 94 HD12 LEU 94 -10.377 7.278 5.392 741 HD13 LEU 94 HD13 LEU 94 -9.691 5.939 6.311 742 HD21 LEU 94 HD21 LEU 94 -9.833 7.596 3.095 743 HD22 LEU 94 HD22 LEU 94 -10.848 6.201 2.729 744 HD23 LEU 94 HD23 LEU 94 -9.196 6.275 2.115 745 H VAL 95 H VAL 95 -6.064 3.199 4.709 746 HA VAL 95 HA VAL 95 -3.497 4.496 4.136 747 HB VAL 95 HB VAL 95 -3.687 1.859 5.593 748 HG11 VAL 95 HG11 VAL 95 -1.702 2.171 4.165 749 HG12 VAL 95 HG12 VAL 95 -1.292 2.095 5.878 750 HG13 VAL 95 HG13 VAL 95 -1.320 3.650 5.047 751 HG21 VAL 95 HG21 VAL 95 -4.241 3.179 7.344 752 HG22 VAL 95 HG22 VAL 95 -3.593 4.637 6.591 753 HG23 VAL 95 HG23 VAL 95 -2.505 3.489 7.371 754 H ILE 96 H ILE 96 -2.937 4.076 2.108 755 HA ILE 96 HA ILE 96 -4.197 1.908 0.658 756 HB ILE 96 HB ILE 96 -2.071 3.713 -0.463 757 HG12 ILE 96 HG13 ILE 96 -3.642 5.223 0.579 758 HG13 ILE 96 HG12 ILE 96 -3.922 5.243 -1.159 759 HG21 ILE 96 HG21 ILE 96 -4.320 2.076 -1.576 760 HG22 ILE 96 HG22 ILE 96 -2.605 2.038 -1.988 761 HG23 ILE 96 HG23 ILE 96 -3.605 3.397 -2.500 762 HD11 ILE 96 HD11 ILE 96 -5.540 3.636 0.800 763 HD12 ILE 96 HD12 ILE 96 -5.866 3.869 -0.918 764 HD13 ILE 96 HD13 ILE 96 -5.988 5.231 0.196 765 H ALA 97 H ALA 97 -3.307 -0.001 0.173 766 HA ALA 97 HA ALA 97 -0.473 -0.405 0.865 767 HB1 ALA 97 HB1 ALA 97 -2.871 -1.933 1.444 768 HB2 ALA 97 HB2 ALA 97 -1.274 -2.012 2.185 769 HB3 ALA 97 HB3 ALA 97 -1.607 -2.919 0.710 770 H GLY 98 H GLY 98 -2.892 -0.753 -1.618 771 HA2 GLY 98 HA3 GLY 98 -1.101 -0.836 -3.732 772 HA3 GLY 98 HA2 GLY 98 -1.433 -2.509 -3.311 773 H GLY 99 H GLY 99 -3.815 -1.684 -5.961 774 HA2 GLY 99 HA3 GLY 99 -1.013 -2.211 -5.349 775 HA3 GLY 99 HA2 GLY 99 -1.827 -2.520 -6.870 776 H ALA 100 H ALA 100 -0.186 -1.558 -8.070 777 HA ALA 100 HA ALA 100 0.902 0.979 -7.621 778 HB1 ALA 100 HB1 ALA 100 1.974 -0.588 -9.098 779 HB2 ALA 100 HB2 ALA 100 1.595 0.882 -9.995 780 HB3 ALA 100 HB3 ALA 100 0.594 -0.556 -10.196 781 H GLN 101 H GLN 101 -1.914 -0.005 -9.541 782 HA GLN 101 HA GLN 101 -2.423 2.543 -10.654 783 HB2 GLN 101 HB3 GLN 101 -3.543 -0.035 -10.825 784 HB3 GLN 101 HB2 GLN 101 -4.846 1.022 -10.301 785 HG2 GLN 101 HG3 GLN 101 -3.103 1.526 -12.700 786 HG3 GLN 101 HG2 GLN 101 -4.688 0.757 -12.754 787 HE21 GLN 101 HE21 GLN 101 -6.498 2.031 -11.878 788 HE22 GLN 101 HE22 GLN 101 -6.488 3.741 -12.120 789 H ILE 102 H ILE 102 -3.318 1.031 -7.632 790 HA ILE 102 HA ILE 102 -5.299 2.944 -6.898 791 HB ILE 102 HB ILE 102 -3.700 1.176 -5.047 792 HG12 ILE 102 HG13 ILE 102 -4.745 -0.123 -6.879 793 HG13 ILE 102 HG12 ILE 102 -5.460 -0.483 -5.311 794 HG21 ILE 102 HG21 ILE 102 -5.057 3.038 -4.060 795 HG22 ILE 102 HG22 ILE 102 -5.510 1.421 -3.520 796 HG23 ILE 102 HG23 ILE 102 -6.491 2.255 -4.725 797 HD11 ILE 102 HD11 ILE 102 -6.932 -0.075 -7.457 798 HD12 ILE 102 HD12 ILE 102 -6.744 1.609 -6.970 799 HD13 ILE 102 HD13 ILE 102 -7.460 0.446 -5.857 800 H PHE 103 H PHE 103 -1.833 2.682 -6.466 801 HA PHE 103 HA PHE 103 -1.581 4.737 -4.523 802 HB2 PHE 103 HB3 PHE 103 0.369 3.470 -6.443 803 HB3 PHE 103 HB2 PHE 103 0.843 4.760 -5.344 804 HD1 PHE 103 HD2 PHE 103 -0.419 4.167 -2.865 805 HD2 PHE 103 HD1 PHE 103 1.232 1.475 -5.718 806 HE1 PHE 103 HE2 PHE 103 -0.046 2.512 -1.082 807 HE2 PHE 103 HE1 PHE 103 1.607 -0.185 -3.941 808 HZ PHE 103 HZ PHE 103 0.969 0.333 -1.620 809 H THR 104 H THR 104 -1.408 4.670 -8.052 810 HA THR 104 HA THR 104 -0.521 7.259 -8.520 811 HB THR 104 HB THR 104 -2.538 5.762 -10.196 812 HG1 THR 104 HG1 THR 104 -1.001 4.457 -10.742 813 HG21 THR 104 HG21 THR 104 -2.139 7.175 -11.867 814 HG22 THR 104 HG22 THR 104 -0.412 7.253 -11.516 815 HG23 THR 104 HG23 THR 104 -1.542 8.262 -10.612 816 H ALA 105 H ALA 105 -3.914 6.129 -8.439 817 HA ALA 105 HA ALA 105 -5.157 8.562 -8.828 818 HB1 ALA 105 HB1 ALA 105 -6.934 7.431 -7.187 819 HB2 ALA 105 HB2 ALA 105 -5.935 6.020 -7.533 820 HB3 ALA 105 HB3 ALA 105 -6.700 6.904 -8.854 821 H PHE 106 H PHE 106 -4.542 7.095 -5.603 822 HA PHE 106 HA PHE 106 -5.242 9.496 -4.265 823 HB2 PHE 106 HB3 PHE 106 -3.842 6.986 -3.338 824 HB3 PHE 106 HB2 PHE 106 -4.273 8.312 -2.263 825 HD1 PHE 106 HD2 PHE 106 -5.713 5.845 -4.632 826 HD2 PHE 106 HD1 PHE 106 -6.403 8.439 -1.330 827 HE1 PHE 106 HE2 PHE 106 -7.956 4.876 -4.346 828 HE2 PHE 106 HE1 PHE 106 -8.648 7.473 -1.037 829 HZ PHE 106 HZ PHE 106 -9.427 5.689 -2.547 830 H LYS 107 H LYS 107 -2.409 8.541 -5.894 831 HA LYS 107 HA LYS 107 -0.309 9.496 -4.438 832 HB2 LYS 107 HB3 LYS 107 0.890 9.507 -6.381 833 HB3 LYS 107 HB2 LYS 107 -0.514 8.615 -6.941 834 HG2 LYS 107 HG3 LYS 107 -1.444 10.808 -7.758 835 HG3 LYS 107 HG2 LYS 107 0.136 11.511 -7.409 836 HD2 LYS 107 HD3 LYS 107 0.805 9.285 -8.849 837 HD3 LYS 107 HD2 LYS 107 -0.710 9.774 -9.610 838 HE2 LYS 107 HE3 LYS 107 0.279 12.114 -9.716 839 HE3 LYS 107 HE2 LYS 107 1.821 11.367 -9.301 840 HZ1 LYS 107 HZ1 LYS 107 0.170 10.582 -11.640 841 HZ2 LYS 107 HZ2 LYS 107 1.735 10.053 -11.277 842 HZ3 LYS 107 HZ3 LYS 107 1.469 11.664 -11.716 843 H ASP 108 H ASP 108 -2.726 11.373 -6.150 844 HA ASP 108 HA ASP 108 -1.434 13.890 -5.481 845 HB2 ASP 108 HB3 ASP 108 -2.683 13.398 -7.675 846 HB3 ASP 108 HB2 ASP 108 -4.158 13.579 -6.730 847 H ASP 109 H ASP 109 -4.291 12.019 -4.601 848 HA ASP 109 HA ASP 109 -5.185 14.033 -2.712 849 HB2 ASP 109 HB3 ASP 109 -6.277 11.549 -3.869 850 HB3 ASP 109 HB2 ASP 109 -6.768 11.884 -2.211 851 H VAL 110 H VAL 110 -2.672 12.076 -2.487 852 HA VAL 110 HA VAL 110 -3.221 10.830 0.066 853 HB VAL 110 HB VAL 110 -1.812 9.695 -1.602 854 HG11 VAL 110 HG11 VAL 110 0.559 11.331 -1.052 855 HG12 VAL 110 HG12 VAL 110 -0.671 12.117 -2.042 856 HG13 VAL 110 HG13 VAL 110 0.020 10.577 -2.552 857 HG21 VAL 110 HG21 VAL 110 -1.594 9.321 0.882 858 HG22 VAL 110 HG22 VAL 110 -0.174 10.366 0.831 859 HG23 VAL 110 HG23 VAL 110 -0.193 8.859 -0.086 860 H ASP 111 H ASP 111 -1.854 11.158 1.945 861 HA ASP 111 HA ASP 111 -0.813 13.905 2.152 862 HB2 ASP 111 HB3 ASP 111 -2.998 12.742 3.560 863 HB3 ASP 111 HB2 ASP 111 -1.692 12.994 4.713 864 H THR 112 H THR 112 -0.654 10.597 3.427 865 HA THR 112 HA THR 112 2.079 11.182 4.345 866 HB THR 112 HB THR 112 0.176 9.086 5.402 867 HG1 THR 112 HG1 THR 112 0.071 10.402 7.206 868 HG21 THR 112 HG21 THR 112 2.407 8.275 5.682 869 HG22 THR 112 HG22 THR 112 1.825 8.860 7.240 870 HG23 THR 112 HG23 THR 112 2.952 9.836 6.297 871 H LEU 113 H LEU 113 3.636 9.406 4.188 872 HA LEU 113 HA LEU 113 2.978 7.341 2.239 873 HB2 LEU 113 HB3 LEU 113 3.875 9.404 1.072 874 HB3 LEU 113 HB2 LEU 113 5.395 9.093 1.888 875 HG LEU 113 HG LEU 113 5.075 6.700 0.764 876 HD11 LEU 113 HD11 LEU 113 2.869 7.762 -0.235 877 HD12 LEU 113 HD12 LEU 113 3.856 6.631 -1.161 878 HD13 LEU 113 HD13 LEU 113 4.000 8.366 -1.446 879 HD21 LEU 113 HD21 LEU 113 6.885 7.311 -0.399 880 HD22 LEU 113 HD22 LEU 113 6.706 8.866 0.413 881 HD23 LEU 113 HD23 LEU 113 6.037 8.633 -1.202 882 H LEU 114 H LEU 114 3.958 5.466 2.629 883 HA LEU 114 HA LEU 114 6.318 5.390 4.370 884 HB2 LEU 114 HB3 LEU 114 3.909 3.592 4.675 885 HB3 LEU 114 HB2 LEU 114 5.384 3.508 5.618 886 HG LEU 114 HG LEU 114 3.857 6.065 5.647 887 HD11 LEU 114 HD11 LEU 114 2.515 5.152 7.561 888 HD12 LEU 114 HD12 LEU 114 3.015 3.540 7.051 889 HD13 LEU 114 HD13 LEU 114 2.057 4.550 5.968 890 HD21 LEU 114 HD21 LEU 114 4.638 6.010 8.012 891 HD22 LEU 114 HD22 LEU 114 5.941 5.993 6.824 892 HD23 LEU 114 HD23 LEU 114 5.480 4.504 7.649 893 H VAL 115 H VAL 115 7.854 4.499 3.130 894 HA VAL 115 HA VAL 115 7.119 2.137 1.535 895 HB VAL 115 HB VAL 115 8.716 2.872 -0.203 896 HG11 VAL 115 HG11 VAL 115 6.235 3.335 -0.259 897 HG12 VAL 115 HG12 VAL 115 7.235 4.377 -1.273 898 HG13 VAL 115 HG13 VAL 115 6.618 4.974 0.268 899 HG21 VAL 115 HG21 VAL 115 9.888 4.818 -0.141 900 HG22 VAL 115 HG22 VAL 115 9.786 4.515 1.593 901 HG23 VAL 115 HG23 VAL 115 8.672 5.649 0.829 902 H THR 116 H THR 116 8.557 0.502 1.398 903 HA THR 116 HA THR 116 10.936 0.684 3.123 904 HB THR 116 HB THR 116 9.167 -1.640 2.353 905 HG1 THR 116 HG1 THR 116 8.875 -1.781 4.554 906 HG21 THR 116 HG21 THR 116 11.349 -2.566 2.203 907 HG22 THR 116 HG22 THR 116 10.661 -3.054 3.752 908 HG23 THR 116 HG23 THR 116 11.856 -1.759 3.687 909 H ARG 117 H ARG 117 12.512 1.343 1.724 910 HA ARG 117 HA ARG 117 12.686 0.294 -0.946 911 HB2 ARG 117 HB3 ARG 117 13.949 2.418 0.604 912 HB3 ARG 117 HB2 ARG 117 15.090 1.573 -0.433 913 HG2 ARG 117 HG3 ARG 117 14.382 3.183 -1.870 914 HG3 ARG 117 HG2 ARG 117 13.192 1.931 -2.229 915 HD2 ARG 117 HD3 ARG 117 11.503 3.028 -1.102 916 HD3 ARG 117 HD2 ARG 117 12.626 3.924 -0.080 917 HE ARG 117 HE ARG 117 11.552 4.781 -2.546 918 HH11 ARG 117 HH11 ARG 117 14.519 4.819 -0.710 919 HH12 ARG 117 HH12 ARG 117 15.097 6.280 -1.437 920 HH21 ARG 117 HH21 ARG 117 12.309 6.702 -3.504 921 HH22 ARG 117 HH22 ARG 117 13.842 7.350 -3.024 922 H LEU 118 H LEU 118 13.263 -1.756 -1.189 923 HA LEU 118 HA LEU 118 15.040 -3.136 0.561 924 HB2 LEU 118 HB3 LEU 118 13.219 -3.798 -1.494 925 HB3 LEU 118 HB2 LEU 118 14.777 -4.425 -1.996 926 HG LEU 118 HG LEU 118 14.832 -5.407 0.439 927 HD11 LEU 118 HD11 LEU 118 12.265 -6.147 0.723 928 HD12 LEU 118 HD12 LEU 118 12.043 -4.519 0.084 929 HD13 LEU 118 HD13 LEU 118 12.979 -4.768 1.557 930 HD21 LEU 118 HD21 LEU 118 12.965 -6.705 -1.517 931 HD22 LEU 118 HD22 LEU 118 14.127 -7.460 -0.427 932 HD23 LEU 118 HD23 LEU 118 14.693 -6.568 -1.838 933 H ALA 119 H ALA 119 17.110 -3.999 0.047 934 HA ALA 119 HA ALA 119 18.784 -2.158 -1.373 935 HB1 ALA 119 HB1 ALA 119 19.164 -3.991 0.666 936 HB2 ALA 119 HB2 ALA 119 20.414 -3.040 -0.135 937 HB3 ALA 119 HB3 ALA 119 20.055 -4.675 -0.695 938 H GLY 120 H GLY 120 17.971 -5.597 -1.807 939 HA2 GLY 120 HA3 GLY 120 19.396 -6.000 -4.177 940 HA3 GLY 120 HA2 GLY 120 18.001 -6.937 -3.665 941 H SER 121 H SER 121 18.735 -6.163 -6.338 942 HA SER 121 HA SER 121 16.566 -4.306 -7.040 943 HB2 SER 121 HB3 SER 121 19.241 -4.784 -8.111 944 HB3 SER 121 HB2 SER 121 18.002 -4.790 -9.365 945 HG SER 121 HG SER 121 19.045 -2.706 -8.034 946 H PHE 122 H PHE 122 14.744 -5.165 -7.775 947 HA PHE 122 HA PHE 122 14.859 -7.822 -9.046 948 HB2 PHE 122 HB3 PHE 122 12.593 -6.578 -7.475 949 HB3 PHE 122 HB2 PHE 122 12.546 -8.156 -8.254 950 HD1 PHE 122 HD2 PHE 122 14.360 -6.203 -5.670 951 HD2 PHE 122 HD1 PHE 122 13.263 -10.052 -7.117 952 HE1 PHE 122 HE2 PHE 122 15.285 -7.228 -3.634 953 HE2 PHE 122 HE1 PHE 122 14.186 -11.084 -5.083 954 HZ PHE 122 HZ PHE 122 15.199 -9.672 -3.338 955 H GLU 123 H GLU 123 13.102 -8.249 -10.618 956 HA GLU 123 HA GLU 123 12.205 -5.831 -12.025 957 HB2 GLU 123 HB3 GLU 123 12.810 -6.785 -14.172 958 HB3 GLU 123 HB2 GLU 123 14.232 -6.699 -13.141 959 HG2 GLU 123 HG3 GLU 123 13.224 -9.211 -12.631 960 HG3 GLU 123 HG2 GLU 123 12.944 -8.996 -14.358 961 H GLY 124 H GLY 124 10.161 -5.915 -12.802 962 HA2 GLY 124 HA3 GLY 124 8.819 -8.447 -13.216 963 HA3 GLY 124 HA2 GLY 124 8.227 -7.530 -11.839 964 H ASP 125 H ASP 125 6.204 -7.107 -12.655 965 HA ASP 125 HA ASP 125 6.141 -5.263 -14.948 966 HB2 ASP 125 HB3 ASP 125 4.232 -7.525 -14.341 967 HB3 ASP 125 HB2 ASP 125 3.895 -6.256 -15.513 968 H THR 126 H THR 126 6.157 -4.851 -11.989 969 HA THR 126 HA THR 126 3.886 -3.036 -11.917 970 HB THR 126 HB THR 126 4.264 -4.616 -9.433 971 HG1 THR 126 HG1 THR 126 2.872 -6.245 -10.251 972 HG21 THR 126 HG21 THR 126 1.860 -4.417 -9.265 973 HG22 THR 126 HG22 THR 126 1.791 -3.675 -10.863 974 HG23 THR 126 HG23 THR 126 2.594 -2.836 -9.536 975 H LYS 127 H LYS 127 4.984 -1.194 -11.693 976 HA LYS 127 HA LYS 127 6.938 -1.006 -9.492 977 HB2 LYS 127 HB3 LYS 127 6.994 0.184 -12.252 978 HB3 LYS 127 HB2 LYS 127 7.888 0.927 -10.932 979 HG2 LYS 127 HG3 LYS 127 9.389 -0.791 -10.794 980 HG3 LYS 127 HG2 LYS 127 8.253 -1.981 -11.432 981 HD2 LYS 127 HD3 LYS 127 9.422 -1.779 -13.337 982 HD3 LYS 127 HD2 LYS 127 8.524 -0.274 -13.546 983 HE2 LYS 127 HE3 LYS 127 10.614 0.457 -11.905 984 HE3 LYS 127 HE2 LYS 127 11.353 -0.707 -13.003 985 HZ1 LYS 127 HZ1 LYS 127 10.089 1.878 -13.622 986 HZ2 LYS 127 HZ2 LYS 127 10.151 0.670 -14.804 987 HZ3 LYS 127 HZ3 LYS 127 11.583 1.268 -14.133 988 H MET 128 H MET 128 7.190 1.268 -8.666 989 HA MET 128 HA MET 128 4.639 2.279 -7.918 990 HB2 MET 128 HB3 MET 128 6.708 2.333 -6.493 991 HB3 MET 128 HB2 MET 128 7.323 3.611 -7.533 992 HG2 MET 128 HG3 MET 128 6.324 4.455 -5.453 993 HG3 MET 128 HG2 MET 128 5.524 5.068 -6.898 994 HE1 MET 128 HE1 MET 128 4.327 5.685 -4.554 995 HE2 MET 128 HE2 MET 128 2.931 4.777 -3.977 996 HE3 MET 128 HE3 MET 128 2.860 5.610 -5.530 997 H ILE 129 H ILE 129 4.061 4.612 -8.104 998 HA ILE 129 HA ILE 129 4.578 5.545 -10.844 999 HB ILE 129 HB ILE 129 2.462 6.918 -10.462 1000 HG12 ILE 129 HG13 ILE 129 0.890 5.904 -8.787 1001 HG13 ILE 129 HG12 ILE 129 2.245 4.992 -8.138 1002 HG21 ILE 129 HG21 ILE 129 1.408 4.242 -10.372 1003 HG22 ILE 129 HG22 ILE 129 2.869 4.303 -11.360 1004 HG23 ILE 129 HG23 ILE 129 1.509 5.364 -11.729 1005 HD11 ILE 129 HD11 ILE 129 2.577 7.919 -8.349 1006 HD12 ILE 129 HD12 ILE 129 3.139 6.795 -7.112 1007 HD13 ILE 129 HD13 ILE 129 1.454 7.315 -7.131 1008 HA PRO 130 HA PRO 130 6.591 9.271 -9.647 1009 HB2 PRO 130 HB3 PRO 130 4.512 10.791 -11.136 1010 HB3 PRO 130 HB2 PRO 130 6.270 10.823 -11.309 1011 HG2 PRO 130 HG3 PRO 130 4.752 9.581 -13.109 1012 HG3 PRO 130 HG2 PRO 130 6.310 8.900 -12.605 1013 HD2 PRO 130 HD3 PRO 130 3.542 8.082 -11.831 1014 HD3 PRO 130 HD2 PRO 130 4.974 7.076 -12.133 1015 H LEU 131 H LEU 131 6.496 10.882 -8.105 1016 HA LEU 131 HA LEU 131 3.884 11.609 -7.005 1017 HB2 LEU 131 HB3 LEU 131 5.892 11.129 -4.926 1018 HB3 LEU 131 HB2 LEU 131 4.186 10.735 -4.952 1019 HG LEU 131 HG LEU 131 5.801 9.022 -6.703 1020 HD11 LEU 131 HD11 LEU 131 6.143 8.345 -3.852 1021 HD12 LEU 131 HD12 LEU 131 7.152 9.649 -4.478 1022 HD13 LEU 131 HD13 LEU 131 7.207 8.054 -5.228 1023 HD21 LEU 131 HD21 LEU 131 4.456 7.296 -5.714 1024 HD22 LEU 131 HD22 LEU 131 3.418 8.669 -6.099 1025 HD23 LEU 131 HD23 LEU 131 3.924 8.386 -4.433 1026 H ASN 132 H ASN 132 3.856 13.567 -5.835 1027 HA ASN 132 HA ASN 132 5.905 15.434 -6.645 1028 HB2 ASN 132 HB3 ASN 132 3.163 15.596 -5.917 1029 HB3 ASN 132 HB2 ASN 132 4.061 16.590 -4.774 1030 HD21 ASN 132 HD21 ASN 132 4.731 18.539 -5.394 1031 HD22 ASN 132 HD22 ASN 132 4.624 19.163 -7.001 1032 H TRP 133 H TRP 133 7.640 14.414 -5.471 1033 HA TRP 133 HA TRP 133 7.732 14.006 -2.734 1034 HB2 TRP 133 HB3 TRP 133 9.974 14.746 -4.617 1035 HB3 TRP 133 HB2 TRP 133 10.199 14.125 -2.984 1036 HD1 TRP 133 HD1 TRP 133 8.931 13.023 -6.444 1037 HE1 TRP 133 HE1 TRP 133 8.996 10.452 -6.554 1038 HE3 TRP 133 HE3 TRP 133 10.202 12.033 -1.591 1039 HZ2 TRP 133 HZ2 TRP 133 9.521 8.292 -4.816 1040 HZ3 TRP 133 HZ3 TRP 133 10.466 9.687 -0.897 1041 HH2 TRP 133 HH2 TRP 133 10.131 7.856 -2.477 1042 H ASP 134 H ASP 134 8.400 17.006 -4.546 1043 HA ASP 134 HA ASP 134 9.528 18.475 -2.476 1044 HB2 ASP 134 HB3 ASP 134 7.740 19.450 -4.714 1045 HB3 ASP 134 HB2 ASP 134 8.787 20.467 -3.728 1046 H ASP 135 H ASP 135 6.117 18.018 -3.325 1047 HA ASP 135 HA ASP 135 5.140 19.773 -1.302 1048 HB2 ASP 135 HB3 ASP 135 3.991 18.906 -3.488 1049 HB3 ASP 135 HB2 ASP 135 3.479 17.567 -2.464 1050 H PHE 136 H PHE 136 6.622 16.838 -1.000 1051 HA PHE 136 HA PHE 136 5.185 16.271 1.507 1052 HB2 PHE 136 HB3 PHE 136 6.412 14.299 -0.429 1053 HB3 PHE 136 HB2 PHE 136 5.816 13.874 1.172 1054 HD1 PHE 136 HD1 PHE 136 3.326 14.883 1.590 1055 HD2 PHE 136 HD2 PHE 136 5.014 13.801 -2.163 1056 HE1 PHE 136 HE1 PHE 136 1.066 14.574 0.667 1057 HE2 PHE 136 HE2 PHE 136 2.757 13.489 -3.094 1058 HZ PHE 136 HZ PHE 136 0.779 13.876 -1.678 1059 H THR 137 H THR 137 6.365 16.128 3.299 1060 HA THR 137 HA THR 137 9.296 16.294 3.024 1061 HB THR 137 HB THR 137 7.498 17.364 5.207 1062 HG1 THR 137 HG1 THR 137 7.474 19.052 3.993 1063 HG21 THR 137 HG21 THR 137 9.528 16.785 6.278 1064 HG22 THR 137 HG22 THR 137 9.565 18.525 5.993 1065 HG23 THR 137 HG23 THR 137 10.489 17.441 4.952 1066 H LYS 138 H LYS 138 10.522 14.780 3.925 1067 HA LYS 138 HA LYS 138 9.474 12.382 4.871 1068 HB2 LYS 138 HB3 LYS 138 11.766 12.745 3.913 1069 HB3 LYS 138 HB2 LYS 138 12.237 13.434 5.462 1070 HG2 LYS 138 HG3 LYS 138 12.491 11.431 6.392 1071 HG3 LYS 138 HG2 LYS 138 10.962 10.841 5.743 1072 HD2 LYS 138 HD3 LYS 138 12.409 9.468 4.629 1073 HD3 LYS 138 HD2 LYS 138 12.335 10.811 3.487 1074 HE2 LYS 138 HE3 LYS 138 14.404 10.747 5.653 1075 HE3 LYS 138 HE2 LYS 138 14.644 9.854 4.152 1076 HZ1 LYS 138 HZ1 LYS 138 15.627 11.889 3.733 1077 HZ2 LYS 138 HZ2 LYS 138 14.438 12.768 4.554 1078 HZ3 LYS 138 HZ3 LYS 138 14.094 12.087 3.044 1079 H VAL 139 H VAL 139 8.539 11.889 6.714 1080 HA VAL 139 HA VAL 139 8.801 13.643 9.014 1081 HB VAL 139 HB VAL 139 7.229 11.109 9.142 1082 HG11 VAL 139 HG11 VAL 139 5.664 13.036 10.161 1083 HG12 VAL 139 HG12 VAL 139 7.248 13.770 10.415 1084 HG13 VAL 139 HG13 VAL 139 6.891 12.184 11.098 1085 HG21 VAL 139 HG21 VAL 139 5.301 12.570 8.159 1086 HG22 VAL 139 HG22 VAL 139 6.390 11.699 7.082 1087 HG23 VAL 139 HG23 VAL 139 6.620 13.425 7.360 1088 H SER 140 H SER 140 9.734 10.432 7.975 1089 HA SER 140 HA SER 140 11.678 10.279 10.101 1090 HB2 SER 140 HB3 SER 140 9.126 8.939 10.366 1091 HB3 SER 140 HB2 SER 140 10.445 7.769 10.339 1092 HG SER 140 HG SER 140 11.433 8.974 12.020 1093 H SER 141 H SER 141 13.101 8.396 9.877 1094 HA SER 141 HA SER 141 12.941 6.800 7.495 1095 HB2 SER 141 HB3 SER 141 15.084 7.634 6.528 1096 HB3 SER 141 HB2 SER 141 13.791 8.832 6.479 1097 HG SER 141 HG SER 141 16.189 8.938 7.735 1098 H ARG 142 H ARG 142 13.766 4.886 7.988 1099 HA ARG 142 HA ARG 142 16.084 4.733 9.775 1100 HB2 ARG 142 HB3 ARG 142 13.971 4.377 11.086 1101 HB3 ARG 142 HB2 ARG 142 13.655 2.963 10.089 1102 HG2 ARG 142 HG3 ARG 142 15.478 1.792 10.969 1103 HG3 ARG 142 HG2 ARG 142 16.203 3.254 11.640 1104 HD2 ARG 142 HD3 ARG 142 14.097 3.406 13.088 1105 HD3 ARG 142 HD2 ARG 142 13.799 1.736 12.605 1106 HE ARG 142 HE ARG 142 15.491 1.063 13.996 1107 HH11 ARG 142 HH11 ARG 142 15.691 4.518 13.553 1108 HH12 ARG 142 HH12 ARG 142 16.903 4.730 14.771 1109 HH21 ARG 142 HH21 ARG 142 17.086 1.339 15.598 1110 HH22 ARG 142 HH22 ARG 142 17.696 2.926 15.932 1111 H THR 143 H THR 143 17.514 3.122 9.295 1112 HA THR 143 HA THR 143 16.904 1.547 6.890 1113 HB THR 143 HB THR 143 19.599 2.227 8.082 1114 HG1 THR 143 HG1 THR 143 18.452 4.027 7.180 1115 HG21 THR 143 HG21 THR 143 19.292 0.142 6.551 1116 HG22 THR 143 HG22 THR 143 20.631 1.259 6.286 1117 HG23 THR 143 HG23 THR 143 19.193 1.349 5.269 1118 H VAL 144 H VAL 144 16.270 -0.449 7.331 1119 HA VAL 144 HA VAL 144 17.439 -1.847 9.640 1120 HB VAL 144 HB VAL 144 14.992 -2.650 8.062 1121 HG11 VAL 144 HG11 VAL 144 15.459 -4.568 9.154 1122 HG12 VAL 144 HG12 VAL 144 14.697 -3.736 10.509 1123 HG13 VAL 144 HG13 VAL 144 16.455 -3.763 10.366 1124 HG21 VAL 144 HG21 VAL 144 14.601 -0.487 9.100 1125 HG22 VAL 144 HG22 VAL 144 15.162 -1.110 10.651 1126 HG23 VAL 144 HG23 VAL 144 13.681 -1.741 9.931 1127 H GLU 145 H GLU 145 18.784 -3.518 9.327 1128 HA GLU 145 HA GLU 145 18.892 -4.711 6.638 1129 HB2 GLU 145 HB3 GLU 145 21.307 -4.941 6.870 1130 HB3 GLU 145 HB2 GLU 145 20.827 -3.257 7.015 1131 HG2 GLU 145 HG3 GLU 145 22.133 -3.240 8.806 1132 HG3 GLU 145 HG2 GLU 145 20.792 -4.056 9.611 1133 H ASP 146 H ASP 146 19.251 -6.899 6.479 1134 HA ASP 146 HA ASP 146 18.941 -8.405 8.991 1135 HB2 ASP 146 HB3 ASP 146 17.778 -8.690 6.289 1136 HB3 ASP 146 HB2 ASP 146 18.275 -10.195 7.056 1137 H THR 147 H THR 147 19.640 -10.901 8.282 1138 HA THR 147 HA THR 147 22.422 -10.891 8.383 1139 HB THR 147 HB THR 147 22.229 -13.309 8.037 1140 HG1 THR 147 HG1 THR 147 19.582 -12.663 7.311 1141 HG21 THR 147 HG21 THR 147 19.842 -13.014 9.657 1142 HG22 THR 147 HG22 THR 147 21.159 -11.948 10.148 1143 HG23 THR 147 HG23 THR 147 21.418 -13.690 10.068 1144 H ASN 148 H ASN 148 20.207 -11.455 5.676 1145 HA ASN 148 HA ASN 148 22.354 -11.863 3.802 1146 HB2 ASN 148 HB3 ASN 148 19.424 -12.031 3.775 1147 HB3 ASN 148 HB2 ASN 148 20.113 -11.419 2.274 1148 HD21 ASN 148 HD21 ASN 148 18.930 -14.075 3.448 1149 HD22 ASN 148 HD22 ASN 148 19.969 -15.270 2.756 1150 HA PRO 149 HA PRO 149 23.137 -7.593 2.873 1151 HB2 PRO 149 HB3 PRO 149 23.806 -8.516 0.146 1152 HB3 PRO 149 HB2 PRO 149 24.814 -7.675 1.327 1153 HG2 PRO 149 HG3 PRO 149 25.200 -10.261 0.763 1154 HG3 PRO 149 HG2 PRO 149 25.415 -9.627 2.403 1155 HD2 PRO 149 HD3 PRO 149 23.128 -11.176 1.258 1156 HD3 PRO 149 HD2 PRO 149 23.892 -11.305 2.856 1157 H ALA 150 H ALA 150 21.218 -9.604 0.742 1158 HA ALA 150 HA ALA 150 20.075 -7.351 -0.666 1159 HB1 ALA 150 HB1 ALA 150 20.261 -9.179 -2.062 1160 HB2 ALA 150 HB2 ALA 150 18.565 -9.257 -1.582 1161 HB3 ALA 150 HB3 ALA 150 19.748 -10.316 -0.815 1162 H LEU 151 H LEU 151 19.433 -8.999 2.246 1163 HA LEU 151 HA LEU 151 16.585 -8.476 2.232 1164 HB2 LEU 151 HB3 LEU 151 18.456 -9.623 4.291 1165 HB3 LEU 151 HB2 LEU 151 16.762 -9.318 4.621 1166 HG LEU 151 HG LEU 151 17.936 -11.296 2.678 1167 HD11 LEU 151 HD11 LEU 151 15.890 -11.790 4.810 1168 HD12 LEU 151 HD12 LEU 151 17.615 -11.774 5.180 1169 HD13 LEU 151 HD13 LEU 151 16.973 -12.936 4.020 1170 HD21 LEU 151 HD21 LEU 151 15.082 -10.359 2.928 1171 HD22 LEU 151 HD22 LEU 151 15.573 -11.834 2.095 1172 HD23 LEU 151 HD23 LEU 151 16.121 -10.264 1.506 1173 H THR 152 H THR 152 18.993 -6.403 2.427 1174 HA THR 152 HA THR 152 18.328 -4.992 4.843 1175 HB THR 152 HB THR 152 19.836 -3.698 2.611 1176 HG1 THR 152 HG1 THR 152 21.702 -4.863 3.300 1177 HG21 THR 152 HG21 THR 152 19.514 -3.228 5.378 1178 HG22 THR 152 HG22 THR 152 20.486 -2.330 4.213 1179 HG23 THR 152 HG23 THR 152 21.196 -3.680 5.098 1180 H HIS 153 H HIS 153 16.650 -3.678 5.093 1181 HA HIS 153 HA HIS 153 15.549 -2.340 2.707 1182 HB2 HIS 153 HB3 HIS 153 13.699 -2.731 4.969 1183 HB3 HIS 153 HB2 HIS 153 13.419 -2.898 3.242 1184 HD1 HIS 153 HD1 HIS 153 13.291 -4.850 6.135 1185 HD2 HIS 153 HD2 HIS 153 14.904 -5.471 2.358 1186 HE1 HIS 153 HE1 HIS 153 13.469 -7.345 5.882 1187 HE2 HIS 153 HE2 HIS 153 14.382 -7.699 3.561 1188 H THR 154 H THR 154 14.252 -0.361 3.265 1189 HA THR 154 HA THR 154 15.221 1.012 5.663 1190 HB THR 154 HB THR 154 15.340 2.224 2.895 1191 HG1 THR 154 HG1 THR 154 16.969 0.605 3.389 1192 HG21 THR 154 HG21 THR 154 16.648 3.999 3.990 1193 HG22 THR 154 HG22 THR 154 16.261 3.283 5.555 1194 HG23 THR 154 HG23 THR 154 14.973 3.934 4.541 1195 H TYR 155 H TYR 155 13.568 1.887 6.710 1196 HA TYR 155 HA TYR 155 11.024 2.247 5.330 1197 HB2 TYR 155 HB3 TYR 155 11.862 2.103 8.207 1198 HB3 TYR 155 HB2 TYR 155 10.311 2.820 7.783 1199 HD1 TYR 155 HD1 TYR 155 8.594 1.429 6.618 1200 HD2 TYR 155 HD2 TYR 155 12.175 -0.250 8.187 1201 HE1 TYR 155 HE1 TYR 155 7.579 -0.810 6.524 1202 HE2 TYR 155 HE2 TYR 155 11.171 -2.493 8.095 1203 HH TYR 155 HH TYR 155 8.295 -3.222 8.080 1204 H GLU 156 H GLU 156 10.053 4.188 4.973 1205 HA GLU 156 HA GLU 156 11.302 6.592 6.098 1206 HB2 GLU 156 HB3 GLU 156 10.660 6.201 3.170 1207 HB3 GLU 156 HB2 GLU 156 11.203 7.706 3.899 1208 HG2 GLU 156 HG3 GLU 156 13.161 6.023 4.700 1209 HG3 GLU 156 HG2 GLU 156 12.721 5.312 3.148 1210 H VAL 157 H VAL 157 9.923 8.219 6.593 1211 HA VAL 157 HA VAL 157 7.073 7.778 5.988 1212 HB VAL 157 HB VAL 157 8.003 9.485 8.277 1213 HG11 VAL 157 HG11 VAL 157 5.592 9.364 7.344 1214 HG12 VAL 157 HG12 VAL 157 5.834 9.250 9.087 1215 HG13 VAL 157 HG13 VAL 157 5.533 7.792 8.142 1216 HG21 VAL 157 HG21 VAL 157 7.676 7.473 9.741 1217 HG22 VAL 157 HG22 VAL 157 9.113 7.422 8.720 1218 HG23 VAL 157 HG23 VAL 157 7.683 6.489 8.278 1219 H TRP 158 H TRP 158 5.810 9.547 5.444 1220 HA TRP 158 HA TRP 158 7.125 12.115 4.992 1221 HB2 TRP 158 HB3 TRP 158 5.696 10.685 2.748 1222 HB3 TRP 158 HB2 TRP 158 6.446 12.274 2.666 1223 HD1 TRP 158 HD1 TRP 158 7.496 8.583 3.213 1224 HE1 TRP 158 HE1 TRP 158 9.875 8.291 2.273 1225 HE3 TRP 158 HE3 TRP 158 8.454 13.432 1.909 1226 HZ2 TRP 158 HZ2 TRP 158 11.891 9.904 1.131 1227 HZ3 TRP 158 HZ3 TRP 158 10.631 13.974 0.899 1228 HH2 TRP 158 HH2 TRP 158 12.313 12.246 0.519 1229 H GLN 159 H GLN 159 5.816 13.830 5.236 1230 HA GLN 159 HA GLN 159 2.913 13.399 5.265 1231 HB2 GLN 159 HB3 GLN 159 4.636 14.309 7.505 1232 HB3 GLN 159 HB2 GLN 159 3.119 15.170 7.279 1233 HG2 GLN 159 HG3 GLN 159 3.231 12.179 7.442 1234 HG3 GLN 159 HG2 GLN 159 3.133 13.193 8.881 1235 HE21 GLN 159 HE21 GLN 159 1.119 12.465 9.476 1236 HE22 GLN 159 HE22 GLN 159 -0.318 12.853 8.598 1237 H LYS 160 H LYS 160 1.903 14.858 4.039 1238 HA LYS 160 HA LYS 160 3.227 16.878 2.652 1239 HB2 LYS 160 HB3 LYS 160 0.894 15.730 2.275 1240 HB3 LYS 160 HB2 LYS 160 0.295 17.094 3.209 1241 HG2 LYS 160 HG3 LYS 160 2.034 18.160 1.274 1242 HG3 LYS 160 HG2 LYS 160 1.028 16.970 0.448 1243 HD2 LYS 160 HD3 LYS 160 -0.483 18.653 2.287 1244 HD3 LYS 160 HD2 LYS 160 0.328 19.577 1.021 1245 HE2 LYS 160 HE3 LYS 160 -0.733 17.428 -0.342 1246 HE3 LYS 160 HE2 LYS 160 -1.971 17.796 0.858 1247 HZ1 LYS 160 HZ1 LYS 160 -2.587 19.212 -0.788 1248 HZ2 LYS 160 HZ2 LYS 160 -1.016 19.413 -1.383 1249 HZ3 LYS 160 HZ3 LYS 160 -1.500 20.228 0.018 1250 H LYS 161 H LYS 161 3.563 19.008 2.978 1251 HA LYS 161 HA LYS 161 3.603 20.020 5.602 1252 HB2 LYS 161 HB3 LYS 161 3.768 21.504 2.973 1253 HB3 LYS 161 HB2 LYS 161 4.183 22.179 4.542 1254 HG2 LYS 161 HG3 LYS 161 6.080 20.844 4.752 1255 HG3 LYS 161 HG2 LYS 161 5.534 19.715 3.510 1256 HD2 LYS 161 HD3 LYS 161 6.315 20.994 1.822 1257 HD3 LYS 161 HD2 LYS 161 5.873 22.503 2.624 1258 HE2 LYS 161 HE3 LYS 161 8.054 20.994 3.897 1259 HE3 LYS 161 HE2 LYS 161 8.418 21.627 2.292 1260 HZ1 LYS 161 HZ1 LYS 161 8.813 23.063 4.419 1261 HZ2 LYS 161 HZ2 LYS 161 7.167 23.412 4.253 1262 HZ3 LYS 161 HZ3 LYS 161 8.238 23.776 2.996 1263 H ALA 162 H ALA 162 2.159 21.118 6.782 1264 HA ALA 162 HA ALA 162 0.218 22.109 7.434 1265 HB1 ALA 162 HB1 ALA 162 0.001 23.003 4.562 1266 HB2 ALA 162 HB2 ALA 162 0.941 23.828 5.807 1267 HB3 ALA 162 HB3 ALA 162 -0.813 23.711 5.958 1268 H51A NDP 170 H51A NDP 170 -4.933 -0.600 -9.725 1269 H52A NDP 170 H52A NDP 170 -5.304 -2.177 -9.025 1270 H4B NDP 170 H4B NDP 170 -6.809 -2.602 -11.033 1271 H3B NDP 170 H3B NDP 170 -6.106 0.267 -11.677 1272 HO3A NDP 170 HO3A NDP 170 -6.613 -2.127 -13.158 1273 H2B NDP 170 H2B NDP 170 -8.374 0.564 -12.397 1274 H1B NDP 170 H1B NDP 170 -9.531 -0.685 -10.234 1275 H8A NDP 170 H8A NDP 170 -6.329 1.164 -9.337 1276 H61A NDP 170 H61A NDP 170 -10.040 5.992 -8.141 1277 H62A NDP 170 H62A NDP 170 -8.396 5.398 -8.085 1278 H2A NDP 170 H2A NDP 170 -12.527 2.753 -9.999 1279 H51N NDP 170 H51N NDP 170 -1.248 -4.577 -7.118 1280 H52N NDP 170 H52N NDP 170 -0.418 -3.935 -8.545 1281 H4D NDP 170 H4D NDP 170 0.703 -6.166 -8.839 1282 H3D NDP 170 H3D NDP 170 -0.745 -6.867 -6.275 1283 HO3N NDP 170 HO3N NDP 170 -1.444 -8.406 -7.565 1284 H2D NDP 170 H2D NDP 170 1.200 -8.138 -5.660 1285 HO2N NDP 170 HO2N NDP 170 2.874 -7.769 -7.701 1286 H1D NDP 170 H1D NDP 170 3.030 -6.207 -6.403 1287 H2N NDP 170 H2N NDP 170 3.699 -5.609 -4.190 1288 H71N NDP 170 H71N NDP 170 5.681 -4.863 -1.750 1289 H72N NDP 170 H72N NDP 170 5.126 -5.586 -3.239 1290 H41N NDP 170 H41N NDP 170 0.862 -3.845 -2.020 1291 H42N NDP 170 H42N NDP 170 0.788 -5.555 -1.471 1292 H5N NDP 170 H5N NDP 170 -1.094 -5.023 -3.012 1293 H6N NDP 170 H6N NDP 170 -0.516 -5.789 -5.323 Start of MODEL 29 1 H1 THR 1 HT1 THR 1 -3.569 9.453 6.673 2 H2 THR 1 HT2 THR 1 -5.221 9.666 6.258 3 H3 THR 1 HT3 THR 1 -4.045 10.793 5.716 4 HA THR 1 HA THR 1 -4.517 8.036 4.853 5 HB THR 1 HB THR 1 -4.175 9.429 2.633 6 HG1 THR 1 HG1 THR 1 -4.921 11.571 2.934 7 HG21 THR 1 HG21 THR 1 -6.684 9.794 4.250 8 HG22 THR 1 HG22 THR 1 -6.292 8.362 3.298 9 HG23 THR 1 HG23 THR 1 -6.521 9.917 2.499 10 H ALA 2 H ALA 2 -2.749 6.808 4.828 11 HA ALA 2 HA ALA 2 -0.238 7.996 3.863 12 HB1 ALA 2 HB1 ALA 2 0.980 7.333 5.637 13 HB2 ALA 2 HB2 ALA 2 0.053 5.849 5.854 14 HB3 ALA 2 HB3 ALA 2 -0.572 7.378 6.471 15 H PHE 3 H PHE 3 1.163 6.573 2.754 16 HA PHE 3 HA PHE 3 -0.205 4.207 1.666 17 HB2 PHE 3 HB3 PHE 3 2.099 5.845 0.593 18 HB3 PHE 3 HB2 PHE 3 1.516 4.367 -0.156 19 HD1 PHE 3 HD1 PHE 3 -1.317 5.922 1.111 20 HD2 PHE 3 HD2 PHE 3 1.560 6.305 -2.002 21 HE1 PHE 3 HE1 PHE 3 -2.923 7.236 -0.209 22 HE2 PHE 3 HE2 PHE 3 -0.041 7.618 -3.325 23 HZ PHE 3 HZ PHE 3 -2.281 8.086 -2.430 24 H LEU 4 H LEU 4 0.575 2.203 2.021 25 HA LEU 4 HA LEU 4 3.298 1.955 3.105 26 HB2 LEU 4 HB3 LEU 4 1.780 1.727 4.962 27 HB3 LEU 4 HB2 LEU 4 0.799 0.575 4.075 28 HG LEU 4 HG LEU 4 2.624 -1.054 4.139 29 HD11 LEU 4 HD11 LEU 4 4.614 0.118 4.152 30 HD12 LEU 4 HD12 LEU 4 4.504 -0.445 5.820 31 HD13 LEU 4 HD13 LEU 4 4.078 1.219 5.421 32 HD21 LEU 4 HD21 LEU 4 2.465 -0.237 6.969 33 HD22 LEU 4 HD22 LEU 4 2.086 -1.782 6.207 34 HD23 LEU 4 HD23 LEU 4 0.929 -0.452 6.129 35 H TRP 5 H TRP 5 4.476 0.843 1.684 36 HA TRP 5 HA TRP 5 3.552 -1.725 0.765 37 HB2 TRP 5 HB3 TRP 5 3.435 -1.341 -1.539 38 HB3 TRP 5 HB2 TRP 5 2.608 0.050 -0.848 39 HD1 TRP 5 HD1 TRP 5 5.790 -0.916 -2.729 40 HE1 TRP 5 HE1 TRP 5 6.887 1.222 -3.650 41 HE3 TRP 5 HE3 TRP 5 2.846 2.565 -0.419 42 HZ2 TRP 5 HZ2 TRP 5 6.548 4.015 -3.428 43 HZ3 TRP 5 HZ3 TRP 5 3.299 4.950 -0.830 44 HH2 TRP 5 HH2 TRP 5 5.111 5.658 -2.302 45 H ALA 6 H ALA 6 5.207 -2.951 -0.355 46 HA ALA 6 HA ALA 6 7.890 -2.105 0.485 47 HB1 ALA 6 HB1 ALA 6 6.578 -4.742 0.071 48 HB2 ALA 6 HB2 ALA 6 7.620 -4.189 1.383 49 HB3 ALA 6 HB3 ALA 6 8.321 -4.627 -0.175 50 H GLN 7 H GLN 7 9.659 -2.171 -0.941 51 HA GLN 7 HA GLN 7 9.172 -2.770 -3.740 52 HB2 GLN 7 HB3 GLN 7 10.079 -0.517 -4.430 53 HB3 GLN 7 HB2 GLN 7 8.459 -0.503 -3.747 54 HG2 GLN 7 HG3 GLN 7 10.295 -0.153 -1.619 55 HG3 GLN 7 HG2 GLN 7 10.754 0.946 -2.920 56 HE21 GLN 7 HE21 GLN 7 8.162 -0.009 -0.760 57 HE22 GLN 7 HE22 GLN 7 7.273 1.469 -0.867 58 H ASP 8 H ASP 8 11.132 -2.758 -5.046 59 HA ASP 8 HA ASP 8 13.424 -3.571 -3.445 60 HB2 ASP 8 HB3 ASP 8 14.311 -4.527 -5.485 61 HB3 ASP 8 HB2 ASP 8 12.629 -5.010 -5.305 62 H ARG 9 H ARG 9 15.538 -3.062 -5.091 63 HA ARG 9 HA ARG 9 16.237 -0.452 -4.398 64 HB2 ARG 9 HB3 ARG 9 17.449 -2.662 -5.871 65 HB3 ARG 9 HB2 ARG 9 17.975 -1.084 -6.440 66 HG2 ARG 9 HG3 ARG 9 18.035 -1.867 -3.541 67 HG3 ARG 9 HG2 ARG 9 19.382 -2.154 -4.645 68 HD2 ARG 9 HD3 ARG 9 18.185 0.576 -4.432 69 HD3 ARG 9 HD2 ARG 9 19.314 0.016 -3.199 70 HE ARG 9 HE ARG 9 20.587 -0.498 -5.550 71 HH11 ARG 9 HH11 ARG 9 19.168 2.351 -4.119 72 HH12 ARG 9 HH12 ARG 9 20.266 3.441 -4.897 73 HH21 ARG 9 HH21 ARG 9 22.032 0.935 -6.575 74 HH22 ARG 9 HH22 ARG 9 21.891 2.638 -6.292 75 H ASP 10 H ASP 10 14.722 -1.655 -7.315 76 HA ASP 10 HA ASP 10 15.216 0.831 -8.737 77 HB2 ASP 10 HB3 ASP 10 15.093 -1.565 -9.753 78 HB3 ASP 10 HB2 ASP 10 13.350 -1.321 -9.689 79 H GLY 11 H GLY 11 12.627 -0.809 -7.081 80 HA2 GLY 11 HA3 GLY 11 11.086 0.895 -5.974 81 HA3 GLY 11 HA2 GLY 11 10.844 1.482 -7.613 82 H LEU 12 H LEU 12 11.233 -1.836 -7.692 83 HA LEU 12 HA LEU 12 8.750 -2.467 -8.680 84 HB2 LEU 12 HB3 LEU 12 10.990 -3.850 -8.358 85 HB3 LEU 12 HB2 LEU 12 10.141 -4.468 -6.957 86 HG LEU 12 HG LEU 12 8.375 -5.369 -8.359 87 HD11 LEU 12 HD11 LEU 12 7.914 -4.481 -10.338 88 HD12 LEU 12 HD12 LEU 12 9.450 -5.082 -10.961 89 HD13 LEU 12 HD13 LEU 12 9.357 -3.472 -10.247 90 HD21 LEU 12 HD21 LEU 12 10.182 -6.636 -9.994 91 HD22 LEU 12 HD22 LEU 12 9.774 -7.103 -8.343 92 HD23 LEU 12 HD23 LEU 12 11.182 -6.086 -8.649 93 H ILE 13 H ILE 13 7.313 -4.227 -7.496 94 HA ILE 13 HA ILE 13 6.903 -3.729 -4.701 95 HB ILE 13 HB ILE 13 4.612 -2.993 -4.815 96 HG12 ILE 13 HG13 ILE 13 4.608 -2.284 -7.672 97 HG13 ILE 13 HG12 ILE 13 4.543 -4.012 -7.362 98 HG21 ILE 13 HG21 ILE 13 6.311 -1.214 -6.553 99 HG22 ILE 13 HG22 ILE 13 6.422 -1.316 -4.796 100 HG23 ILE 13 HG23 ILE 13 4.942 -0.727 -5.554 101 HD11 ILE 13 HD11 ILE 13 2.642 -1.933 -6.319 102 HD12 ILE 13 HD12 ILE 13 2.597 -3.646 -5.900 103 HD13 ILE 13 HD13 ILE 13 2.318 -3.137 -7.565 104 H GLY 14 H GLY 14 5.949 -5.269 -7.696 105 HA2 GLY 14 HA3 GLY 14 5.539 -7.757 -6.270 106 HA3 GLY 14 HA2 GLY 14 4.115 -7.110 -7.068 107 H LYS 15 H LYS 15 4.664 -9.438 -7.939 108 HA LYS 15 HA LYS 15 5.953 -9.032 -10.545 109 HB2 LYS 15 HB3 LYS 15 6.886 -11.298 -10.450 110 HB3 LYS 15 HB2 LYS 15 7.511 -10.305 -9.140 111 HG2 LYS 15 HG3 LYS 15 6.634 -11.622 -7.568 112 HG3 LYS 15 HG2 LYS 15 5.103 -11.787 -8.426 113 HD2 LYS 15 HD3 LYS 15 6.815 -13.234 -10.001 114 HD3 LYS 15 HD2 LYS 15 7.435 -13.554 -8.379 115 HE2 LYS 15 HE3 LYS 15 4.803 -13.852 -7.931 116 HE3 LYS 15 HE2 LYS 15 4.870 -14.330 -9.626 117 HZ1 LYS 15 HZ1 LYS 15 6.152 -15.590 -7.295 118 HZ2 LYS 15 HZ2 LYS 15 6.823 -15.794 -8.834 119 HZ3 LYS 15 HZ3 LYS 15 5.239 -16.303 -8.529 120 H ASP 16 H ASP 16 3.443 -8.615 -10.607 121 HA ASP 16 HA ASP 16 1.505 -9.230 -11.640 122 HB2 ASP 16 HB3 ASP 16 2.705 -11.977 -12.038 123 HB3 ASP 16 HB2 ASP 16 1.371 -11.251 -12.928 124 H GLY 17 H GLY 17 2.070 -9.565 -8.800 125 HA2 GLY 17 HA3 GLY 17 -0.334 -10.831 -8.017 126 HA3 GLY 17 HA2 GLY 17 1.029 -11.891 -7.685 127 H HIS 18 H HIS 18 2.947 -10.548 -6.637 128 HA HIS 18 HA HIS 18 2.334 -8.362 -4.969 129 HB2 HIS 18 HB3 HIS 18 2.184 -9.425 -2.797 130 HB3 HIS 18 HB2 HIS 18 0.919 -10.069 -3.838 131 HD1 HIS 18 HD1 HIS 18 3.834 -11.059 -1.825 132 HD2 HIS 18 HD2 HIS 18 1.410 -12.758 -4.741 133 HE1 HIS 18 HE1 HIS 18 4.294 -13.529 -1.726 134 HE2 HIS 18 HE2 HIS 18 2.886 -14.525 -3.563 135 H LEU 19 H LEU 19 4.017 -8.708 -2.854 136 HA LEU 19 HA LEU 19 6.556 -8.408 -4.050 137 HB2 LEU 19 HB3 LEU 19 7.391 -8.401 -1.691 138 HB3 LEU 19 HB2 LEU 19 6.140 -7.226 -2.044 139 HG LEU 19 HG LEU 19 4.618 -9.255 -1.112 140 HD11 LEU 19 HD11 LEU 19 5.649 -10.676 0.272 141 HD12 LEU 19 HD12 LEU 19 6.701 -9.423 0.930 142 HD13 LEU 19 HD13 LEU 19 7.119 -10.217 -0.588 143 HD21 LEU 19 HD21 LEU 19 4.720 -6.845 -0.412 144 HD22 LEU 19 HD22 LEU 19 6.015 -7.297 0.697 145 HD23 LEU 19 HD23 LEU 19 4.406 -7.993 0.891 146 HA PRO 20 HA PRO 20 7.495 -12.807 -3.993 147 HB2 PRO 20 HB3 PRO 20 9.399 -12.776 -5.857 148 HB3 PRO 20 HB2 PRO 20 7.703 -12.519 -6.277 149 HG2 PRO 20 HG3 PRO 20 9.921 -10.546 -6.049 150 HG3 PRO 20 HG2 PRO 20 8.545 -10.566 -7.163 151 HD2 PRO 20 HD3 PRO 20 8.757 -9.063 -4.792 152 HD3 PRO 20 HD2 PRO 20 7.283 -9.329 -5.742 153 H TRP 21 H TRP 21 8.713 -10.971 -1.981 154 HA TRP 21 HA TRP 21 11.287 -12.374 -1.740 155 HB2 TRP 21 HB3 TRP 21 12.080 -10.272 -0.492 156 HB3 TRP 21 HB2 TRP 21 11.996 -10.201 -2.247 157 HD1 TRP 21 HD1 TRP 21 9.657 -9.261 0.719 158 HE1 TRP 21 HE1 TRP 21 8.490 -7.047 0.119 159 HE3 TRP 21 HE3 TRP 21 11.604 -8.556 -3.955 160 HZ2 TRP 21 HZ2 TRP 21 8.403 -5.243 -2.052 161 HZ3 TRP 21 HZ3 TRP 21 10.928 -6.561 -5.227 162 HH2 TRP 21 HH2 TRP 21 9.359 -4.940 -4.293 163 H HIS 22 H HIS 22 11.941 -12.952 0.337 164 HA HIS 22 HA HIS 22 9.754 -13.358 2.183 165 HB2 HIS 22 HB3 HIS 22 11.738 -14.978 1.529 166 HB3 HIS 22 HB2 HIS 22 12.568 -14.131 2.829 167 HD1 HIS 22 HD1 HIS 22 11.114 -17.173 2.495 168 HD2 HIS 22 HD2 HIS 22 10.285 -14.036 5.091 169 HE1 HIS 22 HE1 HIS 22 9.928 -18.216 4.452 170 HE2 HIS 22 HE2 HIS 22 9.511 -16.311 6.048 171 H LEU 23 H LEU 23 9.317 -11.272 2.940 172 HA LEU 23 HA LEU 23 11.420 -10.064 4.607 173 HB2 LEU 23 HB3 LEU 23 9.593 -8.959 2.695 174 HB3 LEU 23 HB2 LEU 23 9.264 -8.262 4.270 175 HG LEU 23 HG LEU 23 11.784 -7.789 4.384 176 HD11 LEU 23 HD11 LEU 23 12.973 -7.637 2.324 177 HD12 LEU 23 HD12 LEU 23 11.541 -8.086 1.400 178 HD13 LEU 23 HD13 LEU 23 12.320 -9.271 2.449 179 HD21 LEU 23 HD21 LEU 23 9.672 -6.405 2.868 180 HD22 LEU 23 HD22 LEU 23 11.322 -5.863 2.557 181 HD23 LEU 23 HD23 LEU 23 10.678 -5.833 4.199 182 HA PRO 24 HA PRO 24 8.402 -11.800 7.640 183 HB2 PRO 24 HB3 PRO 24 10.272 -12.054 9.621 184 HB3 PRO 24 HB2 PRO 24 9.951 -13.298 8.408 185 HG2 PRO 24 HG3 PRO 24 12.123 -11.241 8.485 186 HG3 PRO 24 HG2 PRO 24 12.218 -12.954 8.035 187 HD2 PRO 24 HD3 PRO 24 12.143 -10.998 6.187 188 HD3 PRO 24 HD2 PRO 24 11.370 -12.574 5.917 189 H ASP 25 H ASP 25 10.978 -9.420 8.249 190 HA ASP 25 HA ASP 25 9.771 -8.211 10.477 191 HB2 ASP 25 HB3 ASP 25 11.310 -6.283 9.849 192 HB3 ASP 25 HB2 ASP 25 12.082 -7.829 10.161 193 H ASP 26 H ASP 26 9.254 -7.866 7.061 194 HA ASP 26 HA ASP 26 7.950 -5.322 7.200 195 HB2 ASP 26 HB3 ASP 26 9.070 -6.500 5.159 196 HB3 ASP 26 HB2 ASP 26 7.505 -7.284 4.975 197 H LEU 27 H LEU 27 6.711 -8.608 6.529 198 HA LEU 27 HA LEU 27 4.011 -7.981 6.626 199 HB2 LEU 27 HB3 LEU 27 3.760 -10.434 7.222 200 HB3 LEU 27 HB2 LEU 27 4.578 -10.059 5.724 201 HG LEU 27 HG LEU 27 6.677 -10.231 7.473 202 HD11 LEU 27 HD11 LEU 27 6.251 -12.425 8.649 203 HD12 LEU 27 HD12 LEU 27 4.535 -12.143 8.354 204 HD13 LEU 27 HD13 LEU 27 5.460 -11.006 9.335 205 HD21 LEU 27 HD21 LEU 27 5.397 -12.299 5.704 206 HD22 LEU 27 HD22 LEU 27 6.954 -12.544 6.494 207 HD23 LEU 27 HD23 LEU 27 6.752 -11.233 5.332 208 H HIS 28 H HIS 28 6.212 -8.975 9.218 209 HA HIS 28 HA HIS 28 4.336 -9.253 11.268 210 HB2 HIS 28 HB3 HIS 28 7.258 -8.824 11.103 211 HB3 HIS 28 HB2 HIS 28 6.506 -8.363 12.626 212 HD1 HIS 28 HD1 HIS 28 8.296 -11.035 11.465 213 HD2 HIS 28 HD2 HIS 28 4.531 -10.789 13.208 214 HE1 HIS 28 HE1 HIS 28 7.835 -13.325 12.396 215 HE2 HIS 28 HE2 HIS 28 5.591 -13.127 13.525 216 H TYR 29 H TYR 29 6.058 -6.403 10.093 217 HA TYR 29 HA TYR 29 4.853 -4.682 12.078 218 HB2 TYR 29 HB3 TYR 29 7.180 -4.369 11.118 219 HB3 TYR 29 HB2 TYR 29 6.406 -3.842 9.628 220 HD1 TYR 29 HD1 TYR 29 6.319 -3.104 13.293 221 HD2 TYR 29 HD2 TYR 29 6.070 -1.578 9.329 222 HE1 TYR 29 HE1 TYR 29 6.171 -0.818 14.188 223 HE2 TYR 29 HE2 TYR 29 5.922 0.711 10.213 224 HH TYR 29 HH TYR 29 5.374 1.375 13.516 225 H PHE 30 H PHE 30 4.203 -5.712 8.837 226 HA PHE 30 HA PHE 30 2.520 -3.544 8.083 227 HB2 PHE 30 HB3 PHE 30 3.652 -5.214 6.531 228 HB3 PHE 30 HB2 PHE 30 2.392 -6.355 6.991 229 HD1 PHE 30 HD1 PHE 30 -0.067 -5.401 6.753 230 HD2 PHE 30 HD2 PHE 30 3.334 -3.950 4.646 231 HE1 PHE 30 HE1 PHE 30 -1.544 -4.472 5.019 232 HE2 PHE 30 HE2 PHE 30 1.863 -3.017 2.908 233 HZ PHE 30 HZ PHE 30 -0.579 -3.277 3.093 234 H ARG 31 H ARG 31 1.803 -6.874 9.134 235 HA ARG 31 HA ARG 31 -1.001 -6.426 9.311 236 HB2 ARG 31 HB3 ARG 31 0.322 -8.654 9.066 237 HB3 ARG 31 HB2 ARG 31 0.419 -8.594 10.821 238 HG2 ARG 31 HG3 ARG 31 -2.231 -8.142 10.412 239 HG3 ARG 31 HG2 ARG 31 -1.843 -9.230 9.078 240 HD2 ARG 31 HD3 ARG 31 -2.565 -10.474 11.048 241 HD3 ARG 31 HD2 ARG 31 -0.883 -10.828 10.653 242 HE ARG 31 HE ARG 31 -0.673 -8.846 12.473 243 HH11 ARG 31 HH11 ARG 31 -2.403 -11.878 12.456 244 HH12 ARG 31 HH12 ARG 31 -2.298 -12.090 14.172 245 HH21 ARG 31 HH21 ARG 31 -0.531 -9.126 14.728 246 HH22 ARG 31 HH22 ARG 31 -1.236 -10.528 15.462 247 H ALA 32 H ALA 32 1.667 -5.985 11.492 248 HA ALA 32 HA ALA 32 0.120 -5.903 13.892 249 HB1 ALA 32 HB1 ALA 32 2.916 -5.026 13.224 250 HB2 ALA 32 HB2 ALA 32 2.403 -6.444 14.138 251 HB3 ALA 32 HB3 ALA 32 2.213 -4.833 14.830 252 H GLN 33 H GLN 33 1.025 -3.574 11.459 253 HA GLN 33 HA GLN 33 0.193 -1.319 13.088 254 HB2 GLN 33 HB3 GLN 33 1.694 -1.702 10.613 255 HB3 GLN 33 HB2 GLN 33 0.552 -0.369 10.513 256 HG2 GLN 33 HG3 GLN 33 2.111 -0.403 12.981 257 HG3 GLN 33 HG2 GLN 33 3.081 -0.222 11.520 258 HE21 GLN 33 HE21 GLN 33 2.929 1.633 10.323 259 HE22 GLN 33 HE22 GLN 33 2.071 3.035 10.854 260 H THR 34 H THR 34 -1.072 -3.346 10.554 261 HA THR 34 HA THR 34 -3.334 -1.577 10.081 262 HB THR 34 HB THR 34 -3.971 -3.147 8.347 263 HG1 THR 34 HG1 THR 34 -2.023 -4.777 9.559 264 HG21 THR 34 HG21 THR 34 -1.637 -3.386 7.164 265 HG22 THR 34 HG22 THR 34 -1.140 -2.274 8.439 266 HG23 THR 34 HG23 THR 34 -2.433 -1.821 7.328 267 H VAL 35 H VAL 35 -3.008 -2.792 12.721 268 HA VAL 35 HA VAL 35 -5.127 -4.785 12.850 269 HB VAL 35 HB VAL 35 -3.570 -3.602 15.150 270 HG11 VAL 35 HG11 VAL 35 -4.190 -5.917 16.104 271 HG12 VAL 35 HG12 VAL 35 -5.409 -5.946 14.829 272 HG13 VAL 35 HG13 VAL 35 -5.434 -4.668 16.044 273 HG21 VAL 35 HG21 VAL 35 -2.051 -4.614 13.504 274 HG22 VAL 35 HG22 VAL 35 -2.976 -6.114 13.587 275 HG23 VAL 35 HG23 VAL 35 -2.104 -5.536 15.007 276 H GLY 36 H GLY 36 -7.079 -3.842 12.558 277 HA2 GLY 36 HA3 GLY 36 -8.992 -2.870 13.520 278 HA3 GLY 36 HA2 GLY 36 -7.958 -1.994 14.638 279 H LYS 37 H LYS 37 -7.131 -1.944 11.283 280 HA LYS 37 HA LYS 37 -8.195 0.799 11.087 281 HB2 LYS 37 HB3 LYS 37 -5.715 -0.222 9.703 282 HB3 LYS 37 HB2 LYS 37 -6.274 1.442 9.810 283 HG2 LYS 37 HG3 LYS 37 -5.808 0.131 12.394 284 HG3 LYS 37 HG2 LYS 37 -4.371 0.350 11.393 285 HD2 LYS 37 HD3 LYS 37 -4.350 2.372 12.421 286 HD3 LYS 37 HD2 LYS 37 -5.461 2.776 11.111 287 HE2 LYS 37 HE3 LYS 37 -6.295 3.542 13.286 288 HE3 LYS 37 HE2 LYS 37 -7.362 2.343 12.556 289 HZ1 LYS 37 HZ1 LYS 37 -6.751 2.135 15.033 290 HZ2 LYS 37 HZ2 LYS 37 -5.285 1.506 14.471 291 HZ3 LYS 37 HZ3 LYS 37 -6.740 0.740 14.075 292 H ILE 38 H ILE 38 -7.747 1.330 8.465 293 HA ILE 38 HA ILE 38 -9.225 -0.776 7.032 294 HB ILE 38 HB ILE 38 -9.790 1.754 5.830 295 HG12 ILE 38 HG13 ILE 38 -10.921 1.711 8.604 296 HG13 ILE 38 HG12 ILE 38 -9.330 2.414 8.343 297 HG21 ILE 38 HG21 ILE 38 -11.032 -0.628 6.207 298 HG22 ILE 38 HG22 ILE 38 -11.817 0.828 5.599 299 HG23 ILE 38 HG23 ILE 38 -11.935 0.412 7.308 300 HD11 ILE 38 HD11 ILE 38 -10.431 3.831 6.545 301 HD12 ILE 38 HD12 ILE 38 -10.815 4.205 8.224 302 HD13 ILE 38 HD13 ILE 38 -11.965 3.302 7.238 303 H MET 39 H MET 39 -8.009 -1.585 5.474 304 HA MET 39 HA MET 39 -5.949 0.104 4.246 305 HB2 MET 39 HB3 MET 39 -5.155 -1.990 5.192 306 HB3 MET 39 HB2 MET 39 -6.317 -2.896 4.234 307 HG2 MET 39 HG3 MET 39 -5.160 -1.960 2.190 308 HG3 MET 39 HG2 MET 39 -3.895 -1.401 3.283 309 HE1 MET 39 HE1 MET 39 -5.917 -4.456 2.019 310 HE2 MET 39 HE2 MET 39 -5.936 -4.796 3.749 311 HE3 MET 39 HE3 MET 39 -5.016 -5.831 2.657 312 H VAL 40 H VAL 40 -6.126 0.814 2.227 313 HA VAL 40 HA VAL 40 -8.432 0.024 0.639 314 HB VAL 40 HB VAL 40 -6.333 2.089 -0.026 315 HG11 VAL 40 HG11 VAL 40 -8.845 1.186 -1.281 316 HG12 VAL 40 HG12 VAL 40 -7.401 1.892 -2.006 317 HG13 VAL 40 HG13 VAL 40 -8.590 2.930 -1.218 318 HG21 VAL 40 HG21 VAL 40 -7.975 2.220 2.141 319 HG22 VAL 40 HG22 VAL 40 -8.956 3.012 0.908 320 HG23 VAL 40 HG23 VAL 40 -7.341 3.619 1.274 321 H VAL 41 H VAL 41 -8.304 -1.567 -0.799 322 HA VAL 41 HA VAL 41 -5.694 -2.097 -2.058 323 HB VAL 41 HB VAL 41 -6.883 -3.830 -0.419 324 HG11 VAL 41 HG11 VAL 41 -8.135 -5.521 -1.595 325 HG12 VAL 41 HG12 VAL 41 -7.982 -4.631 -3.109 326 HG13 VAL 41 HG13 VAL 41 -8.936 -3.962 -1.786 327 HG21 VAL 41 HG21 VAL 41 -4.889 -4.634 -1.036 328 HG22 VAL 41 HG22 VAL 41 -5.067 -4.073 -2.698 329 HG23 VAL 41 HG23 VAL 41 -5.814 -5.590 -2.195 330 H GLY 42 H GLY 42 -5.611 -2.480 -4.252 331 HA2 GLY 42 HA3 GLY 42 -7.736 -1.348 -5.807 332 HA3 GLY 42 HA2 GLY 42 -6.242 -2.031 -6.429 333 H ARG 43 H ARG 43 -8.401 -2.509 -7.901 334 HA ARG 43 HA ARG 43 -9.968 -4.723 -7.206 335 HB2 ARG 43 HB3 ARG 43 -10.557 -3.227 -9.046 336 HB3 ARG 43 HB2 ARG 43 -9.147 -3.761 -9.949 337 HG2 ARG 43 HG3 ARG 43 -10.356 -6.130 -9.494 338 HG3 ARG 43 HG2 ARG 43 -11.756 -5.059 -9.569 339 HD2 ARG 43 HD3 ARG 43 -9.589 -5.224 -11.659 340 HD3 ARG 43 HD2 ARG 43 -11.152 -6.034 -11.758 341 HE ARG 43 HE ARG 43 -11.107 -3.128 -11.448 342 HH11 ARG 43 HH11 ARG 43 -11.673 -5.906 -13.497 343 HH12 ARG 43 HH12 ARG 43 -12.561 -5.005 -14.676 344 HH21 ARG 43 HH21 ARG 43 -12.268 -1.954 -13.006 345 HH22 ARG 43 HH22 ARG 43 -12.899 -2.764 -14.400 346 H ARG 44 H ARG 44 -7.229 -4.638 -9.490 347 HA ARG 44 HA ARG 44 -6.959 -7.376 -9.837 348 HB2 ARG 44 HB3 ARG 44 -4.913 -5.161 -9.942 349 HB3 ARG 44 HB2 ARG 44 -4.534 -6.823 -10.374 350 HG2 ARG 44 HG3 ARG 44 -6.683 -5.175 -11.687 351 HG3 ARG 44 HG2 ARG 44 -5.045 -5.371 -12.312 352 HD2 ARG 44 HD3 ARG 44 -6.013 -7.059 -13.466 353 HD3 ARG 44 HD2 ARG 44 -5.690 -7.945 -11.977 354 HE ARG 44 HE ARG 44 -8.251 -6.638 -12.019 355 HH11 ARG 44 HH11 ARG 44 -6.498 -9.528 -12.886 356 HH12 ARG 44 HH12 ARG 44 -7.908 -10.532 -12.893 357 HH21 ARG 44 HH21 ARG 44 -10.107 -7.956 -12.027 358 HH22 ARG 44 HH22 ARG 44 -9.958 -9.640 -12.406 359 H THR 45 H THR 45 -6.107 -5.402 -7.141 360 HA THR 45 HA THR 45 -4.162 -7.116 -5.991 361 HB THR 45 HB THR 45 -5.760 -5.443 -4.164 362 HG1 THR 45 HG1 THR 45 -4.470 -4.381 -6.437 363 HG21 THR 45 HG21 THR 45 -3.741 -6.138 -3.259 364 HG22 THR 45 HG22 THR 45 -3.419 -4.483 -3.776 365 HG23 THR 45 HG23 THR 45 -2.856 -5.838 -4.755 366 H TYR 46 H TYR 46 -7.611 -6.567 -5.118 367 HA TYR 46 HA TYR 46 -7.802 -8.455 -3.131 368 HB2 TYR 46 HB3 TYR 46 -10.184 -8.525 -3.494 369 HB3 TYR 46 HB2 TYR 46 -9.626 -6.879 -3.752 370 HD1 TYR 46 HD2 TYR 46 -10.144 -9.978 -5.810 371 HD2 TYR 46 HD1 TYR 46 -10.613 -5.758 -5.500 372 HE1 TYR 46 HE2 TYR 46 -11.242 -9.945 -7.997 373 HE2 TYR 46 HE1 TYR 46 -11.734 -5.724 -7.684 374 HH TYR 46 HH TYR 46 -12.622 -8.652 -9.354 375 H GLU 47 H GLU 47 -7.844 -8.963 -6.607 376 HA GLU 47 HA GLU 47 -8.399 -11.791 -6.327 377 HB2 GLU 47 HB3 GLU 47 -8.391 -9.857 -8.466 378 HB3 GLU 47 HB2 GLU 47 -7.444 -11.265 -8.926 379 HG2 GLU 47 HG3 GLU 47 -9.267 -12.710 -8.688 380 HG3 GLU 47 HG2 GLU 47 -10.192 -11.524 -7.769 381 H SER 48 H SER 48 -5.669 -9.680 -6.715 382 HA SER 48 HA SER 48 -3.859 -11.974 -7.007 383 HB2 SER 48 HB3 SER 48 -3.326 -9.012 -7.334 384 HB3 SER 48 HB2 SER 48 -2.142 -10.292 -7.585 385 HG SER 48 HG SER 48 -4.067 -9.383 -9.255 386 H PHE 49 H PHE 49 -5.188 -11.290 -4.475 387 HA PHE 49 HA PHE 49 -2.908 -10.422 -2.844 388 HB2 PHE 49 HB3 PHE 49 -5.567 -9.703 -2.722 389 HB3 PHE 49 HB2 PHE 49 -5.436 -10.905 -1.443 390 HD1 PHE 49 HD1 PHE 49 -3.012 -8.330 -2.630 391 HD2 PHE 49 HD2 PHE 49 -5.443 -9.767 0.556 392 HE1 PHE 49 HE1 PHE 49 -2.047 -6.634 -1.134 393 HE2 PHE 49 HE2 PHE 49 -4.482 -8.072 2.057 394 HZ PHE 49 HZ PHE 49 -2.782 -6.502 1.213 395 HA PRO 50 HA PRO 50 -2.326 -14.611 -1.507 396 HB2 PRO 50 HB3 PRO 50 -0.651 -14.203 0.544 397 HB3 PRO 50 HB2 PRO 50 -0.158 -13.901 -1.127 398 HG2 PRO 50 HG3 PRO 50 -1.040 -11.956 0.969 399 HG3 PRO 50 HG2 PRO 50 0.290 -11.820 -0.195 400 HD2 PRO 50 HD3 PRO 50 -2.170 -10.645 -0.528 401 HD3 PRO 50 HD2 PRO 50 -1.091 -11.086 -1.866 402 H LYS 51 H LYS 51 -3.731 -12.192 0.532 403 HA LYS 51 HA LYS 51 -5.187 -14.235 1.983 404 HB2 LYS 51 HB3 LYS 51 -2.890 -13.314 3.148 405 HB3 LYS 51 HB2 LYS 51 -4.087 -12.214 3.817 406 HG2 LYS 51 HG3 LYS 51 -4.109 -15.219 3.987 407 HG3 LYS 51 HG2 LYS 51 -3.784 -14.083 5.298 408 HD2 LYS 51 HD3 LYS 51 -6.047 -13.234 5.168 409 HD3 LYS 51 HD2 LYS 51 -6.383 -14.263 3.775 410 HE2 LYS 51 HE3 LYS 51 -6.014 -16.249 5.165 411 HE3 LYS 51 HE2 LYS 51 -5.697 -15.213 6.555 412 HZ1 LYS 51 HZ1 LYS 51 -8.251 -15.587 5.105 413 HZ2 LYS 51 HZ2 LYS 51 -7.997 -14.289 6.160 414 HZ3 LYS 51 HZ3 LYS 51 -7.924 -15.876 6.740 415 H ARG 52 H ARG 52 -6.879 -13.257 0.722 416 HA ARG 52 HA ARG 52 -7.805 -10.708 1.864 417 HB2 ARG 52 HB3 ARG 52 -9.084 -10.538 -0.399 418 HB3 ARG 52 HB2 ARG 52 -7.388 -10.089 -0.323 419 HG2 ARG 52 HG3 ARG 52 -7.246 -11.380 -2.152 420 HG3 ARG 52 HG2 ARG 52 -7.150 -12.690 -0.980 421 HD2 ARG 52 HD3 ARG 52 -9.757 -12.643 -1.150 422 HD3 ARG 52 HD2 ARG 52 -9.447 -11.829 -2.681 423 HE ARG 52 HE ARG 52 -7.947 -14.254 -2.359 424 HH11 ARG 52 HH11 ARG 52 -11.010 -12.914 -3.359 425 HH12 ARG 52 HH12 ARG 52 -11.394 -14.244 -4.399 426 HH21 ARG 52 HH21 ARG 52 -8.449 -16.003 -3.727 427 HH22 ARG 52 HH22 ARG 52 -9.940 -15.998 -4.608 428 HA PRO 53 HA PRO 53 -9.276 -9.671 2.540 429 HB2 PRO 53 HB3 PRO 53 -10.899 -9.372 4.655 430 HB3 PRO 53 HB2 PRO 53 -11.497 -9.243 2.997 431 HG2 PRO 53 HG3 PRO 53 -11.753 -11.486 4.940 432 HG3 PRO 53 HG2 PRO 53 -12.911 -10.907 3.729 433 HD2 PRO 53 HD3 PRO 53 -11.233 -13.115 3.447 434 HD3 PRO 53 HD2 PRO 53 -12.055 -12.268 2.124 435 H LEU 54 H LEU 54 -8.290 -8.733 4.484 436 HA LEU 54 HA LEU 54 -6.588 -10.637 5.794 437 HB2 LEU 54 HB3 LEU 54 -6.839 -7.649 5.880 438 HB3 LEU 54 HB2 LEU 54 -5.792 -8.500 7.000 439 HG LEU 54 HG LEU 54 -5.544 -8.782 4.011 440 HD11 LEU 54 HD11 LEU 54 -5.252 -6.417 4.767 441 HD12 LEU 54 HD12 LEU 54 -3.822 -7.137 4.028 442 HD13 LEU 54 HD13 LEU 54 -3.919 -6.969 5.781 443 HD21 LEU 54 HD21 LEU 54 -4.578 -10.517 5.589 444 HD22 LEU 54 HD22 LEU 54 -3.481 -9.253 6.145 445 HD23 LEU 54 HD23 LEU 54 -3.451 -9.767 4.459 446 HA PRO 55 HA PRO 55 -9.188 -11.204 9.353 447 HB2 PRO 55 HB3 PRO 55 -6.861 -12.239 10.775 448 HB3 PRO 55 HB2 PRO 55 -8.299 -13.096 10.217 449 HG2 PRO 55 HG3 PRO 55 -5.851 -13.462 9.113 450 HG3 PRO 55 HG2 PRO 55 -7.358 -13.628 8.193 451 HD2 PRO 55 HD3 PRO 55 -5.431 -11.336 8.281 452 HD3 PRO 55 HD2 PRO 55 -6.286 -12.040 6.892 453 H GLU 56 H GLU 56 -9.534 -10.418 11.425 454 HA GLU 56 HA GLU 56 -9.555 -8.798 13.018 455 HB2 GLU 56 HB3 GLU 56 -6.972 -10.094 13.050 456 HB3 GLU 56 HB2 GLU 56 -6.847 -8.441 13.635 457 HG2 GLU 56 HG3 GLU 56 -9.098 -9.413 14.902 458 HG3 GLU 56 HG2 GLU 56 -7.989 -10.783 14.900 459 H ARG 57 H ARG 57 -9.255 -7.846 10.231 460 HA ARG 57 HA ARG 57 -8.523 -5.131 10.918 461 HB2 ARG 57 HB3 ARG 57 -6.836 -4.791 9.345 462 HB3 ARG 57 HB2 ARG 57 -6.440 -6.353 10.037 463 HG2 ARG 57 HG3 ARG 57 -6.124 -6.734 7.797 464 HG3 ARG 57 HG2 ARG 57 -7.775 -7.304 8.027 465 HD2 ARG 57 HD3 ARG 57 -7.151 -5.722 6.022 466 HD3 ARG 57 HD2 ARG 57 -8.688 -5.554 6.865 467 HE ARG 57 HE ARG 57 -8.001 -3.510 7.645 468 HH11 ARG 57 HH11 ARG 57 -5.245 -5.217 6.355 469 HH12 ARG 57 HH12 ARG 57 -4.196 -3.842 6.443 470 HH21 ARG 57 HH21 ARG 57 -6.628 -1.703 7.761 471 HH22 ARG 57 HH22 ARG 57 -4.982 -1.845 7.241 472 H THR 58 H THR 58 -9.228 -3.556 9.338 473 HA THR 58 HA THR 58 -11.637 -4.457 7.971 474 HB THR 58 HB THR 58 -10.812 -1.600 7.922 475 HG1 THR 58 HG1 THR 58 -11.682 -2.918 10.276 476 HG21 THR 58 HG21 THR 58 -13.399 -2.083 9.008 477 HG22 THR 58 HG22 THR 58 -13.198 -3.032 7.535 478 HG23 THR 58 HG23 THR 58 -12.953 -1.286 7.499 479 H ASN 59 H ASN 59 -11.537 -5.027 5.906 480 HA ASN 59 HA ASN 59 -9.336 -4.016 4.264 481 HB2 ASN 59 HB3 ASN 59 -10.895 -5.905 2.809 482 HB3 ASN 59 HB2 ASN 59 -9.257 -6.082 3.424 483 HD21 ASN 59 HD21 ASN 59 -8.964 -6.994 5.512 484 HD22 ASN 59 HD22 ASN 59 -10.157 -8.047 6.184 485 H VAL 60 H VAL 60 -9.621 -3.022 2.300 486 HA VAL 60 HA VAL 60 -12.358 -2.191 1.615 487 HB VAL 60 HB VAL 60 -9.907 -0.427 1.703 488 HG11 VAL 60 HG11 VAL 60 -10.835 0.625 -0.044 489 HG12 VAL 60 HG12 VAL 60 -12.005 1.226 1.131 490 HG13 VAL 60 HG13 VAL 60 -12.381 -0.198 0.160 491 HG21 VAL 60 HG21 VAL 60 -10.644 -0.240 3.827 492 HG22 VAL 60 HG22 VAL 60 -12.271 -0.789 3.424 493 HG23 VAL 60 HG23 VAL 60 -11.798 0.878 3.099 494 H VAL 61 H VAL 61 -12.868 -2.563 -0.445 495 HA VAL 61 HA VAL 61 -10.699 -3.235 -2.311 496 HB VAL 61 HB VAL 61 -13.609 -4.042 -2.319 497 HG11 VAL 61 HG11 VAL 61 -12.194 -5.561 -4.203 498 HG12 VAL 61 HG12 VAL 61 -11.752 -3.881 -4.506 499 HG13 VAL 61 HG13 VAL 61 -13.449 -4.361 -4.511 500 HG21 VAL 61 HG21 VAL 61 -11.429 -6.029 -2.333 501 HG22 VAL 61 HG22 VAL 61 -12.976 -6.044 -1.487 502 HG23 VAL 61 HG23 VAL 61 -11.631 -5.100 -0.847 503 H LEU 62 H LEU 62 -10.424 -2.156 -4.161 504 HA LEU 62 HA LEU 62 -12.384 -0.067 -4.843 505 HB2 LEU 62 HB3 LEU 62 -10.067 0.634 -3.946 506 HB3 LEU 62 HB2 LEU 62 -9.457 0.100 -5.501 507 HG LEU 62 HG LEU 62 -11.121 1.717 -6.553 508 HD11 LEU 62 HD11 LEU 62 -11.644 2.165 -3.718 509 HD12 LEU 62 HD12 LEU 62 -12.622 2.561 -5.131 510 HD13 LEU 62 HD13 LEU 62 -11.328 3.646 -4.622 511 HD21 LEU 62 HD21 LEU 62 -9.050 3.066 -4.846 512 HD22 LEU 62 HD22 LEU 62 -9.588 3.492 -6.471 513 HD23 LEU 62 HD23 LEU 62 -8.617 2.042 -6.216 514 H THR 63 H THR 63 -13.511 -1.119 -6.418 515 HA THR 63 HA THR 63 -11.997 -1.866 -8.821 516 HB THR 63 HB THR 63 -12.641 -3.929 -7.714 517 HG1 THR 63 HG1 THR 63 -14.510 -3.621 -9.795 518 HG21 THR 63 HG21 THR 63 -15.419 -4.029 -7.973 519 HG22 THR 63 HG22 THR 63 -15.064 -2.526 -7.123 520 HG23 THR 63 HG23 THR 63 -14.469 -4.059 -6.488 521 H HIS 64 H HIS 64 -12.918 -1.274 -10.764 522 HA HIS 64 HA HIS 64 -14.779 0.862 -10.718 523 HB2 HIS 64 HB3 HIS 64 -13.792 -0.792 -13.049 524 HB3 HIS 64 HB2 HIS 64 -14.691 0.713 -13.188 525 HD1 HIS 64 HD1 HIS 64 -13.426 2.904 -12.684 526 HD2 HIS 64 HD2 HIS 64 -11.091 -0.517 -12.342 527 HE1 HIS 64 HE1 HIS 64 -11.050 3.719 -12.577 528 HE2 HIS 64 HE2 HIS 64 -9.651 1.628 -12.455 529 H GLN 65 H GLN 65 -15.104 -2.579 -11.248 530 HA GLN 65 HA GLN 65 -17.493 -2.805 -12.551 531 HB2 GLN 65 HB3 GLN 65 -16.192 -4.439 -10.414 532 HB3 GLN 65 HB2 GLN 65 -17.825 -4.845 -10.921 533 HG2 GLN 65 HG3 GLN 65 -17.164 -5.536 -12.988 534 HG3 GLN 65 HG2 GLN 65 -15.765 -4.464 -13.023 535 HE21 GLN 65 HE21 GLN 65 -13.977 -5.029 -11.561 536 HE22 GLN 65 HE22 GLN 65 -13.631 -6.701 -11.296 537 H GLU 66 H GLU 66 -19.577 -2.429 -12.145 538 HA GLU 66 HA GLU 66 -20.277 -1.015 -9.721 539 HB2 GLU 66 HB3 GLU 66 -22.480 -0.732 -10.801 540 HB3 GLU 66 HB2 GLU 66 -21.159 -0.199 -11.831 541 HG2 GLU 66 HG3 GLU 66 -21.305 -2.208 -13.144 542 HG3 GLU 66 HG2 GLU 66 -22.518 -2.875 -12.051 543 H ASP 67 H ASP 67 -20.891 -4.123 -11.222 544 HA ASP 67 HA ASP 67 -22.695 -4.904 -9.074 545 HB2 ASP 67 HB3 ASP 67 -22.171 -5.796 -11.805 546 HB3 ASP 67 HB2 ASP 67 -22.334 -7.133 -10.670 547 H TYR 68 H TYR 68 -19.650 -4.527 -8.796 548 HA TYR 68 HA TYR 68 -18.687 -7.179 -8.230 549 HB2 TYR 68 HB3 TYR 68 -17.198 -5.297 -8.936 550 HB3 TYR 68 HB2 TYR 68 -17.500 -4.530 -7.380 551 HD1 TYR 68 HD1 TYR 68 -15.959 -7.451 -9.031 552 HD2 TYR 68 HD2 TYR 68 -16.371 -5.255 -5.411 553 HE1 TYR 68 HE1 TYR 68 -14.107 -8.735 -8.048 554 HE2 TYR 68 HE2 TYR 68 -14.518 -6.532 -4.419 555 HH TYR 68 HH TYR 68 -13.279 -9.361 -5.815 556 H GLN 69 H GLN 69 -18.716 -8.253 -6.332 557 HA GLN 69 HA GLN 69 -19.715 -6.811 -3.965 558 HB2 GLN 69 HB3 GLN 69 -20.367 -9.678 -4.650 559 HB3 GLN 69 HB2 GLN 69 -21.028 -8.723 -3.330 560 HG2 GLN 69 HG3 GLN 69 -21.424 -8.024 -6.224 561 HG3 GLN 69 HG2 GLN 69 -22.532 -9.047 -5.312 562 HE21 GLN 69 HE21 GLN 69 -22.202 -6.063 -6.436 563 HE22 GLN 69 HE22 GLN 69 -23.049 -5.161 -5.229 564 H ALA 70 H ALA 70 -18.145 -6.701 -2.524 565 HA ALA 70 HA ALA 70 -16.325 -8.998 -2.222 566 HB1 ALA 70 HB1 ALA 70 -15.613 -6.453 -2.774 567 HB2 ALA 70 HB2 ALA 70 -14.584 -7.599 -1.914 568 HB3 ALA 70 HB3 ALA 70 -15.547 -6.429 -1.012 569 H GLN 71 H GLN 71 -17.399 -10.204 -0.717 570 HA GLN 71 HA GLN 71 -18.669 -9.094 1.576 571 HB2 GLN 71 HB3 GLN 71 -18.050 -11.835 0.588 572 HB3 GLN 71 HB2 GLN 71 -18.414 -11.644 2.298 573 HG2 GLN 71 HG3 GLN 71 -20.501 -12.048 1.507 574 HG3 GLN 71 HG2 GLN 71 -20.470 -10.292 1.358 575 HE21 GLN 71 HE21 GLN 71 -20.661 -9.382 -0.607 576 HE22 GLN 71 HE22 GLN 71 -20.815 -10.265 -2.084 577 H GLY 72 H GLY 72 -17.820 -8.517 3.463 578 HA2 GLY 72 HA3 GLY 72 -16.399 -8.933 5.347 579 HA3 GLY 72 HA2 GLY 72 -15.232 -9.665 4.257 580 H ALA 73 H ALA 73 -15.583 -7.398 2.312 581 HA ALA 73 HA ALA 73 -14.114 -5.341 3.830 582 HB1 ALA 73 HB1 ALA 73 -12.652 -6.711 2.355 583 HB2 ALA 73 HB2 ALA 73 -12.661 -4.993 1.954 584 HB3 ALA 73 HB3 ALA 73 -13.581 -6.133 0.971 585 H VAL 74 H VAL 74 -14.055 -3.204 2.593 586 HA VAL 74 HA VAL 74 -16.782 -2.494 1.930 587 HB VAL 74 HB VAL 74 -14.370 -0.680 1.895 588 HG11 VAL 74 HG11 VAL 74 -17.033 0.301 2.680 589 HG12 VAL 74 HG12 VAL 74 -16.864 -0.184 0.992 590 HG13 VAL 74 HG13 VAL 74 -15.798 1.048 1.667 591 HG21 VAL 74 HG21 VAL 74 -15.317 -2.071 4.110 592 HG22 VAL 74 HG22 VAL 74 -16.032 -0.466 4.255 593 HG23 VAL 74 HG23 VAL 74 -14.283 -0.643 4.121 594 H VAL 75 H VAL 75 -17.563 -1.955 -0.048 595 HA VAL 75 HA VAL 75 -15.710 -2.275 -2.314 596 HB VAL 75 HB VAL 75 -18.706 -2.639 -2.319 597 HG11 VAL 75 HG11 VAL 75 -16.683 -3.414 -4.415 598 HG12 VAL 75 HG12 VAL 75 -17.662 -1.949 -4.478 599 HG13 VAL 75 HG13 VAL 75 -18.439 -3.531 -4.525 600 HG21 VAL 75 HG21 VAL 75 -18.452 -4.850 -1.911 601 HG22 VAL 75 HG22 VAL 75 -16.993 -4.299 -1.087 602 HG23 VAL 75 HG23 VAL 75 -16.891 -4.932 -2.730 603 H VAL 76 H VAL 76 -15.463 -0.733 -3.785 604 HA VAL 76 HA VAL 76 -17.393 1.383 -4.147 605 HB VAL 76 HB VAL 76 -15.835 3.224 -3.750 606 HG11 VAL 76 HG11 VAL 76 -16.027 3.303 -1.417 607 HG12 VAL 76 HG12 VAL 76 -15.870 1.554 -1.256 608 HG13 VAL 76 HG13 VAL 76 -17.341 2.249 -1.937 609 HG21 VAL 76 HG21 VAL 76 -13.850 1.363 -3.944 610 HG22 VAL 76 HG22 VAL 76 -13.901 1.656 -2.206 611 HG23 VAL 76 HG23 VAL 76 -13.647 3.000 -3.321 612 H HIS 77 H HIS 77 -16.537 2.950 -5.908 613 HA HIS 77 HA HIS 77 -14.756 1.499 -7.744 614 HB2 HIS 77 HB3 HIS 77 -17.086 2.951 -8.904 615 HB3 HIS 77 HB2 HIS 77 -16.220 1.545 -9.514 616 HD1 HIS 77 HD1 HIS 77 -16.579 -0.554 -7.487 617 HD2 HIS 77 HD2 HIS 77 -19.600 2.171 -8.334 618 HE1 HIS 77 HE1 HIS 77 -18.709 -1.654 -6.727 619 HE2 HIS 77 HE2 HIS 77 -20.531 -0.017 -7.315 620 H ASP 78 H ASP 78 -15.568 4.471 -6.291 621 HA ASP 78 HA ASP 78 -13.680 5.823 -8.091 622 HB2 ASP 78 HB3 ASP 78 -16.441 6.690 -7.336 623 HB3 ASP 78 HB2 ASP 78 -15.204 7.914 -7.608 624 H VAL 79 H VAL 79 -12.750 7.809 -7.167 625 HA VAL 79 HA VAL 79 -11.713 7.361 -4.599 626 HB VAL 79 HB VAL 79 -10.994 9.837 -4.857 627 HG11 VAL 79 HG11 VAL 79 -9.239 9.148 -6.527 628 HG12 VAL 79 HG12 VAL 79 -10.094 7.611 -6.658 629 HG13 VAL 79 HG13 VAL 79 -9.403 8.107 -5.113 630 HG21 VAL 79 HG21 VAL 79 -12.794 9.791 -6.922 631 HG22 VAL 79 HG22 VAL 79 -11.247 9.601 -7.748 632 HG23 VAL 79 HG23 VAL 79 -11.521 10.990 -6.696 633 H ALA 80 H ALA 80 -14.339 9.364 -5.786 634 HA ALA 80 HA ALA 80 -14.765 10.787 -3.361 635 HB1 ALA 80 HB1 ALA 80 -15.783 11.942 -5.020 636 HB2 ALA 80 HB2 ALA 80 -17.166 10.951 -4.558 637 HB3 ALA 80 HB3 ALA 80 -16.173 10.489 -5.940 638 H ALA 81 H ALA 81 -16.159 7.864 -4.774 639 HA ALA 81 HA ALA 81 -18.203 7.382 -2.966 640 HB1 ALA 81 HB1 ALA 81 -16.425 5.362 -4.331 641 HB2 ALA 81 HB2 ALA 81 -17.905 6.061 -4.986 642 HB3 ALA 81 HB3 ALA 81 -17.977 5.011 -3.571 643 H VAL 82 H VAL 82 -14.960 5.875 -2.844 644 HA VAL 82 HA VAL 82 -15.133 4.717 -0.369 645 HB VAL 82 HB VAL 82 -13.232 4.663 -2.147 646 HG11 VAL 82 HG11 VAL 82 -11.812 6.507 -0.289 647 HG12 VAL 82 HG12 VAL 82 -12.788 7.185 -1.591 648 HG13 VAL 82 HG13 VAL 82 -11.453 6.097 -1.966 649 HG21 VAL 82 HG21 VAL 82 -13.437 3.383 0.041 650 HG22 VAL 82 HG22 VAL 82 -12.347 4.592 0.719 651 HG23 VAL 82 HG23 VAL 82 -11.815 3.580 -0.623 652 H PHE 83 H PHE 83 -14.479 8.103 -1.118 653 HA PHE 83 HA PHE 83 -13.544 8.886 1.403 654 HB2 PHE 83 HB3 PHE 83 -14.775 10.283 -0.920 655 HB3 PHE 83 HB2 PHE 83 -14.732 11.145 0.612 656 HD1 PHE 83 HD2 PHE 83 -12.167 10.252 1.730 657 HD2 PHE 83 HD1 PHE 83 -13.207 11.338 -2.252 658 HE1 PHE 83 HE2 PHE 83 -9.831 10.891 1.298 659 HE2 PHE 83 HE1 PHE 83 -10.872 11.978 -2.691 660 HZ PHE 83 HZ PHE 83 -9.181 11.755 -0.914 661 H ALA 84 H ALA 84 -16.835 8.590 0.141 662 HA ALA 84 HA ALA 84 -18.182 9.743 2.316 663 HB1 ALA 84 HB1 ALA 84 -19.417 9.329 0.325 664 HB2 ALA 84 HB2 ALA 84 -20.111 8.291 1.571 665 HB3 ALA 84 HB3 ALA 84 -19.024 7.610 0.359 666 H TYR 85 H TYR 85 -17.113 6.447 1.698 667 HA TYR 85 HA TYR 85 -18.199 5.242 3.985 668 HB2 TYR 85 HB3 TYR 85 -17.239 3.416 3.107 669 HB3 TYR 85 HB2 TYR 85 -16.509 4.438 1.881 670 HD1 TYR 85 HD1 TYR 85 -15.880 3.371 5.418 671 HD2 TYR 85 HD2 TYR 85 -14.238 4.307 1.611 672 HE1 TYR 85 HE1 TYR 85 -13.644 2.753 6.237 673 HE2 TYR 85 HE2 TYR 85 -11.997 3.695 2.417 674 HH TYR 85 HH TYR 85 -10.963 2.368 4.140 675 H ALA 86 H ALA 86 -14.842 6.393 3.522 676 HA ALA 86 HA ALA 86 -13.835 6.174 6.011 677 HB1 ALA 86 HB1 ALA 86 -12.759 8.547 5.419 678 HB2 ALA 86 HB2 ALA 86 -13.417 8.134 3.836 679 HB3 ALA 86 HB3 ALA 86 -12.272 7.050 4.624 680 H LYS 87 H LYS 87 -16.246 8.514 4.982 681 HA LYS 87 HA LYS 87 -16.103 10.224 7.233 682 HB2 LYS 87 HB3 LYS 87 -17.503 10.270 4.905 683 HB3 LYS 87 HB2 LYS 87 -18.766 9.770 6.022 684 HG2 LYS 87 HG3 LYS 87 -19.036 12.000 6.214 685 HG3 LYS 87 HG2 LYS 87 -17.762 11.807 7.420 686 HD2 LYS 87 HD3 LYS 87 -16.410 13.130 6.251 687 HD3 LYS 87 HD2 LYS 87 -16.574 12.094 4.833 688 HE2 LYS 87 HE3 LYS 87 -18.445 14.323 5.629 689 HE3 LYS 87 HE2 LYS 87 -17.243 14.393 4.341 690 HZ1 LYS 87 HZ1 LYS 87 -18.694 12.178 3.737 691 HZ2 LYS 87 HZ2 LYS 87 -18.886 13.701 3.028 692 HZ3 LYS 87 HZ3 LYS 87 -19.870 13.243 4.325 693 H GLN 88 H GLN 88 -18.106 7.428 6.469 694 HA GLN 88 HA GLN 88 -19.573 7.303 8.853 695 HB2 GLN 88 HB3 GLN 88 -19.426 5.802 6.524 696 HB3 GLN 88 HB2 GLN 88 -18.918 4.671 7.771 697 HG2 GLN 88 HG3 GLN 88 -20.962 4.590 8.728 698 HG3 GLN 88 HG2 GLN 88 -21.331 6.272 8.346 699 HE21 GLN 88 HE21 GLN 88 -21.179 6.472 5.725 700 HE22 GLN 88 HE22 GLN 88 -22.273 5.397 4.930 701 H HIS 89 H HIS 89 -16.314 6.427 8.125 702 HA HIS 89 HA HIS 89 -15.991 5.245 10.803 703 HB2 HIS 89 HB3 HIS 89 -14.782 4.652 8.157 704 HB3 HIS 89 HB2 HIS 89 -13.716 4.536 9.552 705 HD1 HIS 89 HD1 HIS 89 -15.583 3.265 11.602 706 HD2 HIS 89 HD2 HIS 89 -15.353 2.055 7.634 707 HE1 HIS 89 HE1 HIS 89 -16.424 0.895 11.573 708 HE2 HIS 89 HE2 HIS 89 -16.194 0.155 9.176 709 HA PRO 90 HA PRO 90 -13.843 9.329 10.911 710 HB2 PRO 90 HB3 PRO 90 -14.561 9.978 13.429 711 HB3 PRO 90 HB2 PRO 90 -15.626 10.236 12.041 712 HG2 PRO 90 HG3 PRO 90 -15.636 8.013 14.047 713 HG3 PRO 90 HG2 PRO 90 -17.004 8.924 13.381 714 HD2 PRO 90 HD3 PRO 90 -16.296 6.454 12.491 715 HD3 PRO 90 HD2 PRO 90 -17.057 7.675 11.451 716 H ASP 91 H ASP 91 -13.939 6.953 13.591 717 HA ASP 91 HA ASP 91 -11.384 7.789 14.582 718 HB2 ASP 91 HB3 ASP 91 -13.067 5.373 15.264 719 HB3 ASP 91 HB2 ASP 91 -11.637 5.896 16.149 720 H GLN 92 H GLN 92 -12.054 6.138 11.847 721 HA GLN 92 HA GLN 92 -9.843 4.237 12.155 722 HB2 GLN 92 HB3 GLN 92 -11.834 4.471 9.896 723 HB3 GLN 92 HB2 GLN 92 -10.657 3.185 10.120 724 HG2 GLN 92 HG3 GLN 92 -12.290 3.452 12.465 725 HG3 GLN 92 HG2 GLN 92 -13.299 3.271 11.031 726 HE21 GLN 92 HE21 GLN 92 -13.499 1.318 10.120 727 HE22 GLN 92 HE22 GLN 92 -12.650 -0.099 10.626 728 H GLU 93 H GLU 93 -8.281 4.040 10.398 729 HA GLU 93 HA GLU 93 -7.747 6.641 9.117 730 HB2 GLU 93 HB3 GLU 93 -6.052 4.849 10.695 731 HB3 GLU 93 HB2 GLU 93 -5.321 5.331 9.170 732 HG2 GLU 93 HG3 GLU 93 -6.529 7.382 10.972 733 HG3 GLU 93 HG2 GLU 93 -4.915 6.748 11.293 734 H LEU 94 H LEU 94 -6.770 6.619 7.032 735 HA LEU 94 HA LEU 94 -7.476 4.227 5.489 736 HB2 LEU 94 HB3 LEU 94 -7.369 7.130 4.913 737 HB3 LEU 94 HB2 LEU 94 -6.917 6.061 3.599 738 HG LEU 94 HG LEU 94 -9.204 4.873 4.286 739 HD11 LEU 94 HD11 LEU 94 -9.285 6.970 6.011 740 HD12 LEU 94 HD12 LEU 94 -10.699 6.106 5.410 741 HD13 LEU 94 HD13 LEU 94 -10.192 7.609 4.640 742 HD21 LEU 94 HD21 LEU 94 -8.321 6.295 2.169 743 HD22 LEU 94 HD22 LEU 94 -9.652 7.318 2.708 744 HD23 LEU 94 HD23 LEU 94 -9.949 5.628 2.299 745 H VAL 95 H VAL 95 -5.945 2.937 4.721 746 HA VAL 95 HA VAL 95 -3.258 4.031 4.251 747 HB VAL 95 HB VAL 95 -3.741 1.346 5.542 748 HG11 VAL 95 HG11 VAL 95 -1.377 2.798 4.542 749 HG12 VAL 95 HG12 VAL 95 -1.673 1.065 4.680 750 HG13 VAL 95 HG13 VAL 95 -1.190 1.993 6.100 751 HG21 VAL 95 HG21 VAL 95 -3.181 2.256 7.638 752 HG22 VAL 95 HG22 VAL 95 -4.362 3.372 6.952 753 HG23 VAL 95 HG23 VAL 95 -2.646 3.778 6.926 754 H ILE 96 H ILE 96 -2.587 3.616 2.254 755 HA ILE 96 HA ILE 96 -4.000 1.650 0.641 756 HB ILE 96 HB ILE 96 -1.731 3.346 -0.352 757 HG12 ILE 96 HG13 ILE 96 -3.196 4.914 0.773 758 HG13 ILE 96 HG12 ILE 96 -3.421 5.070 -0.966 759 HG21 ILE 96 HG21 ILE 96 -2.625 1.567 -1.791 760 HG22 ILE 96 HG22 ILE 96 -2.900 3.172 -2.468 761 HG23 ILE 96 HG23 ILE 96 -4.223 2.305 -1.690 762 HD11 ILE 96 HD11 ILE 96 -5.452 3.707 -0.806 763 HD12 ILE 96 HD12 ILE 96 -5.543 5.171 0.174 764 HD13 ILE 96 HD13 ILE 96 -5.233 3.613 0.941 765 H ALA 97 H ALA 97 -3.205 -0.270 0.021 766 HA ALA 97 HA ALA 97 -0.419 -0.891 0.756 767 HB1 ALA 97 HB1 ALA 97 -1.950 -2.165 2.098 768 HB2 ALA 97 HB2 ALA 97 -1.172 -3.249 0.944 769 HB3 ALA 97 HB3 ALA 97 -2.826 -2.703 0.665 770 H GLY 98 H GLY 98 -2.828 -0.988 -1.761 771 HA2 GLY 98 HA3 GLY 98 -1.113 -1.008 -3.895 772 HA3 GLY 98 HA2 GLY 98 -1.347 -2.708 -3.515 773 H GLY 99 H GLY 99 -3.833 -1.910 -6.087 774 HA2 GLY 99 HA3 GLY 99 -1.047 -2.504 -5.621 775 HA3 GLY 99 HA2 GLY 99 -1.867 -2.470 -7.172 776 H ALA 100 H ALA 100 -0.030 -1.384 -8.035 777 HA ALA 100 HA ALA 100 0.926 1.085 -7.065 778 HB1 ALA 100 HB1 ALA 100 1.134 0.585 -9.963 779 HB2 ALA 100 HB2 ALA 100 1.808 -0.657 -8.910 780 HB3 ALA 100 HB3 ALA 100 2.380 1.007 -8.789 781 H GLN 101 H GLN 101 -1.732 0.237 -9.165 782 HA GLN 101 HA GLN 101 -2.151 2.813 -10.276 783 HB2 GLN 101 HB3 GLN 101 -3.347 0.229 -10.462 784 HB3 GLN 101 HB2 GLN 101 -4.619 1.397 -10.134 785 HG2 GLN 101 HG3 GLN 101 -2.710 2.235 -12.187 786 HG3 GLN 101 HG2 GLN 101 -3.641 0.794 -12.594 787 HE21 GLN 101 HE21 GLN 101 -4.009 4.090 -11.363 788 HE22 GLN 101 HE22 GLN 101 -5.535 4.389 -12.116 789 H ILE 102 H ILE 102 -3.257 1.212 -7.357 790 HA ILE 102 HA ILE 102 -5.269 3.060 -6.647 791 HB ILE 102 HB ILE 102 -3.594 1.451 -4.721 792 HG12 ILE 102 HG13 ILE 102 -4.421 -0.059 -6.430 793 HG13 ILE 102 HG12 ILE 102 -5.348 -0.297 -4.953 794 HG21 ILE 102 HG21 ILE 102 -5.172 3.271 -3.899 795 HG22 ILE 102 HG22 ILE 102 -5.381 1.660 -3.211 796 HG23 ILE 102 HG23 ILE 102 -6.483 2.234 -4.463 797 HD11 ILE 102 HD11 ILE 102 -6.579 -0.219 -7.207 798 HD12 ILE 102 HD12 ILE 102 -6.350 1.525 -7.094 799 HD13 ILE 102 HD13 ILE 102 -7.248 0.672 -5.840 800 H PHE 103 H PHE 103 -1.821 2.873 -5.857 801 HA PHE 103 HA PHE 103 -1.715 5.020 -4.065 802 HB2 PHE 103 HB3 PHE 103 0.427 4.085 -5.987 803 HB3 PHE 103 HB2 PHE 103 0.688 5.103 -4.576 804 HD1 PHE 103 HD2 PHE 103 -0.998 3.754 -2.574 805 HD2 PHE 103 HD1 PHE 103 1.606 2.146 -5.530 806 HE1 PHE 103 HE2 PHE 103 -0.670 1.748 -1.189 807 HE2 PHE 103 HE1 PHE 103 1.939 0.137 -4.151 808 HZ PHE 103 HZ PHE 103 0.801 -0.064 -1.976 809 H THR 104 H THR 104 -1.627 4.909 -7.573 810 HA THR 104 HA THR 104 -0.776 7.506 -8.110 811 HB THR 104 HB THR 104 -2.793 5.931 -9.713 812 HG1 THR 104 HG1 THR 104 -1.071 4.600 -9.472 813 HG21 THR 104 HG21 THR 104 -2.346 7.227 -11.503 814 HG22 THR 104 HG22 THR 104 -0.694 7.566 -10.988 815 HG23 THR 104 HG23 THR 104 -2.044 8.425 -10.245 816 H ALA 105 H ALA 105 -4.152 6.330 -7.994 817 HA ALA 105 HA ALA 105 -5.433 8.740 -8.369 818 HB1 ALA 105 HB1 ALA 105 -6.394 6.355 -8.126 819 HB2 ALA 105 HB2 ALA 105 -7.375 7.726 -7.609 820 HB3 ALA 105 HB3 ALA 105 -6.518 6.755 -6.413 821 H PHE 106 H PHE 106 -4.755 7.291 -5.151 822 HA PHE 106 HA PHE 106 -5.477 9.683 -3.815 823 HB2 PHE 106 HB3 PHE 106 -3.980 7.233 -2.872 824 HB3 PHE 106 HB2 PHE 106 -4.520 8.534 -1.814 825 HD1 PHE 106 HD2 PHE 106 -5.629 5.800 -4.015 826 HD2 PHE 106 HD1 PHE 106 -6.791 8.708 -1.133 827 HE1 PHE 106 HE2 PHE 106 -7.817 4.697 -3.792 828 HE2 PHE 106 HE1 PHE 106 -8.982 7.609 -0.904 829 HZ PHE 106 HZ PHE 106 -9.497 5.601 -2.236 830 H LYS 107 H LYS 107 -2.653 8.769 -5.486 831 HA LYS 107 HA LYS 107 -0.555 9.794 -4.064 832 HB2 LYS 107 HB3 LYS 107 0.626 9.797 -6.020 833 HB3 LYS 107 HB2 LYS 107 -0.759 8.860 -6.552 834 HG2 LYS 107 HG3 LYS 107 -1.743 11.074 -7.346 835 HG3 LYS 107 HG2 LYS 107 -0.122 11.734 -7.117 836 HD2 LYS 107 HD3 LYS 107 0.788 10.099 -8.667 837 HD3 LYS 107 HD2 LYS 107 -0.804 9.361 -8.853 838 HE2 LYS 107 HE3 LYS 107 -1.606 11.083 -10.134 839 HE3 LYS 107 HE2 LYS 107 -0.520 12.269 -9.411 840 HZ1 LYS 107 HZ1 LYS 107 0.300 11.960 -11.548 841 HZ2 LYS 107 HZ2 LYS 107 0.066 10.285 -11.518 842 HZ3 LYS 107 HZ3 LYS 107 1.308 10.981 -10.606 843 H ASP 108 H ASP 108 -3.081 11.550 -5.716 844 HA ASP 108 HA ASP 108 -1.847 14.126 -5.181 845 HB2 ASP 108 HB3 ASP 108 -4.223 13.180 -6.718 846 HB3 ASP 108 HB2 ASP 108 -4.226 14.840 -6.130 847 H ASP 109 H ASP 109 -4.608 12.195 -4.124 848 HA ASP 109 HA ASP 109 -5.421 14.218 -2.201 849 HB2 ASP 109 HB3 ASP 109 -6.769 12.239 -3.586 850 HB3 ASP 109 HB2 ASP 109 -6.702 11.608 -1.943 851 H VAL 110 H VAL 110 -2.896 12.263 -2.115 852 HA VAL 110 HA VAL 110 -3.292 11.037 0.478 853 HB VAL 110 HB VAL 110 -1.998 9.871 -1.258 854 HG11 VAL 110 HG11 VAL 110 -0.178 10.701 -2.305 855 HG12 VAL 110 HG12 VAL 110 0.379 11.576 -0.878 856 HG13 VAL 110 HG13 VAL 110 -0.911 12.246 -1.877 857 HG21 VAL 110 HG21 VAL 110 -0.292 9.044 0.156 858 HG22 VAL 110 HG22 VAL 110 -1.607 9.549 1.218 859 HG23 VAL 110 HG23 VAL 110 -0.180 10.569 1.034 860 H ASP 111 H ASP 111 -1.779 11.375 2.258 861 HA ASP 111 HA ASP 111 -0.722 14.121 2.357 862 HB2 ASP 111 HB3 ASP 111 -2.916 13.596 3.668 863 HB3 ASP 111 HB2 ASP 111 -1.838 12.785 4.800 864 H THR 112 H THR 112 -0.505 10.832 3.677 865 HA THR 112 HA THR 112 2.277 11.425 4.434 866 HB THR 112 HB THR 112 0.434 9.350 5.630 867 HG1 THR 112 HG1 THR 112 0.519 10.718 7.449 868 HG21 THR 112 HG21 THR 112 2.191 9.217 7.399 869 HG22 THR 112 HG22 THR 112 3.259 10.119 6.323 870 HG23 THR 112 HG23 THR 112 2.654 8.534 5.841 871 H LEU 113 H LEU 113 3.817 9.657 4.225 872 HA LEU 113 HA LEU 113 3.073 7.590 2.293 873 HB2 LEU 113 HB3 LEU 113 4.425 9.884 1.574 874 HB3 LEU 113 HB2 LEU 113 5.717 8.726 1.813 875 HG LEU 113 HG LEU 113 4.749 7.242 0.157 876 HD11 LEU 113 HD11 LEU 113 2.639 7.350 -0.557 877 HD12 LEU 113 HD12 LEU 113 2.752 9.079 -0.881 878 HD13 LEU 113 HD13 LEU 113 2.363 8.510 0.741 879 HD21 LEU 113 HD21 LEU 113 5.444 10.039 -0.416 880 HD22 LEU 113 HD22 LEU 113 4.652 9.171 -1.732 881 HD23 LEU 113 HD23 LEU 113 6.146 8.544 -1.035 882 H LEU 114 H LEU 114 3.959 5.662 2.704 883 HA LEU 114 HA LEU 114 6.300 5.488 4.465 884 HB2 LEU 114 HB3 LEU 114 3.593 4.345 4.915 885 HB3 LEU 114 HB2 LEU 114 4.965 3.329 5.317 886 HG LEU 114 HG LEU 114 4.851 6.122 6.382 887 HD11 LEU 114 HD11 LEU 114 3.701 5.193 8.395 888 HD12 LEU 114 HD12 LEU 114 3.337 3.749 7.450 889 HD13 LEU 114 HD13 LEU 114 2.684 5.312 6.959 890 HD21 LEU 114 HD21 LEU 114 6.129 5.142 8.194 891 HD22 LEU 114 HD22 LEU 114 6.884 4.765 6.645 892 HD23 LEU 114 HD23 LEU 114 5.941 3.536 7.488 893 H VAL 115 H VAL 115 7.796 4.577 3.189 894 HA VAL 115 HA VAL 115 6.965 2.251 1.572 895 HB VAL 115 HB VAL 115 8.639 2.877 -0.107 896 HG11 VAL 115 HG11 VAL 115 6.768 5.172 0.450 897 HG12 VAL 115 HG12 VAL 115 6.270 3.635 -0.259 898 HG13 VAL 115 HG13 VAL 115 7.414 4.670 -1.113 899 HG21 VAL 115 HG21 VAL 115 8.958 5.621 0.884 900 HG22 VAL 115 HG22 VAL 115 10.129 4.544 0.122 901 HG23 VAL 115 HG23 VAL 115 9.778 4.389 1.843 902 H THR 116 H THR 116 8.438 0.593 1.261 903 HA THR 116 HA THR 116 10.736 0.554 3.106 904 HB THR 116 HB THR 116 8.819 -1.671 2.377 905 HG1 THR 116 HG1 THR 116 8.454 -1.686 4.606 906 HG21 THR 116 HG21 THR 116 10.870 -2.793 2.443 907 HG22 THR 116 HG22 THR 116 10.168 -3.010 4.047 908 HG23 THR 116 HG23 THR 116 11.452 -1.826 3.799 909 H ARG 117 H ARG 117 12.358 1.016 1.686 910 HA ARG 117 HA ARG 117 12.436 -0.285 -0.907 911 HB2 ARG 117 HB3 ARG 117 13.267 2.175 -0.011 912 HB3 ARG 117 HB2 ARG 117 14.780 1.287 -0.120 913 HG2 ARG 117 HG3 ARG 117 14.819 1.561 -2.313 914 HG3 ARG 117 HG2 ARG 117 13.246 0.776 -2.467 915 HD2 ARG 117 HD3 ARG 117 12.407 3.146 -1.620 916 HD3 ARG 117 HD2 ARG 117 13.931 3.663 -2.339 917 HE ARG 117 HE ARG 117 12.824 2.150 -4.282 918 HH11 ARG 117 HH11 ARG 117 11.632 4.823 -2.381 919 HH12 ARG 117 HH12 ARG 117 10.575 5.399 -3.626 920 HH21 ARG 117 HH21 ARG 117 11.435 2.906 -5.921 921 HH22 ARG 117 HH22 ARG 117 10.463 4.311 -5.636 922 H LEU 118 H LEU 118 13.084 -2.337 -0.909 923 HA LEU 118 HA LEU 118 14.811 -3.515 0.979 924 HB2 LEU 118 HB3 LEU 118 13.585 -4.295 -1.595 925 HB3 LEU 118 HB2 LEU 118 15.045 -5.163 -1.159 926 HG LEU 118 HG LEU 118 13.860 -5.585 1.102 927 HD11 LEU 118 HD11 LEU 118 11.658 -4.507 -0.592 928 HD12 LEU 118 HD12 LEU 118 11.980 -4.268 1.125 929 HD13 LEU 118 HD13 LEU 118 11.313 -5.799 0.558 930 HD21 LEU 118 HD21 LEU 118 13.457 -7.658 0.341 931 HD22 LEU 118 HD22 LEU 118 14.158 -7.055 -1.160 932 HD23 LEU 118 HD23 LEU 118 12.407 -7.088 -0.955 933 H ALA 119 H ALA 119 16.897 -4.630 0.316 934 HA ALA 119 HA ALA 119 18.650 -2.624 -0.864 935 HB1 ALA 119 HB1 ALA 119 19.970 -3.303 0.793 936 HB2 ALA 119 HB2 ALA 119 20.188 -4.821 -0.079 937 HB3 ALA 119 HB3 ALA 119 18.920 -4.678 1.139 938 H GLY 120 H GLY 120 17.770 -6.026 -1.305 939 HA2 GLY 120 HA3 GLY 120 19.492 -6.573 -3.454 940 HA3 GLY 120 HA2 GLY 120 18.008 -7.440 -3.094 941 H SER 121 H SER 121 19.138 -6.713 -5.671 942 HA SER 121 HA SER 121 17.221 -4.746 -6.685 943 HB2 SER 121 HB3 SER 121 19.852 -5.757 -7.572 944 HB3 SER 121 HB2 SER 121 18.690 -5.456 -8.863 945 HG SER 121 HG SER 121 19.822 -3.570 -8.464 946 H PHE 122 H PHE 122 15.348 -5.442 -7.450 947 HA PHE 122 HA PHE 122 15.233 -8.122 -8.671 948 HB2 PHE 122 HB3 PHE 122 13.105 -6.709 -7.051 949 HB3 PHE 122 HB2 PHE 122 12.883 -8.246 -7.881 950 HD1 PHE 122 HD2 PHE 122 14.836 -6.566 -5.220 951 HD2 PHE 122 HD1 PHE 122 13.504 -10.257 -6.866 952 HE1 PHE 122 HE2 PHE 122 15.677 -7.750 -3.234 953 HE2 PHE 122 HE1 PHE 122 14.341 -11.449 -4.883 954 HZ PHE 122 HZ PHE 122 15.430 -10.195 -3.064 955 H GLU 123 H GLU 123 13.429 -8.399 -10.222 956 HA GLU 123 HA GLU 123 12.658 -5.923 -11.589 957 HB2 GLU 123 HB3 GLU 123 13.210 -6.910 -13.774 958 HB3 GLU 123 HB2 GLU 123 14.636 -6.728 -12.761 959 HG2 GLU 123 HG3 GLU 123 13.664 -9.289 -12.222 960 HG3 GLU 123 HG2 GLU 123 13.535 -9.090 -13.969 961 H GLY 124 H GLY 124 10.646 -5.963 -12.511 962 HA2 GLY 124 HA3 GLY 124 9.242 -8.477 -12.861 963 HA3 GLY 124 HA2 GLY 124 8.617 -7.453 -11.578 964 H ASP 125 H ASP 125 6.677 -6.907 -12.454 965 HA ASP 125 HA ASP 125 6.789 -5.214 -14.849 966 HB2 ASP 125 HB3 ASP 125 5.735 -7.756 -14.902 967 HB3 ASP 125 HB2 ASP 125 4.310 -6.762 -14.615 968 H THR 126 H THR 126 6.546 -4.777 -11.872 969 HA THR 126 HA THR 126 4.294 -2.930 -12.042 970 HB THR 126 HB THR 126 4.578 -4.569 -9.547 971 HG1 THR 126 HG1 THR 126 2.931 -5.279 -11.738 972 HG21 THR 126 HG21 THR 126 2.198 -4.127 -9.314 973 HG22 THR 126 HG22 THR 126 2.209 -3.233 -10.834 974 HG23 THR 126 HG23 THR 126 3.118 -2.629 -9.449 975 H LYS 127 H LYS 127 5.383 -1.082 -11.829 976 HA LYS 127 HA LYS 127 7.267 -0.823 -9.576 977 HB2 LYS 127 HB3 LYS 127 8.374 0.952 -10.847 978 HB3 LYS 127 HB2 LYS 127 8.357 -0.554 -11.754 979 HG2 LYS 127 HG3 LYS 127 6.137 0.516 -12.742 980 HG3 LYS 127 HG2 LYS 127 6.971 2.005 -12.293 981 HD2 LYS 127 HD3 LYS 127 8.573 1.741 -13.873 982 HD3 LYS 127 HD2 LYS 127 8.583 -0.017 -13.721 983 HE2 LYS 127 HE3 LYS 127 6.097 1.070 -14.815 984 HE3 LYS 127 HE2 LYS 127 7.516 1.390 -15.811 985 HZ1 LYS 127 HZ1 LYS 127 7.039 -0.644 -16.606 986 HZ2 LYS 127 HZ2 LYS 127 6.195 -1.127 -15.222 987 HZ3 LYS 127 HZ3 LYS 127 7.885 -1.179 -15.242 988 H MET 128 H MET 128 7.413 1.445 -8.709 989 HA MET 128 HA MET 128 4.857 2.294 -7.857 990 HB2 MET 128 HB3 MET 128 7.033 2.538 -6.594 991 HB3 MET 128 HB2 MET 128 7.419 3.878 -7.665 992 HG2 MET 128 HG3 MET 128 6.497 4.573 -5.481 993 HG3 MET 128 HG2 MET 128 5.564 5.147 -6.861 994 HE1 MET 128 HE1 MET 128 2.350 4.755 -5.911 995 HE2 MET 128 HE2 MET 128 3.767 5.804 -5.937 996 HE3 MET 128 HE3 MET 128 3.150 5.192 -4.402 997 H ILE 129 H ILE 129 4.088 4.581 -8.028 998 HA ILE 129 HA ILE 129 4.353 5.501 -10.811 999 HB ILE 129 HB ILE 129 2.149 6.565 -10.520 1000 HG12 ILE 129 HG13 ILE 129 0.871 5.522 -8.436 1001 HG13 ILE 129 HG12 ILE 129 2.490 5.510 -7.748 1002 HG21 ILE 129 HG21 ILE 129 1.664 4.621 -11.523 1003 HG22 ILE 129 HG22 ILE 129 1.006 4.161 -9.953 1004 HG23 ILE 129 HG23 ILE 129 2.645 3.682 -10.397 1005 HD11 ILE 129 HD11 ILE 129 2.675 7.843 -7.889 1006 HD12 ILE 129 HD12 ILE 129 1.061 7.527 -7.256 1007 HD13 ILE 129 HD13 ILE 129 1.274 7.971 -8.950 1008 HA PRO 130 HA PRO 130 6.046 9.422 -9.755 1009 HB2 PRO 130 HB3 PRO 130 3.835 10.747 -11.224 1010 HB3 PRO 130 HB2 PRO 130 5.580 10.856 -11.477 1011 HG2 PRO 130 HG3 PRO 130 4.040 9.472 -13.157 1012 HG3 PRO 130 HG2 PRO 130 5.657 8.895 -12.711 1013 HD2 PRO 130 HD3 PRO 130 2.980 7.974 -11.742 1014 HD3 PRO 130 HD2 PRO 130 4.430 7.023 -12.124 1015 H LEU 131 H LEU 131 5.863 11.074 -8.275 1016 HA LEU 131 HA LEU 131 3.239 11.680 -7.139 1017 HB2 LEU 131 HB3 LEU 131 5.459 11.176 -5.215 1018 HB3 LEU 131 HB2 LEU 131 3.728 11.085 -4.965 1019 HG LEU 131 HG LEU 131 4.993 9.058 -6.747 1020 HD11 LEU 131 HD11 LEU 131 4.916 8.415 -3.867 1021 HD12 LEU 131 HD12 LEU 131 6.221 9.471 -4.406 1022 HD13 LEU 131 HD13 LEU 131 6.026 7.873 -5.126 1023 HD21 LEU 131 HD21 LEU 131 3.219 7.687 -5.981 1024 HD22 LEU 131 HD22 LEU 131 2.518 9.271 -6.309 1025 HD23 LEU 131 HD23 LEU 131 2.854 8.783 -4.648 1026 H ASN 132 H ASN 132 3.178 13.646 -5.920 1027 HA ASN 132 HA ASN 132 4.951 15.652 -6.913 1028 HB2 ASN 132 HB3 ASN 132 2.403 15.670 -5.888 1029 HB3 ASN 132 HB2 ASN 132 3.329 16.365 -4.563 1030 HD21 ASN 132 HD21 ASN 132 5.250 17.776 -5.841 1031 HD22 ASN 132 HD22 ASN 132 4.541 19.043 -6.777 1032 H TRP 133 H TRP 133 6.869 14.428 -6.102 1033 HA TRP 133 HA TRP 133 7.535 14.062 -3.458 1034 HB2 TRP 133 HB3 TRP 133 9.337 14.754 -5.780 1035 HB3 TRP 133 HB2 TRP 133 9.903 14.163 -4.219 1036 HD1 TRP 133 HD1 TRP 133 8.264 13.005 -7.440 1037 HE1 TRP 133 HE1 TRP 133 8.140 10.432 -7.447 1038 HE3 TRP 133 HE3 TRP 133 9.701 12.106 -2.615 1039 HZ2 TRP 133 HZ2 TRP 133 8.600 8.306 -5.648 1040 HZ3 TRP 133 HZ3 TRP 133 9.835 9.776 -1.839 1041 HH2 TRP 133 HH2 TRP 133 9.294 7.916 -3.325 1042 H ASP 134 H ASP 134 8.104 17.025 -5.414 1043 HA ASP 134 HA ASP 134 9.524 18.440 -3.495 1044 HB2 ASP 134 HB3 ASP 134 8.640 20.480 -4.675 1045 HB3 ASP 134 HB2 ASP 134 9.387 19.285 -5.731 1046 H ASP 135 H ASP 135 6.025 18.179 -3.977 1047 HA ASP 135 HA ASP 135 5.370 19.992 -1.873 1048 HB2 ASP 135 HB3 ASP 135 3.904 18.244 -3.743 1049 HB3 ASP 135 HB2 ASP 135 3.099 18.532 -2.204 1050 H PHE 136 H PHE 136 6.700 16.979 -1.729 1051 HA PHE 136 HA PHE 136 5.486 16.456 0.904 1052 HB2 PHE 136 HB3 PHE 136 6.188 14.582 -1.320 1053 HB3 PHE 136 HB2 PHE 136 6.299 14.012 0.342 1054 HD1 PHE 136 HD2 PHE 136 3.877 16.082 -1.611 1055 HD2 PHE 136 HD1 PHE 136 4.493 12.771 0.990 1056 HE1 PHE 136 HE2 PHE 136 1.457 15.638 -1.609 1057 HE2 PHE 136 HE1 PHE 136 2.074 12.320 0.996 1058 HZ PHE 136 HZ PHE 136 0.553 13.756 -0.304 1059 H THR 137 H THR 137 6.829 16.266 2.585 1060 HA THR 137 HA THR 137 9.721 16.271 2.023 1061 HB THR 137 HB THR 137 8.160 17.569 4.260 1062 HG1 THR 137 HG1 THR 137 9.700 18.534 2.099 1063 HG21 THR 137 HG21 THR 137 11.149 17.475 3.925 1064 HG22 THR 137 HG22 THR 137 10.220 16.686 5.201 1065 HG23 THR 137 HG23 THR 137 10.264 18.447 5.101 1066 H LYS 138 H LYS 138 11.057 14.932 3.164 1067 HA LYS 138 HA LYS 138 9.967 12.532 4.175 1068 HB2 LYS 138 HB3 LYS 138 12.294 12.980 3.140 1069 HB3 LYS 138 HB2 LYS 138 12.761 13.461 4.765 1070 HG2 LYS 138 HG3 LYS 138 13.053 11.350 5.348 1071 HG3 LYS 138 HG2 LYS 138 11.394 10.959 4.893 1072 HD2 LYS 138 HD3 LYS 138 12.446 9.595 3.421 1073 HD3 LYS 138 HD2 LYS 138 12.496 11.071 2.457 1074 HE2 LYS 138 HE3 LYS 138 14.744 11.311 3.994 1075 HE3 LYS 138 HE2 LYS 138 14.668 9.571 3.721 1076 HZ1 LYS 138 HZ1 LYS 138 14.674 11.681 1.631 1077 HZ2 LYS 138 HZ2 LYS 138 14.495 10.027 1.329 1078 HZ3 LYS 138 HZ3 LYS 138 15.938 10.614 1.987 1079 H VAL 139 H VAL 139 9.077 12.175 6.085 1080 HA VAL 139 HA VAL 139 9.481 14.061 8.260 1081 HB VAL 139 HB VAL 139 7.799 11.611 8.568 1082 HG11 VAL 139 HG11 VAL 139 7.599 12.772 10.495 1083 HG12 VAL 139 HG12 VAL 139 6.377 13.649 9.575 1084 HG13 VAL 139 HG13 VAL 139 8.003 14.313 9.738 1085 HG21 VAL 139 HG21 VAL 139 7.255 13.880 6.711 1086 HG22 VAL 139 HG22 VAL 139 5.916 13.163 7.609 1087 HG23 VAL 139 HG23 VAL 139 6.892 12.163 6.534 1088 H SER 140 H SER 140 10.302 10.769 7.399 1089 HA SER 140 HA SER 140 12.259 10.682 9.512 1090 HB2 SER 140 HB3 SER 140 10.428 8.350 9.644 1091 HB3 SER 140 HB2 SER 140 11.343 9.140 10.927 1092 HG SER 140 HG SER 140 9.060 9.472 11.083 1093 H SER 141 H SER 141 13.563 8.690 9.452 1094 HA SER 141 HA SER 141 13.334 6.988 7.138 1095 HB2 SER 141 HB3 SER 141 15.946 8.421 7.278 1096 HB3 SER 141 HB2 SER 141 15.117 7.727 5.884 1097 HG SER 141 HG SER 141 15.005 9.954 5.743 1098 H ARG 142 H ARG 142 13.949 5.030 7.742 1099 HA ARG 142 HA ARG 142 16.089 4.754 9.741 1100 HB2 ARG 142 HB3 ARG 142 13.793 4.436 10.738 1101 HB3 ARG 142 HB2 ARG 142 13.599 3.045 9.681 1102 HG2 ARG 142 HG3 ARG 142 15.786 2.204 10.761 1103 HG3 ARG 142 HG2 ARG 142 15.436 3.399 12.012 1104 HD2 ARG 142 HD3 ARG 142 13.200 1.641 11.220 1105 HD3 ARG 142 HD2 ARG 142 14.532 0.865 12.073 1106 HE ARG 142 HE ARG 142 12.623 2.728 13.156 1107 HH11 ARG 142 HH11 ARG 142 15.794 1.320 13.535 1108 HH12 ARG 142 HH12 ARG 142 15.870 1.639 15.235 1109 HH21 ARG 142 HH21 ARG 142 12.722 3.149 15.392 1110 HH22 ARG 142 HH22 ARG 142 14.126 2.677 16.289 1111 H THR 143 H THR 143 17.533 3.124 9.371 1112 HA THR 143 HA THR 143 17.090 1.535 6.930 1113 HB THR 143 HB THR 143 19.774 2.234 8.113 1114 HG1 THR 143 HG1 THR 143 18.875 4.170 7.539 1115 HG21 THR 143 HG21 THR 143 19.649 1.941 5.256 1116 HG22 THR 143 HG22 THR 143 19.077 0.487 6.073 1117 HG23 THR 143 HG23 THR 143 20.681 1.127 6.430 1118 H VAL 144 H VAL 144 16.426 -0.427 7.540 1119 HA VAL 144 HA VAL 144 17.721 -1.724 9.834 1120 HB VAL 144 HB VAL 144 15.277 -2.683 8.345 1121 HG11 VAL 144 HG11 VAL 144 14.941 -3.765 10.681 1122 HG12 VAL 144 HG12 VAL 144 16.672 -3.480 10.867 1123 HG13 VAL 144 HG13 VAL 144 16.081 -4.489 9.546 1124 HG21 VAL 144 HG21 VAL 144 13.887 -1.601 9.909 1125 HG22 VAL 144 HG22 VAL 144 15.053 -0.380 9.398 1126 HG23 VAL 144 HG23 VAL 144 15.247 -1.189 10.954 1127 H GLU 145 H GLU 145 19.087 -3.382 9.558 1128 HA GLU 145 HA GLU 145 19.194 -4.659 6.905 1129 HB2 GLU 145 HB3 GLU 145 21.700 -4.953 7.469 1130 HB3 GLU 145 HB2 GLU 145 21.141 -3.383 6.909 1131 HG2 GLU 145 HG3 GLU 145 21.405 -2.398 8.961 1132 HG3 GLU 145 HG2 GLU 145 21.244 -3.922 9.833 1133 H ASP 146 H ASP 146 19.611 -6.845 6.823 1134 HA ASP 146 HA ASP 146 19.483 -8.259 9.405 1135 HB2 ASP 146 HB3 ASP 146 17.947 -8.555 6.933 1136 HB3 ASP 146 HB2 ASP 146 18.628 -10.076 7.503 1137 H THR 147 H THR 147 20.064 -10.792 8.669 1138 HA THR 147 HA THR 147 22.856 -10.807 8.493 1139 HB THR 147 HB THR 147 21.567 -12.654 9.467 1140 HG1 THR 147 HG1 THR 147 23.145 -13.414 7.237 1141 HG21 THR 147 HG21 THR 147 20.930 -13.728 6.769 1142 HG22 THR 147 HG22 THR 147 19.832 -12.572 7.522 1143 HG23 THR 147 HG23 THR 147 20.202 -14.093 8.333 1144 H ASN 148 H ASN 148 20.384 -11.370 6.023 1145 HA ASN 148 HA ASN 148 22.390 -11.720 3.958 1146 HB2 ASN 148 HB3 ASN 148 19.383 -11.823 4.004 1147 HB3 ASN 148 HB2 ASN 148 20.266 -11.784 2.480 1148 HD21 ASN 148 HD21 ASN 148 18.839 -13.772 4.615 1149 HD22 ASN 148 HD22 ASN 148 19.727 -15.224 4.323 1150 HA PRO 149 HA PRO 149 22.672 -7.432 2.880 1151 HB2 PRO 149 HB3 PRO 149 23.323 -7.724 0.226 1152 HB3 PRO 149 HB2 PRO 149 24.476 -7.886 1.554 1153 HG2 PRO 149 HG3 PRO 149 23.026 -10.014 0.032 1154 HG3 PRO 149 HG2 PRO 149 24.714 -9.976 0.574 1155 HD2 PRO 149 HD3 PRO 149 22.845 -11.391 1.885 1156 HD3 PRO 149 HD2 PRO 149 24.161 -10.566 2.746 1157 H ALA 150 H ALA 150 20.704 -9.656 1.013 1158 HA ALA 150 HA ALA 150 19.283 -7.582 -0.385 1159 HB1 ALA 150 HB1 ALA 150 17.754 -9.557 -0.979 1160 HB2 ALA 150 HB2 ALA 150 18.972 -10.556 -0.185 1161 HB3 ALA 150 HB3 ALA 150 19.411 -9.575 -1.584 1162 H LEU 151 H LEU 151 19.031 -9.073 2.694 1163 HA LEU 151 HA LEU 151 16.207 -8.504 3.000 1164 HB2 LEU 151 HB3 LEU 151 18.294 -9.623 4.857 1165 HB3 LEU 151 HB2 LEU 151 16.662 -9.261 5.384 1166 HG LEU 151 HG LEU 151 17.542 -11.341 3.395 1167 HD11 LEU 151 HD11 LEU 151 15.758 -11.681 5.779 1168 HD12 LEU 151 HD12 LEU 151 17.515 -11.728 5.925 1169 HD13 LEU 151 HD13 LEU 151 16.684 -12.900 4.903 1170 HD21 LEU 151 HD21 LEU 151 15.113 -11.832 3.116 1171 HD22 LEU 151 HD22 LEU 151 15.628 -10.307 2.396 1172 HD23 LEU 151 HD23 LEU 151 14.762 -10.309 3.933 1173 H THR 152 H THR 152 18.652 -6.476 2.815 1174 HA THR 152 HA THR 152 18.159 -4.925 5.221 1175 HB THR 152 HB THR 152 19.852 -4.154 2.841 1176 HG1 THR 152 HG1 THR 152 20.768 -6.006 3.513 1177 HG21 THR 152 HG21 THR 152 21.169 -3.070 4.797 1178 HG22 THR 152 HG22 THR 152 19.623 -3.161 5.639 1179 HG23 THR 152 HG23 THR 152 19.753 -2.258 4.129 1180 H HIS 153 H HIS 153 16.570 -3.487 5.354 1181 HA HIS 153 HA HIS 153 15.672 -2.149 2.891 1182 HB2 HIS 153 HB3 HIS 153 13.589 -2.529 4.930 1183 HB3 HIS 153 HB2 HIS 153 13.505 -2.723 3.184 1184 HD1 HIS 153 HD1 HIS 153 12.992 -4.639 6.039 1185 HD2 HIS 153 HD2 HIS 153 15.149 -5.298 2.550 1186 HE1 HIS 153 HE1 HIS 153 13.251 -7.134 5.870 1187 HE2 HIS 153 HE2 HIS 153 14.474 -7.514 3.701 1188 H THR 154 H THR 154 14.381 -0.149 3.365 1189 HA THR 154 HA THR 154 15.222 1.148 5.859 1190 HB THR 154 HB THR 154 15.431 2.416 3.122 1191 HG1 THR 154 HG1 THR 154 17.413 1.410 4.877 1192 HG21 THR 154 HG21 THR 154 16.738 3.543 5.532 1193 HG22 THR 154 HG22 THR 154 15.013 3.829 5.300 1194 HG23 THR 154 HG23 THR 154 16.166 4.345 4.069 1195 H TYR 155 H TYR 155 13.573 2.072 6.872 1196 HA TYR 155 HA TYR 155 11.048 2.425 5.457 1197 HB2 TYR 155 HB3 TYR 155 11.868 2.186 8.312 1198 HB3 TYR 155 HB2 TYR 155 10.402 3.094 7.958 1199 HD1 TYR 155 HD1 TYR 155 8.619 1.910 6.515 1200 HD2 TYR 155 HD2 TYR 155 11.791 -0.136 8.478 1201 HE1 TYR 155 HE1 TYR 155 7.347 -0.190 6.369 1202 HE2 TYR 155 HE2 TYR 155 10.529 -2.242 8.336 1203 HH TYR 155 HH TYR 155 7.261 -2.381 7.591 1204 H GLU 156 H GLU 156 10.419 4.344 4.709 1205 HA GLU 156 HA GLU 156 11.594 6.760 5.921 1206 HB2 GLU 156 HB3 GLU 156 10.845 6.448 3.014 1207 HB3 GLU 156 HB2 GLU 156 11.678 7.805 3.757 1208 HG2 GLU 156 HG3 GLU 156 13.666 6.657 3.947 1209 HG3 GLU 156 HG2 GLU 156 12.881 5.080 3.888 1210 H VAL 157 H VAL 157 10.290 8.480 6.299 1211 HA VAL 157 HA VAL 157 7.414 8.079 5.818 1212 HB VAL 157 HB VAL 157 8.600 9.857 7.945 1213 HG11 VAL 157 HG11 VAL 157 6.221 9.344 8.888 1214 HG12 VAL 157 HG12 VAL 157 5.847 8.946 7.211 1215 HG13 VAL 157 HG13 VAL 157 6.423 10.560 7.627 1216 HG21 VAL 157 HG21 VAL 157 8.355 8.147 9.544 1217 HG22 VAL 157 HG22 VAL 157 9.181 7.390 8.183 1218 HG23 VAL 157 HG23 VAL 157 7.456 7.120 8.428 1219 H TRP 158 H TRP 158 6.176 9.809 5.174 1220 HA TRP 158 HA TRP 158 7.500 12.301 4.415 1221 HB2 TRP 158 HB3 TRP 158 6.026 10.590 2.411 1222 HB3 TRP 158 HB2 TRP 158 6.587 12.227 2.115 1223 HD1 TRP 158 HD1 TRP 158 8.185 8.831 3.149 1224 HE1 TRP 158 HE1 TRP 158 10.456 8.643 1.954 1225 HE3 TRP 158 HE3 TRP 158 8.231 13.358 0.774 1226 HZ2 TRP 158 HZ2 TRP 158 12.054 10.204 0.229 1227 HZ3 TRP 158 HZ3 TRP 158 10.167 13.933 -0.632 1228 HH2 TRP 158 HH2 TRP 158 12.039 12.387 -0.897 1229 H GLN 159 H GLN 159 6.210 14.054 4.530 1230 HA GLN 159 HA GLN 159 3.306 13.668 4.683 1231 HB2 GLN 159 HB3 GLN 159 5.087 14.745 6.806 1232 HB3 GLN 159 HB2 GLN 159 3.557 15.572 6.552 1233 HG2 GLN 159 HG3 GLN 159 2.446 13.316 6.775 1234 HG3 GLN 159 HG2 GLN 159 4.003 12.708 7.332 1235 HE21 GLN 159 HE21 GLN 159 1.119 13.713 8.377 1236 HE22 GLN 159 HE22 GLN 159 1.544 14.343 9.929 1237 H LYS 160 H LYS 160 2.233 15.109 3.449 1238 HA LYS 160 HA LYS 160 3.523 16.932 1.806 1239 HB2 LYS 160 HB3 LYS 160 1.074 15.890 1.829 1240 HB3 LYS 160 HB2 LYS 160 0.687 17.435 2.572 1241 HG2 LYS 160 HG3 LYS 160 2.334 17.606 0.150 1242 HG3 LYS 160 HG2 LYS 160 0.706 16.971 -0.089 1243 HD2 LYS 160 HD3 LYS 160 -0.216 18.942 1.048 1244 HD3 LYS 160 HD2 LYS 160 1.417 19.579 1.253 1245 HE2 LYS 160 HE3 LYS 160 1.658 19.508 -1.240 1246 HE3 LYS 160 HE2 LYS 160 -0.055 19.102 -1.332 1247 HZ1 LYS 160 HZ1 LYS 160 -0.660 21.197 -0.871 1248 HZ2 LYS 160 HZ2 LYS 160 0.900 21.596 -1.386 1249 HZ3 LYS 160 HZ3 LYS 160 0.572 21.434 0.265 1250 H LYS 161 H LYS 161 3.792 19.138 1.827 1251 HA LYS 161 HA LYS 161 4.151 20.345 4.386 1252 HB2 LYS 161 HB3 LYS 161 4.296 21.530 1.609 1253 HB3 LYS 161 HB2 LYS 161 4.799 22.355 3.078 1254 HG2 LYS 161 HG3 LYS 161 6.541 20.738 3.450 1255 HG3 LYS 161 HG2 LYS 161 5.986 19.775 2.079 1256 HD2 LYS 161 HD3 LYS 161 7.010 21.102 0.582 1257 HD3 LYS 161 HD2 LYS 161 6.546 22.578 1.431 1258 HE2 LYS 161 HE3 LYS 161 8.865 20.754 2.034 1259 HE3 LYS 161 HE2 LYS 161 8.926 22.427 1.484 1260 HZ1 LYS 161 HZ1 LYS 161 9.175 22.849 3.658 1261 HZ2 LYS 161 HZ2 LYS 161 8.513 21.372 4.147 1262 HZ3 LYS 161 HZ3 LYS 161 7.495 22.658 3.732 1263 H ALA 162 H ALA 162 2.893 21.736 5.485 1264 HA ALA 162 HA ALA 162 1.039 22.885 6.135 1265 HB1 ALA 162 HB1 ALA 162 1.898 24.254 4.126 1266 HB2 ALA 162 HB2 ALA 162 0.264 24.555 4.717 1267 HB3 ALA 162 HB3 ALA 162 0.513 23.579 3.269 1268 H51A NDP 170 H51A NDP 170 -5.005 -0.229 -9.332 1269 H52A NDP 170 H52A NDP 170 -5.243 -1.795 -8.548 1270 H4B NDP 170 H4B NDP 170 -6.638 -2.484 -10.556 1271 H3B NDP 170 H3B NDP 170 -6.214 0.400 -11.353 1272 HO3A NDP 170 HO3A NDP 170 -6.267 -0.688 -13.406 1273 H2B NDP 170 H2B NDP 170 -8.480 0.421 -12.136 1274 H1B NDP 170 H1B NDP 170 -9.561 -0.810 -9.920 1275 H8A NDP 170 H8A NDP 170 -6.572 1.407 -9.122 1276 H61A NDP 170 H61A NDP 170 -9.083 5.456 -8.088 1277 H62A NDP 170 H62A NDP 170 -10.760 5.909 -8.290 1278 H2A NDP 170 H2A NDP 170 -12.904 2.289 -9.850 1279 H51N NDP 170 H51N NDP 170 -1.660 -4.847 -7.536 1280 H52N NDP 170 H52N NDP 170 -0.946 -3.945 -8.884 1281 H4D NDP 170 H4D NDP 170 0.635 -5.857 -9.268 1282 H3D NDP 170 H3D NDP 170 -0.709 -7.040 -6.827 1283 HO3N NDP 170 HO3N NDP 170 0.486 -8.289 -9.087 1284 H2D NDP 170 H2D NDP 170 1.438 -7.922 -6.219 1285 HO2N NDP 170 HO2N NDP 170 2.019 -7.585 -8.907 1286 H1D NDP 170 H1D NDP 170 2.846 -5.601 -6.761 1287 H2N NDP 170 H2N NDP 170 3.370 -5.424 -4.413 1288 H71N NDP 170 H71N NDP 170 5.171 -4.756 -1.832 1289 H72N NDP 170 H72N NDP 170 4.727 -5.495 -3.349 1290 H41N NDP 170 H41N NDP 170 0.349 -3.902 -2.304 1291 H42N NDP 170 H42N NDP 170 0.283 -5.655 -1.912 1292 H5N NDP 170 H5N NDP 170 -1.501 -5.017 -3.532 1293 H6N NDP 170 H6N NDP 170 -0.751 -5.577 -5.851 Start of MODEL 30 1 H1 THR 1 HT1 THR 1 -4.679 9.316 6.253 2 H2 THR 1 HT2 THR 1 -6.133 9.635 5.397 3 H3 THR 1 HT3 THR 1 -4.785 10.684 5.226 4 HA THR 1 HA THR 1 -5.165 7.965 4.213 5 HB THR 1 HB THR 1 -4.409 9.115 2.124 6 HG1 THR 1 HG1 THR 1 -4.193 11.318 2.124 7 HG21 THR 1 HG21 THR 1 -6.433 10.783 2.068 8 HG22 THR 1 HG22 THR 1 -6.865 9.953 3.563 9 HG23 THR 1 HG23 THR 1 -6.683 9.037 2.067 10 H ALA 2 H ALA 2 -3.492 6.612 4.163 11 HA ALA 2 HA ALA 2 -0.769 7.707 4.363 12 HB1 ALA 2 HB1 ALA 2 -1.624 6.825 6.569 13 HB2 ALA 2 HB2 ALA 2 -0.118 6.114 5.988 14 HB3 ALA 2 HB3 ALA 2 -1.633 5.225 5.828 15 H PHE 3 H PHE 3 0.826 6.574 3.278 16 HA PHE 3 HA PHE 3 -0.154 4.491 1.437 17 HB2 PHE 3 HB3 PHE 3 1.657 6.801 1.109 18 HB3 PHE 3 HB2 PHE 3 2.189 5.317 0.329 19 HD1 PHE 3 HD1 PHE 3 -1.298 6.488 0.785 20 HD2 PHE 3 HD2 PHE 3 1.915 5.836 -1.928 21 HE1 PHE 3 HE1 PHE 3 -2.803 6.950 -1.104 22 HE2 PHE 3 HE2 PHE 3 0.416 6.296 -3.822 23 HZ PHE 3 HZ PHE 3 -1.946 6.855 -3.412 24 H LEU 4 H LEU 4 0.651 2.492 1.676 25 HA LEU 4 HA LEU 4 3.324 2.170 2.822 26 HB2 LEU 4 HB3 LEU 4 1.882 1.921 4.718 27 HB3 LEU 4 HB2 LEU 4 0.814 0.848 3.834 28 HG LEU 4 HG LEU 4 2.763 -0.774 3.697 29 HD11 LEU 4 HD11 LEU 4 4.693 0.348 4.188 30 HD12 LEU 4 HD12 LEU 4 4.319 -0.334 5.771 31 HD13 LEU 4 HD13 LEU 4 3.929 1.350 5.422 32 HD21 LEU 4 HD21 LEU 4 1.526 -1.742 5.263 33 HD22 LEU 4 HD22 LEU 4 0.947 -0.178 5.834 34 HD23 LEU 4 HD23 LEU 4 2.440 -0.856 6.484 35 H TRP 5 H TRP 5 4.448 1.067 1.355 36 HA TRP 5 HA TRP 5 3.375 -1.425 0.340 37 HB2 TRP 5 HB3 TRP 5 3.449 -0.941 -1.955 38 HB3 TRP 5 HB2 TRP 5 2.664 0.464 -1.245 39 HD1 TRP 5 HD1 TRP 5 5.931 -0.611 -2.927 40 HE1 TRP 5 HE1 TRP 5 7.194 1.499 -3.688 41 HE3 TRP 5 HE3 TRP 5 2.974 2.934 -0.739 42 HZ2 TRP 5 HZ2 TRP 5 6.966 4.298 -3.397 43 HZ3 TRP 5 HZ3 TRP 5 3.566 5.307 -1.029 44 HH2 TRP 5 HH2 TRP 5 5.520 5.972 -2.330 45 H ALA 6 H ALA 6 4.988 -2.729 -0.781 46 HA ALA 6 HA ALA 6 7.670 -2.173 0.272 47 HB1 ALA 6 HB1 ALA 6 8.101 -4.562 -0.088 48 HB2 ALA 6 HB2 ALA 6 6.478 -4.748 -0.754 49 HB3 ALA 6 HB3 ALA 6 6.690 -4.297 0.938 50 H GLN 7 H GLN 7 9.509 -2.262 -1.031 51 HA GLN 7 HA GLN 7 9.208 -2.694 -3.886 52 HB2 GLN 7 HB3 GLN 7 10.243 -0.479 -4.424 53 HB3 GLN 7 HB2 GLN 7 8.609 -0.378 -3.783 54 HG2 GLN 7 HG3 GLN 7 10.408 -0.247 -1.599 55 HG3 GLN 7 HG2 GLN 7 10.972 0.872 -2.839 56 HE21 GLN 7 HE21 GLN 7 8.201 -0.035 -0.873 57 HE22 GLN 7 HE22 GLN 7 7.441 1.517 -0.899 58 H ASP 8 H ASP 8 11.312 -2.591 -5.034 59 HA ASP 8 HA ASP 8 13.406 -3.645 -3.291 60 HB2 ASP 8 HB3 ASP 8 14.419 -4.563 -5.278 61 HB3 ASP 8 HB2 ASP 8 12.702 -4.946 -5.298 62 H ARG 9 H ARG 9 15.673 -3.141 -4.747 63 HA ARG 9 HA ARG 9 16.368 -0.580 -3.857 64 HB2 ARG 9 HB3 ARG 9 17.703 -2.823 -4.913 65 HB3 ARG 9 HB2 ARG 9 18.166 -1.457 -5.919 66 HG2 ARG 9 HG3 ARG 9 18.437 -1.652 -2.927 67 HG3 ARG 9 HG2 ARG 9 19.740 -1.729 -4.114 68 HD2 ARG 9 HD3 ARG 9 19.833 0.498 -4.311 69 HD3 ARG 9 HD2 ARG 9 18.079 0.649 -4.393 70 HE ARG 9 HE ARG 9 18.036 1.091 -2.142 71 HH11 ARG 9 HH11 ARG 9 21.186 -0.140 -3.007 72 HH12 ARG 9 HH12 ARG 9 21.890 0.229 -1.468 73 HH21 ARG 9 HH21 ARG 9 18.961 1.576 -0.119 74 HH22 ARG 9 HH22 ARG 9 20.627 1.202 0.172 75 H ASP 10 H ASP 10 15.134 -1.626 -6.957 76 HA ASP 10 HA ASP 10 15.858 0.885 -8.226 77 HB2 ASP 10 HB3 ASP 10 14.483 -1.623 -9.145 78 HB3 ASP 10 HB2 ASP 10 14.397 -0.156 -10.116 79 H GLY 11 H GLY 11 13.048 -0.716 -6.920 80 HA2 GLY 11 HA3 GLY 11 11.490 1.030 -5.874 81 HA3 GLY 11 HA2 GLY 11 11.413 1.667 -7.509 82 H LEU 12 H LEU 12 11.685 -1.668 -7.632 83 HA LEU 12 HA LEU 12 9.267 -2.166 -8.845 84 HB2 LEU 12 HB3 LEU 12 11.435 -3.643 -8.389 85 HB3 LEU 12 HB2 LEU 12 10.436 -4.286 -7.103 86 HG LEU 12 HG LEU 12 8.753 -5.004 -8.746 87 HD11 LEU 12 HD11 LEU 12 10.491 -4.568 -11.066 88 HD12 LEU 12 HD12 LEU 12 9.796 -3.098 -10.388 89 HD13 LEU 12 HD13 LEU 12 8.742 -4.411 -10.909 90 HD21 LEU 12 HD21 LEU 12 11.031 -6.241 -8.154 91 HD22 LEU 12 HD22 LEU 12 11.275 -6.051 -9.890 92 HD23 LEU 12 HD23 LEU 12 9.856 -6.907 -9.288 93 H ILE 13 H ILE 13 7.749 -3.989 -7.786 94 HA ILE 13 HA ILE 13 7.100 -3.484 -5.039 95 HB ILE 13 HB ILE 13 4.828 -2.757 -5.344 96 HG12 ILE 13 HG13 ILE 13 5.192 -2.287 -8.276 97 HG13 ILE 13 HG12 ILE 13 4.746 -3.898 -7.732 98 HG21 ILE 13 HG21 ILE 13 6.683 -1.084 -5.275 99 HG22 ILE 13 HG22 ILE 13 5.195 -0.508 -6.027 100 HG23 ILE 13 HG23 ILE 13 6.567 -0.974 -7.032 101 HD11 ILE 13 HD11 ILE 13 3.222 -1.384 -7.110 102 HD12 ILE 13 HD12 ILE 13 2.762 -3.028 -6.663 103 HD13 ILE 13 HD13 ILE 13 2.805 -2.554 -8.362 104 H GLY 14 H GLY 14 6.349 -5.005 -8.110 105 HA2 GLY 14 HA3 GLY 14 6.011 -7.546 -6.797 106 HA3 GLY 14 HA2 GLY 14 4.531 -6.916 -7.505 107 H LYS 15 H LYS 15 5.150 -9.183 -8.518 108 HA LYS 15 HA LYS 15 6.341 -8.573 -11.130 109 HB2 LYS 15 HB3 LYS 15 7.068 -11.062 -11.104 110 HB3 LYS 15 HB2 LYS 15 8.042 -9.887 -10.233 111 HG2 LYS 15 HG3 LYS 15 7.927 -11.471 -8.630 112 HG3 LYS 15 HG2 LYS 15 6.429 -10.625 -8.244 113 HD2 LYS 15 HD3 LYS 15 6.092 -12.663 -10.302 114 HD3 LYS 15 HD2 LYS 15 6.681 -13.317 -8.773 115 HE2 LYS 15 HE3 LYS 15 4.526 -11.377 -8.447 116 HE3 LYS 15 HE2 LYS 15 4.056 -12.786 -9.395 117 HZ1 LYS 15 HZ1 LYS 15 5.317 -13.977 -7.401 118 HZ2 LYS 15 HZ2 LYS 15 3.665 -13.616 -7.349 119 HZ3 LYS 15 HZ3 LYS 15 4.777 -12.598 -6.582 120 H ASP 16 H ASP 16 3.941 -8.175 -11.379 121 HA ASP 16 HA ASP 16 2.021 -8.756 -12.452 122 HB2 ASP 16 HB3 ASP 16 3.230 -11.512 -12.773 123 HB3 ASP 16 HB2 ASP 16 1.876 -10.841 -13.677 124 H GLY 17 H GLY 17 2.124 -8.807 -9.687 125 HA2 GLY 17 HA3 GLY 17 -0.236 -10.083 -8.992 126 HA3 GLY 17 HA2 GLY 17 1.060 -11.191 -8.566 127 H HIS 18 H HIS 18 2.935 -9.994 -7.359 128 HA HIS 18 HA HIS 18 2.350 -7.740 -5.766 129 HB2 HIS 18 HB3 HIS 18 1.970 -8.791 -3.601 130 HB3 HIS 18 HB2 HIS 18 0.724 -9.296 -4.736 131 HD1 HIS 18 HD1 HIS 18 2.382 -10.718 -2.111 132 HD2 HIS 18 HD2 HIS 18 2.005 -11.885 -6.081 133 HE1 HIS 18 HE1 HIS 18 2.839 -13.191 -2.131 134 HE2 HIS 18 HE2 HIS 18 2.693 -13.857 -4.556 135 H LEU 19 H LEU 19 3.825 -8.238 -3.497 136 HA LEU 19 HA LEU 19 6.466 -8.108 -4.485 137 HB2 LEU 19 HB3 LEU 19 7.123 -8.177 -2.081 138 HB3 LEU 19 HB2 LEU 19 5.945 -6.941 -2.477 139 HG LEU 19 HG LEU 19 4.270 -8.898 -1.710 140 HD11 LEU 19 HD11 LEU 19 5.734 -9.511 0.547 141 HD12 LEU 19 HD12 LEU 19 6.895 -9.702 -0.767 142 HD13 LEU 19 HD13 LEU 19 5.376 -10.598 -0.794 143 HD21 LEU 19 HD21 LEU 19 4.591 -6.501 -0.882 144 HD22 LEU 19 HD22 LEU 19 5.645 -7.200 0.348 145 HD23 LEU 19 HD23 LEU 19 3.949 -7.679 0.264 146 HA PRO 20 HA PRO 20 7.061 -12.561 -4.577 147 HB2 PRO 20 HB3 PRO 20 9.291 -12.590 -6.042 148 HB3 PRO 20 HB2 PRO 20 7.733 -12.155 -6.755 149 HG2 PRO 20 HG3 PRO 20 9.972 -10.382 -5.866 150 HG3 PRO 20 HG2 PRO 20 8.957 -10.263 -7.315 151 HD2 PRO 20 HD3 PRO 20 8.575 -8.802 -4.999 152 HD3 PRO 20 HD2 PRO 20 7.317 -9.130 -6.206 153 H TRP 21 H TRP 21 8.490 -10.453 -2.580 154 HA TRP 21 HA TRP 21 10.644 -12.300 -1.794 155 HB2 TRP 21 HB3 TRP 21 11.500 -10.317 -0.470 156 HB3 TRP 21 HB2 TRP 21 11.573 -10.152 -2.222 157 HD1 TRP 21 HD1 TRP 21 9.107 -9.149 0.612 158 HE1 TRP 21 HE1 TRP 21 8.152 -6.830 0.036 159 HE3 TRP 21 HE3 TRP 21 11.414 -8.419 -3.890 160 HZ2 TRP 21 HZ2 TRP 21 8.348 -4.942 -2.057 161 HZ3 TRP 21 HZ3 TRP 21 10.976 -6.332 -5.116 162 HH2 TRP 21 HH2 TRP 21 9.474 -4.630 -4.217 163 H HIS 22 H HIS 22 10.907 -12.830 0.413 164 HA HIS 22 HA HIS 22 8.391 -12.730 1.915 165 HB2 HIS 22 HB3 HIS 22 10.322 -14.777 1.448 166 HB3 HIS 22 HB2 HIS 22 10.295 -14.438 3.175 167 HD1 HIS 22 HD1 HIS 22 7.800 -14.540 4.277 168 HD2 HIS 22 HD2 HIS 22 8.321 -16.404 0.600 169 HE1 HIS 22 HE1 HIS 22 5.851 -16.110 4.038 170 HE2 HIS 22 HE2 HIS 22 6.140 -17.162 1.767 171 H LEU 23 H LEU 23 8.558 -10.685 2.827 172 HA LEU 23 HA LEU 23 10.862 -10.147 4.552 173 HB2 LEU 23 HB3 LEU 23 9.195 -8.539 2.909 174 HB3 LEU 23 HB2 LEU 23 8.944 -8.025 4.567 175 HG LEU 23 HG LEU 23 11.510 -7.900 4.717 176 HD11 LEU 23 HD11 LEU 23 11.114 -8.041 1.737 177 HD12 LEU 23 HD12 LEU 23 12.135 -9.069 2.743 178 HD13 LEU 23 HD13 LEU 23 12.556 -7.373 2.502 179 HD21 LEU 23 HD21 LEU 23 9.704 -6.036 3.238 180 HD22 LEU 23 HD22 LEU 23 11.420 -5.661 3.397 181 HD23 LEU 23 HD23 LEU 23 10.425 -5.867 4.839 182 HA PRO 24 HA PRO 24 8.040 -11.788 7.758 183 HB2 PRO 24 HB3 PRO 24 10.009 -11.823 9.686 184 HB3 PRO 24 HB2 PRO 24 9.673 -13.152 8.572 185 HG2 PRO 24 HG3 PRO 24 11.773 -11.030 8.416 186 HG3 PRO 24 HG2 PRO 24 11.892 -12.757 8.032 187 HD2 PRO 24 HD3 PRO 24 11.666 -10.899 6.110 188 HD3 PRO 24 HD2 PRO 24 10.896 -12.492 5.957 189 H ASP 25 H ASP 25 10.432 -9.192 8.209 190 HA ASP 25 HA ASP 25 9.186 -8.032 10.454 191 HB2 ASP 25 HB3 ASP 25 10.576 -6.013 9.756 192 HB3 ASP 25 HB2 ASP 25 11.457 -7.491 10.104 193 H ASP 26 H ASP 26 8.727 -7.649 7.002 194 HA ASP 26 HA ASP 26 7.134 -5.274 7.225 195 HB2 ASP 26 HB3 ASP 26 8.485 -6.200 5.177 196 HB3 ASP 26 HB2 ASP 26 7.005 -7.097 4.851 197 H LEU 27 H LEU 27 6.397 -8.688 6.510 198 HA LEU 27 HA LEU 27 3.633 -8.459 6.327 199 HB2 LEU 27 HB3 LEU 27 5.062 -10.821 7.531 200 HB3 LEU 27 HB2 LEU 27 3.529 -10.817 6.680 201 HG LEU 27 HG LEU 27 5.826 -9.846 5.108 202 HD11 LEU 27 HD11 LEU 27 6.408 -11.988 6.644 203 HD12 LEU 27 HD12 LEU 27 7.082 -11.709 5.038 204 HD13 LEU 27 HD13 LEU 27 5.695 -12.779 5.239 205 HD21 LEU 27 HD21 LEU 27 4.686 -11.612 3.554 206 HD22 LEU 27 HD22 LEU 27 3.920 -10.051 3.852 207 HD23 LEU 27 HD23 LEU 27 3.369 -11.484 4.720 208 H HIS 28 H HIS 28 5.510 -9.503 9.177 209 HA HIS 28 HA HIS 28 3.405 -9.590 10.988 210 HB2 HIS 28 HB3 HIS 28 6.325 -9.522 11.132 211 HB3 HIS 28 HB2 HIS 28 5.553 -8.779 12.529 212 HD1 HIS 28 HD1 HIS 28 3.739 -11.589 10.948 213 HD2 HIS 28 HD2 HIS 28 6.435 -11.017 14.057 214 HE1 HIS 28 HE1 HIS 28 3.681 -13.717 12.288 215 HE2 HIS 28 HE2 HIS 28 5.383 -13.379 14.114 216 H TYR 29 H TYR 29 5.608 -6.891 10.271 217 HA TYR 29 HA TYR 29 4.475 -5.062 12.082 218 HB2 TYR 29 HB3 TYR 29 6.696 -4.793 10.980 219 HB3 TYR 29 HB2 TYR 29 5.866 -4.435 9.469 220 HD1 TYR 29 HD1 TYR 29 5.528 -3.296 13.021 221 HD2 TYR 29 HD2 TYR 29 5.926 -2.200 8.929 222 HE1 TYR 29 HE1 TYR 29 5.424 -0.922 13.653 223 HE2 TYR 29 HE2 TYR 29 5.823 0.177 9.550 224 HH TYR 29 HH TYR 29 6.437 1.485 11.936 225 H PHE 30 H PHE 30 3.585 -6.038 8.855 226 HA PHE 30 HA PHE 30 1.880 -3.891 8.208 227 HB2 PHE 30 HB3 PHE 30 2.769 -5.704 6.653 228 HB3 PHE 30 HB2 PHE 30 1.502 -6.743 7.297 229 HD1 PHE 30 HD2 PHE 30 -0.841 -6.291 6.816 230 HD2 PHE 30 HD1 PHE 30 2.263 -3.895 5.162 231 HE1 PHE 30 HE2 PHE 30 -2.430 -5.368 5.179 232 HE2 PHE 30 HE1 PHE 30 0.679 -2.967 3.524 233 HZ PHE 30 HZ PHE 30 -1.671 -3.704 3.530 234 H ARG 31 H ARG 31 1.006 -7.172 9.313 235 HA ARG 31 HA ARG 31 -1.696 -6.539 9.819 236 HB2 ARG 31 HB3 ARG 31 -0.747 -8.844 9.486 237 HB3 ARG 31 HB2 ARG 31 -0.086 -8.744 11.112 238 HG2 ARG 31 HG3 ARG 31 -2.297 -8.583 12.053 239 HG3 ARG 31 HG2 ARG 31 -3.013 -8.526 10.441 240 HD2 ARG 31 HD3 ARG 31 -3.287 -10.747 11.169 241 HD3 ARG 31 HD2 ARG 31 -1.933 -10.787 10.041 242 HE ARG 31 HE ARG 31 -1.142 -10.467 12.785 243 HH11 ARG 31 HH11 ARG 31 -1.958 -12.770 10.293 244 HH12 ARG 31 HH12 ARG 31 -1.077 -14.067 11.028 245 HH21 ARG 31 HH21 ARG 31 0.018 -12.172 13.754 246 HH22 ARG 31 HH22 ARG 31 0.044 -13.728 12.993 247 H ALA 32 H ALA 32 1.200 -6.376 11.784 248 HA ALA 32 HA ALA 32 -0.088 -6.023 14.286 249 HB1 ALA 32 HB1 ALA 32 2.037 -5.513 15.156 250 HB2 ALA 32 HB2 ALA 32 2.636 -4.961 13.592 251 HB3 ALA 32 HB3 ALA 32 2.333 -6.677 13.864 252 H GLN 33 H GLN 33 1.039 -3.790 11.798 253 HA GLN 33 HA GLN 33 0.365 -1.454 13.351 254 HB2 GLN 33 HB3 GLN 33 1.407 -1.934 10.581 255 HB3 GLN 33 HB2 GLN 33 0.773 -0.353 11.014 256 HG2 GLN 33 HG3 GLN 33 2.608 -1.308 13.018 257 HG3 GLN 33 HG2 GLN 33 3.352 -1.311 11.420 258 HE21 GLN 33 HE21 GLN 33 2.954 0.736 10.144 259 HE22 GLN 33 HE22 GLN 33 3.100 2.225 11.008 260 H THR 34 H THR 34 -1.101 -3.402 10.844 261 HA THR 34 HA THR 34 -3.328 -1.529 10.576 262 HB THR 34 HB THR 34 -4.052 -2.923 8.724 263 HG1 THR 34 HG1 THR 34 -1.862 -4.611 9.334 264 HG21 THR 34 HG21 THR 34 -1.705 -1.486 8.702 265 HG22 THR 34 HG22 THR 34 -2.573 -2.097 7.293 266 HG23 THR 34 HG23 THR 34 -1.254 -3.036 7.993 267 H VAL 35 H VAL 35 -3.116 -2.705 13.095 268 HA VAL 35 HA VAL 35 -5.017 -4.902 13.188 269 HB VAL 35 HB VAL 35 -3.088 -4.981 14.686 270 HG11 VAL 35 HG11 VAL 35 -2.337 -3.117 15.626 271 HG12 VAL 35 HG12 VAL 35 -3.736 -3.140 16.700 272 HG13 VAL 35 HG13 VAL 35 -3.804 -2.247 15.181 273 HG21 VAL 35 HG21 VAL 35 -5.580 -5.702 15.300 274 HG22 VAL 35 HG22 VAL 35 -5.310 -4.536 16.595 275 HG23 VAL 35 HG23 VAL 35 -4.229 -5.917 16.413 276 H GLY 36 H GLY 36 -6.739 -3.539 12.245 277 HA2 GLY 36 HA3 GLY 36 -8.932 -2.954 13.158 278 HA3 GLY 36 HA2 GLY 36 -8.094 -1.993 14.367 279 H LYS 37 H LYS 37 -7.000 -1.954 11.074 280 HA LYS 37 HA LYS 37 -8.136 0.749 10.769 281 HB2 LYS 37 HB3 LYS 37 -5.595 -0.223 9.470 282 HB3 LYS 37 HB2 LYS 37 -6.180 1.430 9.593 283 HG2 LYS 37 HG3 LYS 37 -5.833 0.190 12.194 284 HG3 LYS 37 HG2 LYS 37 -4.344 0.210 11.249 285 HD2 LYS 37 HD3 LYS 37 -4.074 2.327 11.887 286 HD3 LYS 37 HD2 LYS 37 -5.459 2.738 10.874 287 HE2 LYS 37 HE3 LYS 37 -6.108 1.656 13.534 288 HE3 LYS 37 HE2 LYS 37 -5.312 3.229 13.531 289 HZ1 LYS 37 HZ1 LYS 37 -7.825 3.214 13.433 290 HZ2 LYS 37 HZ2 LYS 37 -7.673 2.667 11.840 291 HZ3 LYS 37 HZ3 LYS 37 -7.034 4.169 12.282 292 H ILE 38 H ILE 38 -8.238 1.423 8.396 293 HA ILE 38 HA ILE 38 -9.318 -0.834 6.843 294 HB ILE 38 HB ILE 38 -10.189 1.555 5.638 295 HG12 ILE 38 HG13 ILE 38 -10.909 1.619 8.566 296 HG13 ILE 38 HG12 ILE 38 -9.590 2.579 7.906 297 HG21 ILE 38 HG21 ILE 38 -11.637 -0.426 7.383 298 HG22 ILE 38 HG22 ILE 38 -11.417 -0.516 5.636 299 HG23 ILE 38 HG23 ILE 38 -12.419 0.757 6.336 300 HD11 ILE 38 HD11 ILE 38 -12.520 2.838 7.462 301 HD12 ILE 38 HD12 ILE 38 -11.392 3.416 6.235 302 HD13 ILE 38 HD13 ILE 38 -11.328 4.072 7.872 303 H MET 39 H MET 39 -8.014 -1.494 5.289 304 HA MET 39 HA MET 39 -6.220 0.449 4.008 305 HB2 MET 39 HB3 MET 39 -4.917 -1.298 4.857 306 HB3 MET 39 HB2 MET 39 -6.093 -2.523 4.409 307 HG2 MET 39 HG3 MET 39 -4.765 -0.972 2.249 308 HG3 MET 39 HG2 MET 39 -3.843 -2.218 3.089 309 HE1 MET 39 HE1 MET 39 -6.788 -4.624 3.244 310 HE2 MET 39 HE2 MET 39 -5.162 -4.282 3.837 311 HE3 MET 39 HE3 MET 39 -5.394 -5.411 2.502 312 H VAL 40 H VAL 40 -6.431 0.972 1.920 313 HA VAL 40 HA VAL 40 -8.662 -0.152 0.430 314 HB VAL 40 HB VAL 40 -6.802 2.058 -0.440 315 HG11 VAL 40 HG11 VAL 40 -8.591 0.705 -1.929 316 HG12 VAL 40 HG12 VAL 40 -8.182 2.401 -2.192 317 HG13 VAL 40 HG13 VAL 40 -9.627 1.974 -1.276 318 HG21 VAL 40 HG21 VAL 40 -7.632 3.152 1.351 319 HG22 VAL 40 HG22 VAL 40 -9.001 2.054 1.521 320 HG23 VAL 40 HG23 VAL 40 -9.051 3.346 0.322 321 H VAL 41 H VAL 41 -8.470 -1.615 -1.142 322 HA VAL 41 HA VAL 41 -5.808 -2.042 -2.320 323 HB VAL 41 HB VAL 41 -6.804 -3.802 -0.607 324 HG11 VAL 41 HG11 VAL 41 -8.894 -4.125 -1.883 325 HG12 VAL 41 HG12 VAL 41 -7.981 -5.618 -1.668 326 HG13 VAL 41 HG13 VAL 41 -7.947 -4.780 -3.219 327 HG21 VAL 41 HG21 VAL 41 -5.050 -3.988 -2.932 328 HG22 VAL 41 HG22 VAL 41 -5.687 -5.542 -2.391 329 HG23 VAL 41 HG23 VAL 41 -4.794 -4.516 -1.269 330 H GLY 42 H GLY 42 -5.708 -2.531 -4.500 331 HA2 GLY 42 HA3 GLY 42 -7.867 -1.583 -6.104 332 HA3 GLY 42 HA2 GLY 42 -6.373 -2.296 -6.695 333 H ARG 43 H ARG 43 -8.701 -2.842 -8.013 334 HA ARG 43 HA ARG 43 -10.135 -5.056 -7.126 335 HB2 ARG 43 HB3 ARG 43 -10.394 -5.416 -9.723 336 HB3 ARG 43 HB2 ARG 43 -11.185 -4.082 -8.906 337 HG2 ARG 43 HG3 ARG 43 -9.920 -2.528 -9.937 338 HG3 ARG 43 HG2 ARG 43 -8.478 -3.543 -9.945 339 HD2 ARG 43 HD3 ARG 43 -9.158 -3.286 -12.207 340 HD3 ARG 43 HD2 ARG 43 -9.587 -4.926 -11.724 341 HE ARG 43 HE ARG 43 -11.722 -3.056 -11.356 342 HH11 ARG 43 HH11 ARG 43 -10.127 -5.114 -13.679 343 HH12 ARG 43 HH12 ARG 43 -11.528 -5.279 -14.683 344 HH21 ARG 43 HH21 ARG 43 -13.568 -3.274 -12.675 345 HH22 ARG 43 HH22 ARG 43 -13.481 -4.234 -14.114 346 H ARG 44 H ARG 44 -7.527 -5.041 -9.568 347 HA ARG 44 HA ARG 44 -7.222 -7.795 -9.765 348 HB2 ARG 44 HB3 ARG 44 -5.150 -5.615 -10.080 349 HB3 ARG 44 HB2 ARG 44 -4.920 -7.285 -10.581 350 HG2 ARG 44 HG3 ARG 44 -7.008 -5.397 -11.652 351 HG3 ARG 44 HG2 ARG 44 -5.511 -5.860 -12.463 352 HD2 ARG 44 HD3 ARG 44 -6.752 -7.456 -13.425 353 HD3 ARG 44 HD2 ARG 44 -6.610 -8.289 -11.878 354 HE ARG 44 HE ARG 44 -8.779 -6.736 -11.512 355 HH11 ARG 44 HH11 ARG 44 -7.879 -8.964 -14.044 356 HH12 ARG 44 HH12 ARG 44 -9.514 -9.392 -14.419 357 HH21 ARG 44 HH21 ARG 44 -10.929 -7.299 -12.004 358 HH22 ARG 44 HH22 ARG 44 -11.246 -8.447 -13.262 359 H THR 45 H THR 45 -6.283 -5.623 -7.263 360 HA THR 45 HA THR 45 -4.226 -7.202 -6.110 361 HB THR 45 HB THR 45 -5.787 -5.403 -4.358 362 HG1 THR 45 HG1 THR 45 -4.530 -4.537 -6.731 363 HG21 THR 45 HG21 THR 45 -2.934 -6.010 -4.890 364 HG22 THR 45 HG22 THR 45 -3.801 -5.882 -3.360 365 HG23 THR 45 HG23 THR 45 -3.351 -4.423 -4.244 366 H TYR 46 H TYR 46 -7.645 -6.682 -5.136 367 HA TYR 46 HA TYR 46 -7.697 -8.389 -2.980 368 HB2 TYR 46 HB3 TYR 46 -10.089 -8.553 -3.236 369 HB3 TYR 46 HB2 TYR 46 -9.592 -6.923 -3.660 370 HD1 TYR 46 HD2 TYR 46 -10.098 -10.205 -5.411 371 HD2 TYR 46 HD1 TYR 46 -10.684 -5.988 -5.464 372 HE1 TYR 46 HE2 TYR 46 -11.272 -10.399 -7.548 373 HE2 TYR 46 HE1 TYR 46 -11.880 -6.184 -7.599 374 HH TYR 46 HH TYR 46 -11.993 -7.750 -9.513 375 H GLU 47 H GLU 47 -7.918 -9.207 -6.400 376 HA GLU 47 HA GLU 47 -8.355 -12.010 -5.844 377 HB2 GLU 47 HB3 GLU 47 -8.557 -10.274 -8.125 378 HB3 GLU 47 HB2 GLU 47 -7.560 -11.664 -8.535 379 HG2 GLU 47 HG3 GLU 47 -9.283 -13.179 -8.041 380 HG3 GLU 47 HG2 GLU 47 -10.228 -11.948 -7.206 381 H SER 48 H SER 48 -5.690 -9.891 -6.377 382 HA SER 48 HA SER 48 -3.862 -12.151 -6.774 383 HB2 SER 48 HB3 SER 48 -2.276 -10.632 -7.619 384 HB3 SER 48 HB2 SER 48 -3.814 -10.041 -8.247 385 HG SER 48 HG SER 48 -2.712 -8.305 -7.402 386 H PHE 49 H PHE 49 -5.184 -11.262 -4.170 387 HA PHE 49 HA PHE 49 -2.728 -10.796 -2.617 388 HB2 PHE 49 HB3 PHE 49 -5.053 -9.371 -2.531 389 HB3 PHE 49 HB2 PHE 49 -5.314 -10.526 -1.230 390 HD1 PHE 49 HD1 PHE 49 -2.781 -8.108 -2.500 391 HD2 PHE 49 HD2 PHE 49 -4.467 -10.087 0.870 392 HE1 PHE 49 HE1 PHE 49 -1.393 -6.735 -1.003 393 HE2 PHE 49 HE2 PHE 49 -3.083 -8.717 2.372 394 HZ PHE 49 HZ PHE 49 -1.543 -7.038 1.436 395 HA PRO 50 HA PRO 50 -3.233 -14.915 -1.035 396 HB2 PRO 50 HB3 PRO 50 -1.368 -14.876 0.886 397 HB3 PRO 50 HB2 PRO 50 -0.931 -14.813 -0.826 398 HG2 PRO 50 HG3 PRO 50 -1.089 -12.593 1.172 399 HG3 PRO 50 HG2 PRO 50 0.134 -12.891 -0.076 400 HD2 PRO 50 HD3 PRO 50 -1.941 -11.104 -0.338 401 HD3 PRO 50 HD2 PRO 50 -1.110 -11.875 -1.702 402 H LYS 51 H LYS 51 -3.808 -12.083 0.855 403 HA LYS 51 HA LYS 51 -5.320 -13.706 2.791 404 HB2 LYS 51 HB3 LYS 51 -3.366 -11.503 3.286 405 HB3 LYS 51 HB2 LYS 51 -4.753 -11.648 4.357 406 HG2 LYS 51 HG3 LYS 51 -2.741 -13.820 3.801 407 HG3 LYS 51 HG2 LYS 51 -2.783 -12.796 5.238 408 HD2 LYS 51 HD3 LYS 51 -5.129 -13.656 5.625 409 HD3 LYS 51 HD2 LYS 51 -4.808 -14.845 4.361 410 HE2 LYS 51 HE3 LYS 51 -2.610 -15.134 5.930 411 HE3 LYS 51 HE2 LYS 51 -3.830 -14.710 7.130 412 HZ1 LYS 51 HZ1 LYS 51 -3.593 -17.100 5.486 413 HZ2 LYS 51 HZ2 LYS 51 -5.163 -16.521 5.736 414 HZ3 LYS 51 HZ3 LYS 51 -4.189 -16.922 7.060 415 H ARG 52 H ARG 52 -7.127 -13.293 1.376 416 HA ARG 52 HA ARG 52 -8.199 -10.565 1.670 417 HB2 ARG 52 HB3 ARG 52 -9.525 -11.124 -0.429 418 HB3 ARG 52 HB2 ARG 52 -7.802 -10.843 -0.635 419 HG2 ARG 52 HG3 ARG 52 -7.408 -12.943 -1.315 420 HG3 ARG 52 HG2 ARG 52 -8.543 -13.641 -0.158 421 HD2 ARG 52 HD3 ARG 52 -10.365 -12.634 -1.679 422 HD3 ARG 52 HD2 ARG 52 -9.081 -12.502 -2.878 423 HE ARG 52 HE ARG 52 -9.348 -15.118 -1.695 424 HH11 ARG 52 HH11 ARG 52 -10.372 -13.001 -4.276 425 HH12 ARG 52 HH12 ARG 52 -10.840 -14.299 -5.321 426 HH21 ARG 52 HH21 ARG 52 -9.964 -16.824 -3.070 427 HH22 ARG 52 HH22 ARG 52 -10.610 -16.468 -4.638 428 HA PRO 53 HA PRO 53 -9.123 -9.683 2.916 429 HB2 PRO 53 HB3 PRO 53 -10.441 -9.140 5.174 430 HB3 PRO 53 HB2 PRO 53 -11.240 -9.053 3.600 431 HG2 PRO 53 HG3 PRO 53 -11.453 -11.122 5.720 432 HG3 PRO 53 HG2 PRO 53 -12.673 -10.562 4.565 433 HD2 PRO 53 HD3 PRO 53 -11.083 -12.889 4.357 434 HD3 PRO 53 HD2 PRO 53 -12.120 -12.194 3.097 435 H LEU 54 H LEU 54 -7.715 -8.835 4.559 436 HA LEU 54 HA LEU 54 -6.053 -10.798 5.757 437 HB2 LEU 54 HB3 LEU 54 -6.142 -7.798 5.915 438 HB3 LEU 54 HB2 LEU 54 -4.979 -8.737 6.832 439 HG LEU 54 HG LEU 54 -4.783 -9.658 4.180 440 HD11 LEU 54 HD11 LEU 54 -4.040 -7.236 3.323 441 HD12 LEU 54 HD12 LEU 54 -5.402 -6.775 4.344 442 HD13 LEU 54 HD13 LEU 54 -5.638 -7.917 3.021 443 HD21 LEU 54 HD21 LEU 54 -2.583 -9.295 4.525 444 HD22 LEU 54 HD22 LEU 54 -3.108 -9.041 6.189 445 HD23 LEU 54 HD23 LEU 54 -2.835 -7.658 5.129 446 HA PRO 55 HA PRO 55 -8.134 -11.288 9.633 447 HB2 PRO 55 HB3 PRO 55 -5.588 -12.061 10.843 448 HB3 PRO 55 HB2 PRO 55 -7.015 -13.045 10.517 449 HG2 PRO 55 HG3 PRO 55 -4.703 -13.340 9.148 450 HG3 PRO 55 HG2 PRO 55 -6.291 -13.637 8.419 451 HD2 PRO 55 HD3 PRO 55 -4.508 -11.243 8.168 452 HD3 PRO 55 HD2 PRO 55 -5.465 -12.073 6.923 453 H GLU 56 H GLU 56 -8.315 -10.451 11.710 454 HA GLU 56 HA GLU 56 -8.337 -8.741 13.208 455 HB2 GLU 56 HB3 GLU 56 -5.589 -9.743 13.001 456 HB3 GLU 56 HB2 GLU 56 -5.714 -8.143 13.718 457 HG2 GLU 56 HG3 GLU 56 -5.918 -9.398 15.590 458 HG3 GLU 56 HG2 GLU 56 -7.617 -9.313 15.125 459 H ARG 57 H ARG 57 -8.338 -7.889 10.372 460 HA ARG 57 HA ARG 57 -7.715 -5.110 10.898 461 HB2 ARG 57 HB3 ARG 57 -6.211 -4.741 9.147 462 HB3 ARG 57 HB2 ARG 57 -5.647 -6.229 9.885 463 HG2 ARG 57 HG3 ARG 57 -5.509 -6.753 7.662 464 HG3 ARG 57 HG2 ARG 57 -7.113 -7.370 8.058 465 HD2 ARG 57 HD3 ARG 57 -6.768 -5.927 5.918 466 HD3 ARG 57 HD2 ARG 57 -8.191 -5.677 6.923 467 HE ARG 57 HE ARG 57 -7.424 -3.583 7.430 468 HH11 ARG 57 HH11 ARG 57 -4.809 -5.433 6.044 469 HH12 ARG 57 HH12 ARG 57 -3.745 -4.073 5.925 470 HH21 ARG 57 HH21 ARG 57 -6.028 -1.794 7.271 471 HH22 ARG 57 HH22 ARG 57 -4.436 -2.007 6.624 472 H THR 58 H THR 58 -8.547 -3.654 9.206 473 HA THR 58 HA THR 58 -11.004 -4.768 8.052 474 HB THR 58 HB THR 58 -10.473 -1.836 8.080 475 HG1 THR 58 HG1 THR 58 -10.358 -1.717 10.155 476 HG21 THR 58 HG21 THR 58 -12.604 -2.846 7.233 477 HG22 THR 58 HG22 THR 58 -12.786 -1.624 8.491 478 HG23 THR 58 HG23 THR 58 -12.942 -3.334 8.894 479 H ASN 59 H ASN 59 -11.063 -5.163 5.939 480 HA ASN 59 HA ASN 59 -9.009 -3.955 4.236 481 HB2 ASN 59 HB3 ASN 59 -10.823 -6.319 3.736 482 HB3 ASN 59 HB2 ASN 59 -9.585 -5.736 2.627 483 HD21 ASN 59 HD21 ASN 59 -10.095 -7.017 5.866 484 HD22 ASN 59 HD22 ASN 59 -8.545 -7.765 6.011 485 H VAL 60 H VAL 60 -9.513 -3.162 2.163 486 HA VAL 60 HA VAL 60 -12.309 -2.454 1.659 487 HB VAL 60 HB VAL 60 -10.012 -0.487 1.666 488 HG11 VAL 60 HG11 VAL 60 -12.616 -0.440 0.290 489 HG12 VAL 60 HG12 VAL 60 -11.115 0.405 -0.088 490 HG13 VAL 60 HG13 VAL 60 -12.185 1.028 1.167 491 HG21 VAL 60 HG21 VAL 60 -11.620 -1.234 3.740 492 HG22 VAL 60 HG22 VAL 60 -12.479 0.164 3.094 493 HG23 VAL 60 HG23 VAL 60 -10.797 0.319 3.602 494 H VAL 61 H VAL 61 -12.852 -2.843 -0.396 495 HA VAL 61 HA VAL 61 -10.695 -3.406 -2.305 496 HB VAL 61 HB VAL 61 -13.587 -4.277 -2.298 497 HG11 VAL 61 HG11 VAL 61 -12.174 -5.795 -4.162 498 HG12 VAL 61 HG12 VAL 61 -11.688 -4.127 -4.465 499 HG13 VAL 61 HG13 VAL 61 -13.396 -4.568 -4.494 500 HG21 VAL 61 HG21 VAL 61 -12.668 -6.511 -1.952 501 HG22 VAL 61 HG22 VAL 61 -12.186 -5.416 -0.656 502 HG23 VAL 61 HG23 VAL 61 -11.037 -5.841 -1.925 503 H LEU 62 H LEU 62 -10.484 -2.313 -4.162 504 HA LEU 62 HA LEU 62 -12.521 -0.283 -4.797 505 HB2 LEU 62 HB3 LEU 62 -10.243 0.522 -3.921 506 HB3 LEU 62 HB2 LEU 62 -9.601 -0.010 -5.463 507 HG LEU 62 HG LEU 62 -11.352 1.527 -6.533 508 HD11 LEU 62 HD11 LEU 62 -12.773 2.589 -5.205 509 HD12 LEU 62 HD12 LEU 62 -11.418 3.428 -4.446 510 HD13 LEU 62 HD13 LEU 62 -11.993 1.899 -3.781 511 HD21 LEU 62 HD21 LEU 62 -9.891 3.428 -6.395 512 HD22 LEU 62 HD22 LEU 62 -8.912 1.962 -6.427 513 HD23 LEU 62 HD23 LEU 62 -9.168 2.818 -4.906 514 H THR 63 H THR 63 -13.625 -1.375 -6.357 515 HA THR 63 HA THR 63 -12.106 -2.084 -8.772 516 HB THR 63 HB THR 63 -12.810 -4.127 -7.566 517 HG1 THR 63 HG1 THR 63 -13.242 -5.042 -9.408 518 HG21 THR 63 HG21 THR 63 -15.286 -2.732 -7.286 519 HG22 THR 63 HG22 THR 63 -14.778 -4.265 -6.577 520 HG23 THR 63 HG23 THR 63 -15.548 -4.239 -8.163 521 H HIS 64 H HIS 64 -13.185 -1.749 -10.759 522 HA HIS 64 HA HIS 64 -14.890 0.517 -10.788 523 HB2 HIS 64 HB3 HIS 64 -14.051 -1.379 -12.984 524 HB3 HIS 64 HB2 HIS 64 -14.991 0.084 -13.260 525 HD1 HIS 64 HD1 HIS 64 -13.756 2.375 -12.747 526 HD2 HIS 64 HD2 HIS 64 -11.338 -1.005 -12.735 527 HE1 HIS 64 HE1 HIS 64 -11.397 3.235 -12.891 528 HE2 HIS 64 HE2 HIS 64 -9.957 1.170 -12.965 529 H GLN 65 H GLN 65 -15.448 -2.928 -11.172 530 HA GLN 65 HA GLN 65 -17.942 -3.053 -12.248 531 HB2 GLN 65 HB3 GLN 65 -16.584 -4.684 -10.142 532 HB3 GLN 65 HB2 GLN 65 -18.269 -5.009 -10.524 533 HG2 GLN 65 HG3 GLN 65 -17.786 -5.905 -12.533 534 HG3 GLN 65 HG2 GLN 65 -16.441 -4.803 -12.825 535 HE21 GLN 65 HE21 GLN 65 -14.488 -5.196 -11.470 536 HE22 GLN 65 HE22 GLN 65 -14.044 -6.839 -11.169 537 H GLU 66 H GLU 66 -19.941 -2.466 -11.719 538 HA GLU 66 HA GLU 66 -20.351 -0.951 -9.292 539 HB2 GLU 66 HB3 GLU 66 -22.532 -0.410 -10.225 540 HB3 GLU 66 HB2 GLU 66 -21.278 -0.167 -11.434 541 HG2 GLU 66 HG3 GLU 66 -21.861 -2.230 -12.524 542 HG3 GLU 66 HG2 GLU 66 -23.025 -2.610 -11.256 543 H ASP 67 H ASP 67 -21.420 -3.995 -10.691 544 HA ASP 67 HA ASP 67 -23.079 -4.557 -8.365 545 HB2 ASP 67 HB3 ASP 67 -23.423 -5.128 -11.005 546 HB3 ASP 67 HB2 ASP 67 -22.772 -6.653 -10.410 547 H TYR 68 H TYR 68 -19.962 -4.602 -8.461 548 HA TYR 68 HA TYR 68 -19.276 -7.334 -8.012 549 HB2 TYR 68 HB3 TYR 68 -17.696 -5.417 -8.655 550 HB3 TYR 68 HB2 TYR 68 -17.722 -4.983 -6.949 551 HD1 TYR 68 HD1 TYR 68 -17.328 -8.101 -8.981 552 HD2 TYR 68 HD2 TYR 68 -15.936 -5.755 -5.716 553 HE1 TYR 68 HE1 TYR 68 -15.581 -9.771 -8.534 554 HE2 TYR 68 HE2 TYR 68 -14.183 -7.419 -5.261 555 HH TYR 68 HH TYR 68 -13.793 -9.840 -5.679 556 H GLN 69 H GLN 69 -18.808 -8.383 -6.052 557 HA GLN 69 HA GLN 69 -19.859 -7.079 -3.633 558 HB2 GLN 69 HB3 GLN 69 -20.486 -9.835 -4.676 559 HB3 GLN 69 HB2 GLN 69 -20.722 -9.397 -2.990 560 HG2 GLN 69 HG3 GLN 69 -22.026 -8.058 -5.349 561 HG3 GLN 69 HG2 GLN 69 -22.787 -9.230 -4.274 562 HE21 GLN 69 HE21 GLN 69 -21.648 -5.975 -4.628 563 HE22 GLN 69 HE22 GLN 69 -22.380 -5.342 -3.197 564 H ALA 70 H ALA 70 -18.188 -6.849 -2.310 565 HA ALA 70 HA ALA 70 -16.197 -9.012 -2.147 566 HB1 ALA 70 HB1 ALA 70 -14.560 -7.455 -1.600 567 HB2 ALA 70 HB2 ALA 70 -15.739 -6.247 -1.089 568 HB3 ALA 70 HB3 ALA 70 -15.530 -6.605 -2.803 569 H GLN 71 H GLN 71 -17.093 -10.330 -0.619 570 HA GLN 71 HA GLN 71 -18.302 -9.365 1.774 571 HB2 GLN 71 HB3 GLN 71 -17.230 -12.149 1.355 572 HB3 GLN 71 HB2 GLN 71 -18.558 -11.641 2.389 573 HG2 GLN 71 HG3 GLN 71 -20.011 -11.980 0.761 574 HG3 GLN 71 HG2 GLN 71 -19.129 -10.887 -0.303 575 HE21 GLN 71 HE21 GLN 71 -18.793 -11.835 -2.175 576 HE22 GLN 71 HE22 GLN 71 -18.293 -13.471 -2.416 577 H GLY 72 H GLY 72 -17.370 -8.741 3.603 578 HA2 GLY 72 HA3 GLY 72 -15.833 -9.102 5.404 579 HA3 GLY 72 HA2 GLY 72 -14.693 -9.772 4.248 580 H ALA 73 H ALA 73 -15.309 -7.470 2.372 581 HA ALA 73 HA ALA 73 -13.850 -5.371 3.840 582 HB1 ALA 73 HB1 ALA 73 -13.170 -5.278 1.073 583 HB2 ALA 73 HB2 ALA 73 -12.904 -6.916 1.670 584 HB3 ALA 73 HB3 ALA 73 -12.121 -5.550 2.464 585 H VAL 74 H VAL 74 -13.922 -3.235 2.638 586 HA VAL 74 HA VAL 74 -16.691 -2.640 2.025 587 HB VAL 74 HB VAL 74 -14.357 -0.725 2.024 588 HG11 VAL 74 HG11 VAL 74 -16.858 -0.306 1.108 589 HG12 VAL 74 HG12 VAL 74 -15.848 0.952 1.819 590 HG13 VAL 74 HG13 VAL 74 -17.063 0.136 2.803 591 HG21 VAL 74 HG21 VAL 74 -15.259 -2.193 4.205 592 HG22 VAL 74 HG22 VAL 74 -16.045 -0.623 4.374 593 HG23 VAL 74 HG23 VAL 74 -14.289 -0.721 4.251 594 H VAL 75 H VAL 75 -17.523 -2.202 0.049 595 HA VAL 75 HA VAL 75 -15.666 -2.371 -2.225 596 HB VAL 75 HB VAL 75 -18.647 -2.837 -2.243 597 HG11 VAL 75 HG11 VAL 75 -16.996 -4.006 -4.353 598 HG12 VAL 75 HG12 VAL 75 -17.002 -2.242 -4.350 599 HG13 VAL 75 HG13 VAL 75 -18.523 -3.129 -4.460 600 HG21 VAL 75 HG21 VAL 75 -18.333 -4.991 -1.713 601 HG22 VAL 75 HG22 VAL 75 -16.785 -4.454 -1.062 602 HG23 VAL 75 HG23 VAL 75 -16.873 -5.118 -2.694 603 H VAL 76 H VAL 76 -15.494 -0.820 -3.690 604 HA VAL 76 HA VAL 76 -17.489 1.217 -4.067 605 HB VAL 76 HB VAL 76 -16.053 3.131 -3.592 606 HG11 VAL 76 HG11 VAL 76 -16.110 1.378 -1.148 607 HG12 VAL 76 HG12 VAL 76 -17.554 2.120 -1.837 608 HG13 VAL 76 HG13 VAL 76 -16.244 3.134 -1.233 609 HG21 VAL 76 HG21 VAL 76 -14.055 1.869 -1.963 610 HG22 VAL 76 HG22 VAL 76 -13.856 2.967 -3.328 611 HG23 VAL 76 HG23 VAL 76 -13.987 1.231 -3.606 612 H HIS 77 H HIS 77 -16.762 2.769 -5.839 613 HA HIS 77 HA HIS 77 -14.773 1.485 -7.587 614 HB2 HIS 77 HB3 HIS 77 -17.111 2.692 -8.937 615 HB3 HIS 77 HB2 HIS 77 -16.193 1.246 -9.343 616 HD1 HIS 77 HD1 HIS 77 -16.634 -0.609 -7.092 617 HD2 HIS 77 HD2 HIS 77 -19.646 1.909 -8.454 618 HE1 HIS 77 HE1 HIS 77 -18.785 -1.663 -6.330 619 HE2 HIS 77 HE2 HIS 77 -20.598 -0.166 -7.236 620 H ASP 78 H ASP 78 -15.846 4.359 -6.163 621 HA ASP 78 HA ASP 78 -14.306 5.930 -8.124 622 HB2 ASP 78 HB3 ASP 78 -16.779 6.632 -6.563 623 HB3 ASP 78 HB2 ASP 78 -15.717 7.885 -7.199 624 H VAL 79 H VAL 79 -12.911 7.531 -7.360 625 HA VAL 79 HA VAL 79 -11.561 6.965 -4.970 626 HB VAL 79 HB VAL 79 -10.557 9.313 -5.403 627 HG11 VAL 79 HG11 VAL 79 -9.981 7.644 -7.746 628 HG12 VAL 79 HG12 VAL 79 -9.868 6.824 -6.188 629 HG13 VAL 79 HG13 VAL 79 -8.899 8.265 -6.499 630 HG21 VAL 79 HG21 VAL 79 -11.280 9.115 -8.212 631 HG22 VAL 79 HG22 VAL 79 -11.217 10.526 -7.156 632 HG23 VAL 79 HG23 VAL 79 -12.650 9.499 -7.171 633 H ALA 80 H ALA 80 -14.036 9.311 -5.797 634 HA ALA 80 HA ALA 80 -13.894 10.719 -3.306 635 HB1 ALA 80 HB1 ALA 80 -14.740 11.689 -5.463 636 HB2 ALA 80 HB2 ALA 80 -15.787 11.948 -4.068 637 HB3 ALA 80 HB3 ALA 80 -16.191 10.709 -5.255 638 H ALA 81 H ALA 81 -15.854 8.122 -4.645 639 HA ALA 81 HA ALA 81 -17.856 7.921 -2.751 640 HB1 ALA 81 HB1 ALA 81 -18.267 6.439 -4.408 641 HB2 ALA 81 HB2 ALA 81 -17.458 5.319 -3.310 642 HB3 ALA 81 HB3 ALA 81 -16.560 6.057 -4.636 643 H VAL 82 H VAL 82 -14.801 6.071 -2.754 644 HA VAL 82 HA VAL 82 -15.100 4.904 -0.253 645 HB VAL 82 HB VAL 82 -13.365 4.414 -2.084 646 HG11 VAL 82 HG11 VAL 82 -11.729 6.391 -0.517 647 HG12 VAL 82 HG12 VAL 82 -12.454 6.740 -2.087 648 HG13 VAL 82 HG13 VAL 82 -11.240 5.471 -1.940 649 HG21 VAL 82 HG21 VAL 82 -13.510 3.263 0.103 650 HG22 VAL 82 HG22 VAL 82 -12.394 4.458 0.765 651 HG23 VAL 82 HG23 VAL 82 -11.864 3.374 -0.521 652 H PHE 83 H PHE 83 -13.617 8.009 -1.130 653 HA PHE 83 HA PHE 83 -12.500 8.695 1.302 654 HB2 PHE 83 HB3 PHE 83 -13.409 10.141 -1.081 655 HB3 PHE 83 HB2 PHE 83 -13.474 11.108 0.388 656 HD1 PHE 83 HD2 PHE 83 -11.241 10.611 1.923 657 HD2 PHE 83 HD1 PHE 83 -11.519 10.457 -2.320 658 HE1 PHE 83 HE2 PHE 83 -8.822 11.033 1.754 659 HE2 PHE 83 HE1 PHE 83 -9.101 10.877 -2.498 660 HZ PHE 83 HZ PHE 83 -7.750 11.166 -0.459 661 H ALA 84 H ALA 84 -15.836 9.264 0.201 662 HA ALA 84 HA ALA 84 -16.758 10.604 2.470 663 HB1 ALA 84 HB1 ALA 84 -18.077 10.451 0.425 664 HB2 ALA 84 HB2 ALA 84 -19.003 9.848 1.800 665 HB3 ALA 84 HB3 ALA 84 -18.272 8.715 0.663 666 H TYR 85 H TYR 85 -16.601 7.165 1.724 667 HA TYR 85 HA TYR 85 -17.793 6.200 4.066 668 HB2 TYR 85 HB3 TYR 85 -17.438 4.248 3.026 669 HB3 TYR 85 HB2 TYR 85 -16.477 5.086 1.818 670 HD1 TYR 85 HD1 TYR 85 -16.144 3.611 5.238 671 HD2 TYR 85 HD2 TYR 85 -14.295 4.432 1.500 672 HE1 TYR 85 HE1 TYR 85 -14.156 2.349 5.950 673 HE2 TYR 85 HE2 TYR 85 -12.301 3.171 2.202 674 HH TYR 85 HH TYR 85 -11.209 2.409 4.169 675 H ALA 86 H ALA 86 -14.279 6.450 3.356 676 HA ALA 86 HA ALA 86 -13.284 5.886 5.828 677 HB1 ALA 86 HB1 ALA 86 -12.341 7.647 3.624 678 HB2 ALA 86 HB2 ALA 86 -11.636 6.163 4.265 679 HB3 ALA 86 HB3 ALA 86 -11.476 7.674 5.160 680 H LYS 87 H LYS 87 -14.997 8.762 4.892 681 HA LYS 87 HA LYS 87 -14.139 10.349 7.122 682 HB2 LYS 87 HB3 LYS 87 -15.504 10.862 4.773 683 HB3 LYS 87 HB2 LYS 87 -16.760 11.016 5.994 684 HG2 LYS 87 HG3 LYS 87 -16.031 13.133 6.107 685 HG3 LYS 87 HG2 LYS 87 -14.786 12.443 7.150 686 HD2 LYS 87 HD3 LYS 87 -13.794 12.060 4.594 687 HD3 LYS 87 HD2 LYS 87 -14.552 13.651 4.516 688 HE2 LYS 87 HE3 LYS 87 -12.623 14.401 5.371 689 HE3 LYS 87 HE2 LYS 87 -13.229 13.771 6.901 690 HZ1 LYS 87 HZ1 LYS 87 -11.820 11.906 5.153 691 HZ2 LYS 87 HZ2 LYS 87 -11.825 12.012 6.841 692 HZ3 LYS 87 HZ3 LYS 87 -10.888 13.085 5.929 693 H GLN 88 H GLN 88 -16.984 8.429 6.329 694 HA GLN 88 HA GLN 88 -18.466 8.878 8.651 695 HB2 GLN 88 HB3 GLN 88 -18.836 7.433 6.356 696 HB3 GLN 88 HB2 GLN 88 -18.676 6.157 7.556 697 HG2 GLN 88 HG3 GLN 88 -20.675 6.582 8.448 698 HG3 GLN 88 HG2 GLN 88 -20.442 8.329 8.381 699 HE21 GLN 88 HE21 GLN 88 -21.562 9.437 6.933 700 HE22 GLN 88 HE22 GLN 88 -22.432 8.763 5.601 701 H HIS 89 H HIS 89 -15.606 7.032 8.185 702 HA HIS 89 HA HIS 89 -15.988 5.661 10.755 703 HB2 HIS 89 HB3 HIS 89 -14.500 5.029 8.274 704 HB3 HIS 89 HB2 HIS 89 -13.723 4.564 9.784 705 HD1 HIS 89 HD1 HIS 89 -16.252 3.676 11.346 706 HD2 HIS 89 HD2 HIS 89 -15.388 2.595 7.430 707 HE1 HIS 89 HE1 HIS 89 -17.527 1.547 10.940 708 HE2 HIS 89 HE2 HIS 89 -17.062 0.962 8.534 709 HA PRO 90 HA PRO 90 -13.007 9.128 11.654 710 HB2 PRO 90 HB3 PRO 90 -14.093 9.795 14.049 711 HB3 PRO 90 HB2 PRO 90 -14.677 10.452 12.515 712 HG2 PRO 90 HG3 PRO 90 -15.780 8.199 14.152 713 HG3 PRO 90 HG2 PRO 90 -16.643 9.521 13.344 714 HD2 PRO 90 HD3 PRO 90 -16.479 7.040 12.283 715 HD3 PRO 90 HD2 PRO 90 -16.529 8.502 11.278 716 H ASP 91 H ASP 91 -13.894 6.156 13.062 717 HA ASP 91 HA ASP 91 -11.843 6.309 15.137 718 HB2 ASP 91 HB3 ASP 91 -14.244 5.264 15.367 719 HB3 ASP 91 HB2 ASP 91 -13.485 3.858 14.627 720 H GLN 92 H GLN 92 -11.728 5.786 11.969 721 HA GLN 92 HA GLN 92 -9.458 3.965 12.216 722 HB2 GLN 92 HB3 GLN 92 -11.745 3.569 10.280 723 HB3 GLN 92 HB2 GLN 92 -10.212 2.712 10.193 724 HG2 GLN 92 HG3 GLN 92 -10.639 1.495 12.123 725 HG3 GLN 92 HG2 GLN 92 -11.873 2.624 12.678 726 HE21 GLN 92 HE21 GLN 92 -11.313 -0.307 11.209 727 HE22 GLN 92 HE22 GLN 92 -12.885 -0.585 10.549 728 H GLU 93 H GLU 93 -7.938 4.124 10.500 729 HA GLU 93 HA GLU 93 -8.144 6.657 9.022 730 HB2 GLU 93 HB3 GLU 93 -6.069 5.520 10.595 731 HB3 GLU 93 HB2 GLU 93 -5.501 5.564 8.932 732 HG2 GLU 93 HG3 GLU 93 -5.264 7.777 8.952 733 HG3 GLU 93 HG2 GLU 93 -6.811 8.028 9.759 734 H LEU 94 H LEU 94 -7.154 6.712 6.857 735 HA LEU 94 HA LEU 94 -7.763 4.234 5.413 736 HB2 LEU 94 HB3 LEU 94 -8.615 6.765 4.946 737 HB3 LEU 94 HB2 LEU 94 -7.210 6.707 3.899 738 HG LEU 94 HG LEU 94 -8.124 4.790 2.714 739 HD11 LEU 94 HD11 LEU 94 -10.019 4.808 4.969 740 HD12 LEU 94 HD12 LEU 94 -9.402 3.463 4.011 741 HD13 LEU 94 HD13 LEU 94 -10.710 4.465 3.383 742 HD21 LEU 94 HD21 LEU 94 -10.365 5.961 2.002 743 HD22 LEU 94 HD22 LEU 94 -8.803 6.687 1.623 744 HD23 LEU 94 HD23 LEU 94 -9.739 7.276 2.996 745 H VAL 95 H VAL 95 -6.202 3.049 4.531 746 HA VAL 95 HA VAL 95 -3.609 4.311 3.967 747 HB VAL 95 HB VAL 95 -3.881 1.578 5.216 748 HG11 VAL 95 HG11 VAL 95 -1.552 1.526 5.327 749 HG12 VAL 95 HG12 VAL 95 -1.407 3.265 5.070 750 HG13 VAL 95 HG13 VAL 95 -1.878 2.213 3.735 751 HG21 VAL 95 HG21 VAL 95 -2.780 2.819 7.199 752 HG22 VAL 95 HG22 VAL 95 -4.522 2.966 6.963 753 HG23 VAL 95 HG23 VAL 95 -3.451 4.270 6.453 754 H ILE 96 H ILE 96 -2.624 3.673 2.116 755 HA ILE 96 HA ILE 96 -4.104 1.787 0.423 756 HB ILE 96 HB ILE 96 -1.908 3.659 -0.454 757 HG12 ILE 96 HG13 ILE 96 -3.685 5.007 0.512 758 HG13 ILE 96 HG12 ILE 96 -3.724 5.154 -1.242 759 HG21 ILE 96 HG21 ILE 96 -4.126 2.582 -2.148 760 HG22 ILE 96 HG22 ILE 96 -2.687 1.615 -1.829 761 HG23 ILE 96 HG23 ILE 96 -2.538 3.177 -2.633 762 HD11 ILE 96 HD11 ILE 96 -5.959 4.961 -0.521 763 HD12 ILE 96 HD12 ILE 96 -5.580 3.591 0.523 764 HD13 ILE 96 HD13 ILE 96 -5.530 3.405 -1.230 765 H ALA 97 H ALA 97 -3.270 -0.136 -0.128 766 HA ALA 97 HA ALA 97 -0.443 -0.639 0.541 767 HB1 ALA 97 HB1 ALA 97 -1.834 -1.878 2.036 768 HB2 ALA 97 HB2 ALA 97 -1.128 -3.013 0.886 769 HB3 ALA 97 HB3 ALA 97 -2.806 -2.500 0.702 770 H GLY 98 H GLY 98 -2.910 -0.875 -1.896 771 HA2 GLY 98 HA3 GLY 98 -1.183 -1.102 -4.039 772 HA3 GLY 98 HA2 GLY 98 -1.563 -2.753 -3.573 773 H GLY 99 H GLY 99 -3.980 -1.901 -6.187 774 HA2 GLY 99 HA3 GLY 99 -1.212 -2.601 -5.657 775 HA3 GLY 99 HA2 GLY 99 -2.065 -2.768 -7.181 776 H ALA 100 H ALA 100 -0.368 -1.875 -8.352 777 HA ALA 100 HA ALA 100 0.912 0.549 -7.795 778 HB1 ALA 100 HB1 ALA 100 0.452 -0.567 -10.551 779 HB2 ALA 100 HB2 ALA 100 1.648 -1.214 -9.427 780 HB3 ALA 100 HB3 ALA 100 1.784 0.448 -9.999 781 H GLN 101 H GLN 101 -1.988 -0.135 -9.720 782 HA GLN 101 HA GLN 101 -2.317 2.507 -10.683 783 HB2 GLN 101 HB3 GLN 101 -3.575 0.020 -11.044 784 HB3 GLN 101 HB2 GLN 101 -4.826 1.106 -10.455 785 HG2 GLN 101 HG3 GLN 101 -3.018 1.861 -12.719 786 HG3 GLN 101 HG2 GLN 101 -4.486 0.919 -12.972 787 HE21 GLN 101 HE21 GLN 101 -6.439 1.911 -12.906 788 HE22 GLN 101 HE22 GLN 101 -6.651 3.613 -12.703 789 H ILE 102 H ILE 102 -3.299 0.882 -7.749 790 HA ILE 102 HA ILE 102 -5.224 2.805 -6.925 791 HB ILE 102 HB ILE 102 -3.625 0.907 -5.204 792 HG12 ILE 102 HG13 ILE 102 -4.893 -0.203 -7.038 793 HG13 ILE 102 HG12 ILE 102 -5.478 -0.634 -5.435 794 HG21 ILE 102 HG21 ILE 102 -6.301 2.168 -4.638 795 HG22 ILE 102 HG22 ILE 102 -4.770 2.798 -4.031 796 HG23 ILE 102 HG23 ILE 102 -5.317 1.193 -3.546 797 HD11 ILE 102 HD11 ILE 102 -7.078 0.063 -7.457 798 HD12 ILE 102 HD12 ILE 102 -6.814 1.647 -6.730 799 HD13 ILE 102 HD13 ILE 102 -7.482 0.333 -5.762 800 H PHE 103 H PHE 103 -1.757 2.455 -6.461 801 HA PHE 103 HA PHE 103 -1.413 4.400 -4.467 802 HB2 PHE 103 HB3 PHE 103 0.463 3.462 -6.645 803 HB3 PHE 103 HB2 PHE 103 0.944 4.526 -5.329 804 HD1 PHE 103 HD2 PHE 103 -0.528 3.284 -3.073 805 HD2 PHE 103 HD1 PHE 103 1.691 1.533 -6.253 806 HE1 PHE 103 HE2 PHE 103 -0.059 1.324 -1.661 807 HE2 PHE 103 HE1 PHE 103 2.163 -0.431 -4.848 808 HZ PHE 103 HZ PHE 103 1.289 -0.536 -2.549 809 H THR 104 H THR 104 -1.224 4.650 -8.006 810 HA THR 104 HA THR 104 -0.541 7.327 -8.217 811 HB THR 104 HB THR 104 -2.355 5.755 -10.055 812 HG1 THR 104 HG1 THR 104 -0.630 4.729 -10.598 813 HG21 THR 104 HG21 THR 104 -0.508 7.877 -11.003 814 HG22 THR 104 HG22 THR 104 -2.067 8.341 -10.321 815 HG23 THR 104 HG23 THR 104 -2.000 7.269 -11.720 816 H ALA 105 H ALA 105 -3.800 5.896 -8.078 817 HA ALA 105 HA ALA 105 -5.299 8.192 -8.422 818 HB1 ALA 105 HB1 ALA 105 -5.764 5.582 -7.112 819 HB2 ALA 105 HB2 ALA 105 -6.663 6.382 -8.401 820 HB3 ALA 105 HB3 ALA 105 -6.890 6.884 -6.726 821 H PHE 106 H PHE 106 -4.412 6.794 -5.225 822 HA PHE 106 HA PHE 106 -5.261 9.178 -3.908 823 HB2 PHE 106 HB3 PHE 106 -3.814 6.711 -2.944 824 HB3 PHE 106 HB2 PHE 106 -4.282 8.037 -1.885 825 HD1 PHE 106 HD2 PHE 106 -5.695 5.605 -4.322 826 HD2 PHE 106 HD1 PHE 106 -6.375 8.040 -0.898 827 HE1 PHE 106 HE2 PHE 106 -7.922 4.593 -4.050 828 HE2 PHE 106 HE1 PHE 106 -8.602 7.031 -0.620 829 HZ PHE 106 HZ PHE 106 -9.377 5.306 -2.198 830 H LYS 107 H LYS 107 -2.389 8.281 -5.502 831 HA LYS 107 HA LYS 107 -0.343 9.339 -4.020 832 HB2 LYS 107 HB3 LYS 107 0.901 9.322 -5.938 833 HB3 LYS 107 HB2 LYS 107 -0.457 8.361 -6.496 834 HG2 LYS 107 HG3 LYS 107 -1.433 10.567 -7.351 835 HG3 LYS 107 HG2 LYS 107 0.185 11.224 -7.101 836 HD2 LYS 107 HD3 LYS 107 0.876 9.060 -8.463 837 HD3 LYS 107 HD2 LYS 107 -0.771 9.217 -9.076 838 HE2 LYS 107 HE3 LYS 107 1.328 11.382 -9.127 839 HE3 LYS 107 HE2 LYS 107 0.873 10.371 -10.497 840 HZ1 LYS 107 HZ1 LYS 107 -0.185 12.711 -10.173 841 HZ2 LYS 107 HZ2 LYS 107 -1.212 11.897 -9.105 842 HZ3 LYS 107 HZ3 LYS 107 -1.130 11.421 -10.726 843 H ASP 108 H ASP 108 -2.840 11.038 -5.765 844 HA ASP 108 HA ASP 108 -1.648 13.638 -5.248 845 HB2 ASP 108 HB3 ASP 108 -3.077 12.834 -7.339 846 HB3 ASP 108 HB2 ASP 108 -4.419 13.347 -6.319 847 H ASP 109 H ASP 109 -4.433 11.710 -4.243 848 HA ASP 109 HA ASP 109 -5.318 13.759 -2.385 849 HB2 ASP 109 HB3 ASP 109 -6.591 11.714 -3.765 850 HB3 ASP 109 HB2 ASP 109 -6.597 11.160 -2.094 851 H VAL 110 H VAL 110 -2.779 11.832 -2.168 852 HA VAL 110 HA VAL 110 -3.258 10.656 0.434 853 HB VAL 110 HB VAL 110 -1.877 9.469 -1.218 854 HG11 VAL 110 HG11 VAL 110 -0.292 10.484 -2.394 855 HG12 VAL 110 HG12 VAL 110 0.576 10.912 -0.920 856 HG13 VAL 110 HG13 VAL 110 -0.666 11.990 -1.557 857 HG21 VAL 110 HG21 VAL 110 -0.234 10.283 1.175 858 HG22 VAL 110 HG22 VAL 110 -0.143 8.767 0.278 859 HG23 VAL 110 HG23 VAL 110 -1.577 9.141 1.235 860 H ASP 111 H ASP 111 -1.851 11.066 2.273 861 HA ASP 111 HA ASP 111 -0.892 13.851 2.365 862 HB2 ASP 111 HB3 ASP 111 -3.044 12.978 3.730 863 HB3 ASP 111 HB2 ASP 111 -1.781 12.576 4.890 864 H THR 112 H THR 112 -0.491 10.576 3.674 865 HA THR 112 HA THR 112 2.261 11.310 4.425 866 HB THR 112 HB THR 112 0.483 9.176 5.618 867 HG1 THR 112 HG1 THR 112 0.292 10.506 7.305 868 HG21 THR 112 HG21 THR 112 3.355 9.856 6.137 869 HG22 THR 112 HG22 THR 112 2.617 8.278 5.858 870 HG23 THR 112 HG23 THR 112 2.332 9.127 7.376 871 H LEU 113 H LEU 113 3.894 9.645 4.172 872 HA LEU 113 HA LEU 113 3.233 7.575 2.207 873 HB2 LEU 113 HB3 LEU 113 4.458 9.914 1.512 874 HB3 LEU 113 HB2 LEU 113 5.834 8.875 1.824 875 HG LEU 113 HG LEU 113 5.045 7.281 0.161 876 HD11 LEU 113 HD11 LEU 113 2.951 7.218 -0.586 877 HD12 LEU 113 HD12 LEU 113 3.007 8.914 -1.064 878 HD13 LEU 113 HD13 LEU 113 2.559 8.477 0.585 879 HD21 LEU 113 HD21 LEU 113 6.404 8.631 -1.010 880 HD22 LEU 113 HD22 LEU 113 5.614 10.097 -0.428 881 HD23 LEU 113 HD23 LEU 113 4.909 9.185 -1.764 882 H LEU 114 H LEU 114 4.034 5.662 2.732 883 HA LEU 114 HA LEU 114 6.434 5.506 4.422 884 HB2 LEU 114 HB3 LEU 114 3.916 3.867 4.760 885 HB3 LEU 114 HB2 LEU 114 5.416 3.600 5.628 886 HG LEU 114 HG LEU 114 4.205 6.303 5.837 887 HD11 LEU 114 HD11 LEU 114 2.628 5.640 7.517 888 HD12 LEU 114 HD12 LEU 114 3.119 3.952 7.376 889 HD13 LEU 114 HD13 LEU 114 2.285 4.743 6.038 890 HD21 LEU 114 HD21 LEU 114 5.271 6.352 7.886 891 HD22 LEU 114 HD22 LEU 114 6.367 5.360 6.925 892 HD23 LEU 114 HD23 LEU 114 5.250 4.597 8.058 893 H VAL 115 H VAL 115 7.929 4.561 3.182 894 HA VAL 115 HA VAL 115 7.078 2.281 1.514 895 HB VAL 115 HB VAL 115 8.749 2.900 -0.144 896 HG11 VAL 115 HG11 VAL 115 6.959 5.228 0.540 897 HG12 VAL 115 HG12 VAL 115 6.459 3.778 -0.331 898 HG13 VAL 115 HG13 VAL 115 7.652 4.866 -1.041 899 HG21 VAL 115 HG21 VAL 115 9.491 4.878 1.921 900 HG22 VAL 115 HG22 VAL 115 9.553 5.428 0.246 901 HG23 VAL 115 HG23 VAL 115 10.498 4.027 0.750 902 H THR 116 H THR 116 8.463 0.566 1.265 903 HA THR 116 HA THR 116 10.773 0.474 3.092 904 HB THR 116 HB THR 116 8.699 -1.632 2.475 905 HG1 THR 116 HG1 THR 116 8.481 -1.635 4.710 906 HG21 THR 116 HG21 THR 116 11.403 -2.024 3.714 907 HG22 THR 116 HG22 THR 116 10.679 -2.894 2.361 908 HG23 THR 116 HG23 THR 116 10.048 -3.118 3.994 909 H ARG 117 H ARG 117 12.392 0.846 1.637 910 HA ARG 117 HA ARG 117 12.389 -0.559 -0.909 911 HB2 ARG 117 HB3 ARG 117 14.394 1.401 0.218 912 HB3 ARG 117 HB2 ARG 117 14.356 0.798 -1.433 913 HG2 ARG 117 HG3 ARG 117 11.875 1.791 -1.274 914 HG3 ARG 117 HG2 ARG 117 12.692 2.849 -0.122 915 HD2 ARG 117 HD3 ARG 117 14.143 2.405 -2.636 916 HD3 ARG 117 HD2 ARG 117 12.606 3.251 -2.810 917 HE ARG 117 HE ARG 117 14.274 4.303 -0.719 918 HH11 ARG 117 HH11 ARG 117 13.553 4.416 -4.132 919 HH12 ARG 117 HH12 ARG 117 14.185 6.014 -4.340 920 HH21 ARG 117 HH21 ARG 117 15.107 6.405 -0.992 921 HH22 ARG 117 HH22 ARG 117 15.068 7.144 -2.558 922 H LEU 118 H LEU 118 12.989 -2.624 -0.797 923 HA LEU 118 HA LEU 118 14.749 -3.711 1.119 924 HB2 LEU 118 HB3 LEU 118 13.416 -4.642 -1.354 925 HB3 LEU 118 HB2 LEU 118 14.852 -5.528 -0.878 926 HG LEU 118 HG LEU 118 13.728 -5.748 1.422 927 HD11 LEU 118 HD11 LEU 118 11.114 -5.846 0.842 928 HD12 LEU 118 HD12 LEU 118 11.594 -4.491 -0.179 929 HD13 LEU 118 HD13 LEU 118 11.896 -4.436 1.557 930 HD21 LEU 118 HD21 LEU 118 12.026 -7.346 -0.254 931 HD22 LEU 118 HD22 LEU 118 13.386 -7.836 0.755 932 HD23 LEU 118 HD23 LEU 118 13.665 -7.302 -0.902 933 H ALA 119 H ALA 119 16.779 -4.915 0.501 934 HA ALA 119 HA ALA 119 18.547 -3.074 -0.892 935 HB1 ALA 119 HB1 ALA 119 18.819 -4.943 1.255 936 HB2 ALA 119 HB2 ALA 119 19.956 -3.714 0.701 937 HB3 ALA 119 HB3 ALA 119 19.989 -5.329 -0.007 938 H GLY 120 H GLY 120 17.369 -6.387 -1.155 939 HA2 GLY 120 HA3 GLY 120 19.010 -7.244 -3.261 940 HA3 GLY 120 HA2 GLY 120 17.419 -7.890 -2.886 941 H SER 121 H SER 121 18.692 -7.377 -5.479 942 HA SER 121 HA SER 121 17.009 -5.240 -6.563 943 HB2 SER 121 HB3 SER 121 19.495 -6.614 -7.480 944 HB3 SER 121 HB2 SER 121 18.415 -5.944 -8.702 945 HG SER 121 HG SER 121 18.849 -3.962 -8.029 946 H PHE 122 H PHE 122 15.067 -5.806 -7.257 947 HA PHE 122 HA PHE 122 14.679 -8.499 -8.377 948 HB2 PHE 122 HB3 PHE 122 12.735 -6.548 -7.134 949 HB3 PHE 122 HB2 PHE 122 12.224 -8.000 -7.989 950 HD1 PHE 122 HD2 PHE 122 14.234 -6.811 -5.111 951 HD2 PHE 122 HD1 PHE 122 12.157 -10.065 -6.904 952 HE1 PHE 122 HE2 PHE 122 14.497 -8.115 -3.041 953 HE2 PHE 122 HE1 PHE 122 12.415 -11.374 -4.837 954 HZ PHE 122 HZ PHE 122 13.587 -10.400 -2.902 955 H GLU 123 H GLU 123 13.085 -8.636 -10.207 956 HA GLU 123 HA GLU 123 13.208 -6.235 -11.905 957 HB2 GLU 123 HB3 GLU 123 13.494 -7.777 -13.851 958 HB3 GLU 123 HB2 GLU 123 14.867 -7.733 -12.754 959 HG2 GLU 123 HG3 GLU 123 13.771 -9.801 -11.668 960 HG3 GLU 123 HG2 GLU 123 12.857 -9.903 -13.172 961 H GLY 124 H GLY 124 11.787 -6.706 -13.933 962 HA2 GLY 124 HA3 GLY 124 9.652 -8.114 -14.380 963 HA3 GLY 124 HA2 GLY 124 9.118 -7.374 -12.879 964 H ASP 125 H ASP 125 7.368 -6.360 -13.881 965 HA ASP 125 HA ASP 125 8.120 -4.014 -15.483 966 HB2 ASP 125 HB3 ASP 125 6.887 -6.121 -16.627 967 HB3 ASP 125 HB2 ASP 125 5.480 -5.231 -16.053 968 H THR 126 H THR 126 7.144 -4.775 -12.584 969 HA THR 126 HA THR 126 5.010 -2.746 -12.470 970 HB THR 126 HB THR 126 5.559 -4.753 -10.298 971 HG1 THR 126 HG1 THR 126 3.747 -5.114 -12.444 972 HG21 THR 126 HG21 THR 126 2.821 -3.930 -10.933 973 HG22 THR 126 HG22 THR 126 3.865 -2.649 -10.316 974 HG23 THR 126 HG23 THR 126 3.624 -4.121 -9.374 975 H LYS 127 H LYS 127 5.972 -0.865 -12.039 976 HA LYS 127 HA LYS 127 7.801 -0.751 -9.730 977 HB2 LYS 127 HB3 LYS 127 8.541 -0.212 -12.297 978 HB3 LYS 127 HB2 LYS 127 8.053 1.385 -11.749 979 HG2 LYS 127 HG3 LYS 127 9.575 0.627 -9.667 980 HG3 LYS 127 HG2 LYS 127 10.362 -0.265 -10.970 981 HD2 LYS 127 HD3 LYS 127 9.805 2.701 -10.952 982 HD3 LYS 127 HD2 LYS 127 11.371 1.947 -10.644 983 HE2 LYS 127 HE3 LYS 127 11.737 1.507 -12.830 984 HE3 LYS 127 HE2 LYS 127 10.039 1.154 -13.150 985 HZ1 LYS 127 HZ1 LYS 127 10.220 3.100 -14.262 986 HZ2 LYS 127 HZ2 LYS 127 11.466 3.694 -13.286 987 HZ3 LYS 127 HZ3 LYS 127 9.867 3.746 -12.739 988 H MET 128 H MET 128 7.875 1.466 -8.732 989 HA MET 128 HA MET 128 5.325 2.244 -7.906 990 HB2 MET 128 HB3 MET 128 7.523 2.632 -6.707 991 HB3 MET 128 HB2 MET 128 7.786 3.988 -7.795 992 HG2 MET 128 HG3 MET 128 6.882 4.626 -5.582 993 HG3 MET 128 HG2 MET 128 5.882 5.139 -6.938 994 HE1 MET 128 HE1 MET 128 3.637 4.800 -4.075 995 HE2 MET 128 HE2 MET 128 2.875 4.829 -5.664 996 HE3 MET 128 HE3 MET 128 4.340 5.767 -5.372 997 H ILE 129 H ILE 129 4.430 4.491 -8.082 998 HA ILE 129 HA ILE 129 4.587 5.389 -10.882 999 HB ILE 129 HB ILE 129 2.311 6.484 -10.268 1000 HG12 ILE 129 HG13 ILE 129 1.033 5.113 -8.610 1001 HG13 ILE 129 HG12 ILE 129 2.543 4.339 -8.146 1002 HG21 ILE 129 HG21 ILE 129 1.273 4.043 -10.575 1003 HG22 ILE 129 HG22 ILE 129 2.950 3.691 -10.991 1004 HG23 ILE 129 HG23 ILE 129 2.060 4.922 -11.886 1005 HD11 ILE 129 HD11 ILE 129 1.654 6.282 -6.728 1006 HD12 ILE 129 HD12 ILE 129 2.249 7.310 -8.033 1007 HD13 ILE 129 HD13 ILE 129 3.365 6.263 -7.155 1008 HA PRO 130 HA PRO 130 6.055 9.405 -9.857 1009 HB2 PRO 130 HB3 PRO 130 4.257 11.038 -11.183 1010 HB3 PRO 130 HB2 PRO 130 5.646 10.246 -11.931 1011 HG2 PRO 130 HG3 PRO 130 2.775 9.417 -11.907 1012 HG3 PRO 130 HG2 PRO 130 3.957 9.335 -13.227 1013 HD2 PRO 130 HD3 PRO 130 3.284 7.157 -11.823 1014 HD3 PRO 130 HD2 PRO 130 4.949 7.413 -12.387 1015 H LEU 131 H LEU 131 5.759 11.102 -8.433 1016 HA LEU 131 HA LEU 131 3.122 11.555 -7.274 1017 HB2 LEU 131 HB3 LEU 131 5.345 11.191 -5.329 1018 HB3 LEU 131 HB2 LEU 131 3.621 10.974 -5.107 1019 HG LEU 131 HG LEU 131 5.051 9.036 -6.860 1020 HD11 LEU 131 HD11 LEU 131 6.316 9.510 -4.614 1021 HD12 LEU 131 HD12 LEU 131 6.060 7.859 -5.178 1022 HD13 LEU 131 HD13 LEU 131 5.016 8.536 -3.928 1023 HD21 LEU 131 HD21 LEU 131 2.728 8.707 -6.713 1024 HD22 LEU 131 HD22 LEU 131 2.713 8.998 -4.974 1025 HD23 LEU 131 HD23 LEU 131 3.429 7.519 -5.615 1026 H ASN 132 H ASN 132 3.006 13.498 -5.988 1027 HA ASN 132 HA ASN 132 4.698 15.583 -7.007 1028 HB2 ASN 132 HB3 ASN 132 2.124 15.510 -6.064 1029 HB3 ASN 132 HB2 ASN 132 2.977 16.233 -4.704 1030 HD21 ASN 132 HD21 ASN 132 4.826 17.793 -5.773 1031 HD22 ASN 132 HD22 ASN 132 4.127 19.009 -6.782 1032 H TRP 133 H TRP 133 6.653 14.480 -6.147 1033 HA TRP 133 HA TRP 133 7.271 14.133 -3.487 1034 HB2 TRP 133 HB3 TRP 133 9.083 14.959 -5.758 1035 HB3 TRP 133 HB2 TRP 133 9.651 14.403 -4.185 1036 HD1 TRP 133 HD1 TRP 133 8.024 13.138 -7.402 1037 HE1 TRP 133 HE1 TRP 133 8.150 10.566 -7.439 1038 HE3 TRP 133 HE3 TRP 133 9.771 12.340 -2.663 1039 HZ2 TRP 133 HZ2 TRP 133 8.897 8.478 -5.693 1040 HZ3 TRP 133 HZ3 TRP 133 10.165 10.026 -1.925 1041 HH2 TRP 133 HH2 TRP 133 9.736 8.136 -3.410 1042 H ASP 134 H ASP 134 7.537 17.136 -5.392 1043 HA ASP 134 HA ASP 134 8.893 18.662 -3.499 1044 HB2 ASP 134 HB3 ASP 134 8.300 19.241 -5.928 1045 HB3 ASP 134 HB2 ASP 134 6.750 19.783 -5.293 1046 H ASP 135 H ASP 135 5.421 18.087 -3.889 1047 HA ASP 135 HA ASP 135 4.652 19.853 -1.792 1048 HB2 ASP 135 HB3 ASP 135 3.324 17.996 -3.631 1049 HB3 ASP 135 HB2 ASP 135 2.545 18.110 -2.056 1050 H PHE 136 H PHE 136 6.187 16.891 -1.657 1051 HA PHE 136 HA PHE 136 5.165 16.434 1.071 1052 HB2 PHE 136 HB3 PHE 136 5.987 14.381 -0.991 1053 HB3 PHE 136 HB2 PHE 136 5.713 14.006 0.707 1054 HD1 PHE 136 HD1 PHE 136 3.370 14.942 1.611 1055 HD2 PHE 136 HD2 PHE 136 4.261 13.981 -2.437 1056 HE1 PHE 136 HE1 PHE 136 0.971 14.640 1.159 1057 HE2 PHE 136 HE2 PHE 136 1.863 13.678 -2.897 1058 HZ PHE 136 HZ PHE 136 0.214 14.008 -1.098 1059 H THR 137 H THR 137 6.630 16.346 2.650 1060 HA THR 137 HA THR 137 9.476 16.325 1.880 1061 HB THR 137 HB THR 137 8.049 17.789 4.099 1062 HG1 THR 137 HG1 THR 137 9.722 18.659 1.983 1063 HG21 THR 137 HG21 THR 137 10.078 16.932 5.085 1064 HG22 THR 137 HG22 THR 137 10.223 18.667 4.801 1065 HG23 THR 137 HG23 THR 137 11.021 17.526 3.718 1066 H LYS 138 H LYS 138 10.860 14.961 2.914 1067 HA LYS 138 HA LYS 138 9.777 12.711 4.254 1068 HB2 LYS 138 HB3 LYS 138 11.888 12.753 2.870 1069 HB3 LYS 138 HB2 LYS 138 12.673 13.529 4.241 1070 HG2 LYS 138 HG3 LYS 138 12.975 11.582 5.235 1071 HG3 LYS 138 HG2 LYS 138 11.260 11.207 5.131 1072 HD2 LYS 138 HD3 LYS 138 12.499 9.484 4.005 1073 HD3 LYS 138 HD2 LYS 138 11.619 10.433 2.806 1074 HE2 LYS 138 HE3 LYS 138 13.515 10.885 1.743 1075 HE3 LYS 138 HE2 LYS 138 14.178 11.620 3.202 1076 HZ1 LYS 138 HZ1 LYS 138 15.601 9.850 2.473 1077 HZ2 LYS 138 HZ2 LYS 138 14.316 8.750 2.451 1078 HZ3 LYS 138 HZ3 LYS 138 14.861 9.384 3.922 1079 H VAL 139 H VAL 139 9.000 12.756 6.233 1080 HA VAL 139 HA VAL 139 10.052 14.663 8.165 1081 HB VAL 139 HB VAL 139 8.197 13.667 9.639 1082 HG11 VAL 139 HG11 VAL 139 8.143 15.868 8.482 1083 HG12 VAL 139 HG12 VAL 139 6.555 15.130 8.689 1084 HG13 VAL 139 HG13 VAL 139 7.351 15.081 7.117 1085 HG21 VAL 139 HG21 VAL 139 6.738 12.881 7.217 1086 HG22 VAL 139 HG22 VAL 139 6.738 12.164 8.828 1087 HG23 VAL 139 HG23 VAL 139 8.032 11.782 7.693 1088 H SER 140 H SER 140 10.111 11.239 7.482 1089 HA SER 140 HA SER 140 12.048 10.920 9.639 1090 HB2 SER 140 HB3 SER 140 9.338 9.927 9.806 1091 HB3 SER 140 HB2 SER 140 10.492 8.595 9.850 1092 HG SER 140 HG SER 140 10.164 10.735 11.628 1093 H SER 141 H SER 141 13.372 9.055 9.446 1094 HA SER 141 HA SER 141 13.093 7.306 7.178 1095 HB2 SER 141 HB3 SER 141 14.095 9.404 6.206 1096 HB3 SER 141 HB2 SER 141 15.497 9.141 7.242 1097 HG SER 141 HG SER 141 16.188 7.830 5.769 1098 H ARG 142 H ARG 142 13.805 5.379 7.796 1099 HA ARG 142 HA ARG 142 16.114 5.208 9.593 1100 HB2 ARG 142 HB3 ARG 142 13.996 5.057 10.925 1101 HB3 ARG 142 HB2 ARG 142 13.582 3.613 10.010 1102 HG2 ARG 142 HG3 ARG 142 15.603 2.511 10.850 1103 HG3 ARG 142 HG2 ARG 142 15.990 3.956 11.786 1104 HD2 ARG 142 HD3 ARG 142 13.282 2.867 12.182 1105 HD3 ARG 142 HD2 ARG 142 14.602 1.845 12.750 1106 HE ARG 142 HE ARG 142 14.808 4.585 13.596 1107 HH11 ARG 142 HH11 ARG 142 13.455 1.454 14.335 1108 HH12 ARG 142 HH12 ARG 142 13.301 1.781 16.028 1109 HH21 ARG 142 HH21 ARG 142 14.607 5.017 15.823 1110 HH22 ARG 142 HH22 ARG 142 13.954 3.803 16.874 1111 H THR 143 H THR 143 17.569 3.799 8.873 1112 HA THR 143 HA THR 143 16.777 1.939 6.755 1113 HB THR 143 HB THR 143 19.589 2.584 7.631 1114 HG1 THR 143 HG1 THR 143 18.957 4.530 7.003 1115 HG21 THR 143 HG21 THR 143 18.679 0.736 5.817 1116 HG22 THR 143 HG22 THR 143 20.301 1.425 5.879 1117 HG23 THR 143 HG23 THR 143 19.085 2.128 4.813 1118 H VAL 144 H VAL 144 16.203 -0.013 7.450 1119 HA VAL 144 HA VAL 144 17.573 -1.166 9.770 1120 HB VAL 144 HB VAL 144 15.633 -2.950 9.313 1121 HG11 VAL 144 HG11 VAL 144 14.779 -2.214 11.262 1122 HG12 VAL 144 HG12 VAL 144 14.630 -0.552 10.691 1123 HG13 VAL 144 HG13 VAL 144 16.191 -1.158 11.244 1124 HG21 VAL 144 HG21 VAL 144 14.449 -0.353 8.343 1125 HG22 VAL 144 HG22 VAL 144 13.563 -1.845 8.656 1126 HG23 VAL 144 HG23 VAL 144 14.751 -1.782 7.354 1127 H GLU 145 H GLU 145 18.841 -2.927 9.594 1128 HA GLU 145 HA GLU 145 18.884 -4.343 7.015 1129 HB2 GLU 145 HB3 GLU 145 21.407 -4.589 7.461 1130 HB3 GLU 145 HB2 GLU 145 20.821 -3.043 6.863 1131 HG2 GLU 145 HG3 GLU 145 21.361 -1.953 8.745 1132 HG3 GLU 145 HG2 GLU 145 20.927 -3.309 9.785 1133 H ASP 146 H ASP 146 19.311 -6.524 7.072 1134 HA ASP 146 HA ASP 146 19.259 -7.758 9.747 1135 HB2 ASP 146 HB3 ASP 146 17.880 -8.411 7.188 1136 HB3 ASP 146 HB2 ASP 146 18.381 -9.760 8.203 1137 H THR 147 H THR 147 19.945 -10.301 9.254 1138 HA THR 147 HA THR 147 22.731 -10.223 8.985 1139 HB THR 147 HB THR 147 21.662 -12.023 10.193 1140 HG1 THR 147 HG1 THR 147 22.849 -13.094 7.853 1141 HG21 THR 147 HG21 THR 147 20.116 -13.478 9.417 1142 HG22 THR 147 HG22 THR 147 20.710 -13.402 7.758 1143 HG23 THR 147 HG23 THR 147 19.715 -12.095 8.400 1144 H ASN 148 H ASN 148 20.205 -11.158 6.695 1145 HA ASN 148 HA ASN 148 22.117 -11.645 4.582 1146 HB2 ASN 148 HB3 ASN 148 19.110 -11.723 4.742 1147 HB3 ASN 148 HB2 ASN 148 19.951 -11.863 3.201 1148 HD21 ASN 148 HD21 ASN 148 18.435 -13.647 5.332 1149 HD22 ASN 148 HD22 ASN 148 19.352 -15.110 5.275 1150 HA PRO 149 HA PRO 149 22.323 -7.459 3.143 1151 HB2 PRO 149 HB3 PRO 149 22.916 -7.964 0.509 1152 HB3 PRO 149 HB2 PRO 149 24.101 -8.010 1.818 1153 HG2 PRO 149 HG3 PRO 149 22.635 -10.264 0.508 1154 HG3 PRO 149 HG2 PRO 149 24.335 -10.171 1.006 1155 HD2 PRO 149 HD3 PRO 149 22.503 -11.486 2.469 1156 HD3 PRO 149 HD2 PRO 149 23.838 -10.593 3.228 1157 H ALA 150 H ALA 150 20.453 -9.838 1.316 1158 HA ALA 150 HA ALA 150 18.947 -7.912 -0.151 1159 HB1 ALA 150 HB1 ALA 150 18.862 -9.858 -1.292 1160 HB2 ALA 150 HB2 ALA 150 17.412 -10.104 -0.320 1161 HB3 ALA 150 HB3 ALA 150 18.936 -10.845 0.167 1162 H LEU 151 H LEU 151 18.725 -9.137 3.049 1163 HA LEU 151 HA LEU 151 15.897 -8.496 3.287 1164 HB2 LEU 151 HB3 LEU 151 17.917 -9.727 5.131 1165 HB3 LEU 151 HB2 LEU 151 16.378 -9.153 5.742 1166 HG LEU 151 HG LEU 151 16.883 -11.401 3.806 1167 HD11 LEU 151 HD11 LEU 151 16.811 -12.515 5.738 1168 HD12 LEU 151 HD12 LEU 151 15.075 -12.206 5.701 1169 HD13 LEU 151 HD13 LEU 151 16.141 -11.138 6.613 1170 HD21 LEU 151 HD21 LEU 151 15.069 -10.312 2.787 1171 HD22 LEU 151 HD22 LEU 151 14.336 -9.898 4.337 1172 HD23 LEU 151 HD23 LEU 151 14.339 -11.572 3.783 1173 H THR 152 H THR 152 18.302 -6.525 2.976 1174 HA THR 152 HA THR 152 17.884 -4.893 5.360 1175 HB THR 152 HB THR 152 19.690 -4.414 2.978 1176 HG1 THR 152 HG1 THR 152 21.313 -5.201 4.294 1177 HG21 THR 152 HG21 THR 152 19.541 -2.327 3.928 1178 HG22 THR 152 HG22 THR 152 20.911 -3.025 4.793 1179 HG23 THR 152 HG23 THR 152 19.323 -2.966 5.557 1180 H HIS 153 H HIS 153 16.345 -3.394 5.404 1181 HA HIS 153 HA HIS 153 15.562 -2.107 2.877 1182 HB2 HIS 153 HB3 HIS 153 13.380 -2.348 4.816 1183 HB3 HIS 153 HB2 HIS 153 13.386 -2.660 3.085 1184 HD1 HIS 153 HD1 HIS 153 12.483 -4.387 5.885 1185 HD2 HIS 153 HD2 HIS 153 15.185 -5.287 2.860 1186 HE1 HIS 153 HE1 HIS 153 12.747 -6.887 5.938 1187 HE2 HIS 153 HE2 HIS 153 14.321 -7.415 4.046 1188 H THR 154 H THR 154 14.339 -0.055 3.230 1189 HA THR 154 HA THR 154 15.184 1.303 5.701 1190 HB THR 154 HB THR 154 15.176 2.689 3.030 1191 HG1 THR 154 HG1 THR 154 17.030 1.852 2.555 1192 HG21 THR 154 HG21 THR 154 15.593 4.436 4.332 1193 HG22 THR 154 HG22 THR 154 17.188 3.726 4.583 1194 HG23 THR 154 HG23 THR 154 15.894 3.421 5.743 1195 H TYR 155 H TYR 155 13.555 2.228 6.742 1196 HA TYR 155 HA TYR 155 10.987 2.528 5.393 1197 HB2 TYR 155 HB3 TYR 155 11.895 2.265 8.201 1198 HB3 TYR 155 HB2 TYR 155 10.482 3.283 7.941 1199 HD1 TYR 155 HD1 TYR 155 8.589 2.220 6.467 1200 HD2 TYR 155 HD2 TYR 155 11.607 -0.017 8.464 1201 HE1 TYR 155 HE1 TYR 155 7.163 0.219 6.368 1202 HE2 TYR 155 HE2 TYR 155 10.189 -2.024 8.369 1203 HH TYR 155 HH TYR 155 7.344 -2.178 6.461 1204 H GLU 156 H GLU 156 10.373 4.416 4.572 1205 HA GLU 156 HA GLU 156 11.568 6.873 5.677 1206 HB2 GLU 156 HB3 GLU 156 10.709 6.298 2.837 1207 HB3 GLU 156 HB2 GLU 156 11.268 7.861 3.418 1208 HG2 GLU 156 HG3 GLU 156 13.446 7.166 3.610 1209 HG3 GLU 156 HG2 GLU 156 13.002 5.470 3.791 1210 H VAL 157 H VAL 157 10.269 8.529 6.224 1211 HA VAL 157 HA VAL 157 7.375 8.133 5.879 1212 HB VAL 157 HB VAL 157 8.547 9.906 8.001 1213 HG11 VAL 157 HG11 VAL 157 6.377 10.311 8.317 1214 HG12 VAL 157 HG12 VAL 157 6.216 8.648 8.876 1215 HG13 VAL 157 HG13 VAL 157 5.908 9.044 7.185 1216 HG21 VAL 157 HG21 VAL 157 8.399 8.045 9.582 1217 HG22 VAL 157 HG22 VAL 157 9.567 7.705 8.304 1218 HG23 VAL 157 HG23 VAL 157 7.971 6.955 8.263 1219 H TRP 158 H TRP 158 6.096 9.876 5.420 1220 HA TRP 158 HA TRP 158 7.368 12.391 4.631 1221 HB2 TRP 158 HB3 TRP 158 5.645 10.839 2.701 1222 HB3 TRP 158 HB2 TRP 158 6.364 12.417 2.413 1223 HD1 TRP 158 HD1 TRP 158 7.560 8.795 3.144 1224 HE1 TRP 158 HE1 TRP 158 9.767 8.423 1.873 1225 HE3 TRP 158 HE3 TRP 158 8.167 13.477 1.183 1226 HZ2 TRP 158 HZ2 TRP 158 11.531 9.917 0.253 1227 HZ3 TRP 158 HZ3 TRP 158 10.140 13.923 -0.216 1228 HH2 TRP 158 HH2 TRP 158 11.787 12.179 -0.670 1229 H GLN 159 H GLN 159 6.132 14.162 4.837 1230 HA GLN 159 HA GLN 159 3.252 13.851 5.277 1231 HB2 GLN 159 HB3 GLN 159 5.231 15.076 7.181 1232 HB3 GLN 159 HB2 GLN 159 3.550 15.592 7.171 1233 HG2 GLN 159 HG3 GLN 159 2.888 13.226 7.551 1234 HG3 GLN 159 HG2 GLN 159 4.596 12.828 7.725 1235 HE21 GLN 159 HE21 GLN 159 2.127 12.931 9.548 1236 HE22 GLN 159 HE22 GLN 159 2.710 13.737 10.961 1237 H LYS 160 H LYS 160 2.107 15.352 4.206 1238 HA LYS 160 HA LYS 160 3.300 17.153 2.446 1239 HB2 LYS 160 HB3 LYS 160 0.943 16.239 2.355 1240 HB3 LYS 160 HB2 LYS 160 0.516 17.427 3.579 1241 HG2 LYS 160 HG3 LYS 160 1.569 19.112 1.874 1242 HG3 LYS 160 HG2 LYS 160 1.228 17.824 0.717 1243 HD2 LYS 160 HD3 LYS 160 -1.017 18.096 0.874 1244 HD3 LYS 160 HD2 LYS 160 -0.953 18.520 2.586 1245 HE2 LYS 160 HE3 LYS 160 -0.490 20.746 2.150 1246 HE3 LYS 160 HE2 LYS 160 0.137 20.405 0.538 1247 HZ1 LYS 160 HZ1 LYS 160 -2.384 19.614 0.261 1248 HZ2 LYS 160 HZ2 LYS 160 -1.867 21.190 -0.072 1249 HZ3 LYS 160 HZ3 LYS 160 -2.599 20.837 1.411 1250 H LYS 161 H LYS 161 3.759 19.308 2.508 1251 HA LYS 161 HA LYS 161 4.401 20.459 5.005 1252 HB2 LYS 161 HB3 LYS 161 4.538 21.263 2.170 1253 HB3 LYS 161 HB2 LYS 161 4.413 22.592 3.314 1254 HG2 LYS 161 HG3 LYS 161 6.468 22.208 4.204 1255 HG3 LYS 161 HG2 LYS 161 6.405 20.473 3.887 1256 HD2 LYS 161 HD3 LYS 161 8.052 21.410 2.436 1257 HD3 LYS 161 HD2 LYS 161 6.648 20.999 1.449 1258 HE2 LYS 161 HE3 LYS 161 6.607 23.719 2.539 1259 HE3 LYS 161 HE2 LYS 161 7.937 23.404 1.426 1260 HZ1 LYS 161 HZ1 LYS 161 6.428 22.799 -0.272 1261 HZ2 LYS 161 HZ2 LYS 161 5.842 24.243 0.385 1262 HZ3 LYS 161 HZ3 LYS 161 5.111 22.773 0.790 1263 H ALA 162 H ALA 162 3.362 21.901 6.282 1264 HA ALA 162 HA ALA 162 1.653 23.089 7.201 1265 HB1 ALA 162 HB1 ALA 162 0.611 23.661 4.450 1266 HB2 ALA 162 HB2 ALA 162 2.109 24.391 5.027 1267 HB3 ALA 162 HB3 ALA 162 0.597 24.690 5.883 1268 H51A NDP 170 H51A NDP 170 -5.348 -0.137 -9.017 1269 H52A NDP 170 H52A NDP 170 -5.693 -1.753 -8.390 1270 H4B NDP 170 H4B NDP 170 -6.917 -2.237 -10.562 1271 H3B NDP 170 H3B NDP 170 -6.335 0.682 -11.094 1272 HO3A NDP 170 HO3A NDP 170 -5.218 -0.942 -12.296 1273 H2B NDP 170 H2B NDP 170 -8.516 0.849 -12.068 1274 H1B NDP 170 H1B NDP 170 -9.836 -0.497 -10.062 1275 H8A NDP 170 H8A NDP 170 -6.850 1.534 -8.847 1276 H61A NDP 170 H61A NDP 170 -10.972 6.086 -7.941 1277 H62A NDP 170 H62A NDP 170 -9.299 5.608 -7.757 1278 H2A NDP 170 H2A NDP 170 -13.069 2.702 -10.011 1279 H51N NDP 170 H51N NDP 170 -1.142 -4.296 -8.625 1280 H52N NDP 170 H52N NDP 170 -0.358 -3.325 -9.883 1281 H4D NDP 170 H4D NDP 170 1.293 -5.182 -10.232 1282 H3D NDP 170 H3D NDP 170 -0.200 -6.509 -7.959 1283 HO3N NDP 170 HO3N NDP 170 -0.213 -7.083 -10.384 1284 H2D NDP 170 H2D NDP 170 1.915 -7.373 -7.227 1285 HO2N NDP 170 HO2N NDP 170 2.615 -7.148 -9.819 1286 H1D NDP 170 H1D NDP 170 3.298 -4.998 -7.529 1287 H2N NDP 170 H2N NDP 170 3.599 -4.923 -5.131 1288 H71N NDP 170 H71N NDP 170 5.120 -4.455 -2.314 1289 H72N NDP 170 H72N NDP 170 4.849 -5.044 -3.934 1290 H41N NDP 170 H41N NDP 170 0.353 -3.587 -3.241 1291 H42N NDP 170 H42N NDP 170 0.297 -5.360 -2.948 1292 H5N NDP 170 H5N NDP 170 -1.345 -4.676 -4.694 1293 H6N NDP 170 H6N NDP 170 -0.366 -5.092 -6.957
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