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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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609969 |
5kvp ![]() ![]() |
30139 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H1 MET 1 4.053 1.350 -32.383 2 H2 MET 1 H2 MET 1 2.471 1.147 -32.945 3 H3 MET 1 H3 MET 1 3.378 -0.199 -32.467 4 HA MET 1 HA MET 1 3.412 0.560 -30.200 5 HB2 MET 1 HB2 MET 1 1.935 2.890 -31.398 6 HB3 MET 1 HB3 MET 1 1.769 2.490 -29.695 7 HG2 MET 1 HG2 MET 1 4.217 2.709 -29.446 8 HG3 MET 1 HG3 MET 1 4.310 3.220 -31.131 9 HE1 MET 1 HE1 MET 1 5.651 5.395 -30.131 10 HE2 MET 1 HE2 MET 1 5.371 4.812 -28.490 11 HE3 MET 1 HE3 MET 1 4.946 6.469 -28.922 12 H ARG 2 H ARG 2 1.996 -0.438 -28.876 13 HA ARG 2 HA ARG 2 -0.359 -1.648 -30.103 14 HB2 ARG 2 HB2 ARG 2 1.145 -2.176 -27.544 15 HB3 ARG 2 HB3 ARG 2 -0.400 -2.938 -27.893 16 HG2 ARG 2 HG2 ARG 2 0.537 -3.969 -29.885 17 HG3 ARG 2 HG3 ARG 2 2.083 -3.173 -29.583 18 HD2 ARG 2 HD2 ARG 2 2.280 -4.372 -27.458 19 HD3 ARG 2 HD3 ARG 2 0.736 -5.167 -27.763 20 HE ARG 2 HE ARG 2 2.489 -5.639 -29.919 21 HH11 ARG 2 HH11 ARG 2 2.016 -6.568 -26.548 22 HH12 ARG 2 HH12 ARG 2 2.820 -8.165 -26.770 23 HH21 ARG 2 HH21 ARG 2 3.504 -7.646 -30.215 24 HH22 ARG 2 HH22 ARG 2 3.647 -8.763 -28.809 25 H GLY 3 H GLY 3 -2.440 -1.336 -29.442 26 HA2 GLY 3 HA2 GLY 3 -2.925 0.522 -27.208 27 HA3 GLY 3 HA3 GLY 3 -3.644 0.843 -28.779 28 H SER 4 H SER 4 -4.608 0.042 -25.949 29 HA SER 4 HA SER 4 -6.207 -2.315 -26.635 30 HB2 SER 4 HB2 SER 4 -6.827 -2.274 -24.201 31 HB3 SER 4 HB3 SER 4 -5.100 -2.473 -24.497 32 HG SER 4 HG SER 4 -5.995 0.136 -24.226 33 H HIS 5 H HIS 5 -8.448 -2.321 -26.584 34 HA HIS 5 HA HIS 5 -9.734 0.331 -26.518 35 HB2 HIS 5 HB2 HIS 5 -9.477 -1.120 -28.763 36 HB3 HIS 5 HB3 HIS 5 -10.971 -1.820 -28.149 37 HD1 HIS 5 HD1 HIS 5 -9.584 1.215 -29.744 38 HD2 HIS 5 HD2 HIS 5 -13.160 0.006 -28.004 39 HE1 HIS 5 HE1 HIS 5 -11.281 2.940 -30.428 40 HE2 HIS 5 HE2 HIS 5 -13.439 2.189 -29.365 41 H HIS 6 H HIS 6 -10.182 -3.144 -25.952 42 HA HIS 6 HA HIS 6 -12.523 -2.538 -24.272 43 HB2 HIS 6 HB2 HIS 6 -11.697 -5.049 -25.724 44 HB3 HIS 6 HB3 HIS 6 -12.943 -5.049 -24.480 45 HD1 HIS 6 HD1 HIS 6 -15.188 -3.870 -25.053 46 HD2 HIS 6 HD2 HIS 6 -12.452 -3.967 -28.180 47 HE1 HIS 6 HE1 HIS 6 -16.495 -3.247 -27.109 48 HE2 HIS 6 HE2 HIS 6 -14.820 -3.312 -28.990 49 H HIS 7 H HIS 7 -12.656 -3.267 -22.188 50 HA HIS 7 HA HIS 7 -10.143 -4.222 -20.989 51 HB2 HIS 7 HB2 HIS 7 -12.200 -2.278 -20.134 52 HB3 HIS 7 HB3 HIS 7 -11.586 -3.333 -18.866 53 HD1 HIS 7 HD1 HIS 7 -9.241 -2.895 -18.010 54 HD2 HIS 7 HD2 HIS 7 -10.247 -0.544 -21.285 55 HE1 HIS 7 HE1 HIS 7 -7.414 -1.177 -18.189 56 HE2 HIS 7 HE2 HIS 7 -8.042 0.236 -20.179 57 H HIS 8 H HIS 8 -10.394 -5.589 -19.022 58 HA HIS 8 HA HIS 8 -12.255 -7.750 -19.555 59 HB2 HIS 8 HB2 HIS 8 -9.975 -7.442 -17.595 60 HB3 HIS 8 HB3 HIS 8 -11.000 -8.871 -17.659 61 HD1 HIS 8 HD1 HIS 8 -10.649 -10.495 -19.618 62 HD2 HIS 8 HD2 HIS 8 -8.171 -7.161 -19.739 63 HE1 HIS 8 HE1 HIS 8 -8.913 -11.011 -21.363 64 HE2 HIS 8 HE2 HIS 8 -7.423 -8.979 -21.420 65 H HIS 9 H HIS 9 -13.551 -8.737 -17.861 66 HA HIS 9 HA HIS 9 -14.900 -6.724 -16.250 67 HB2 HIS 9 HB2 HIS 9 -15.578 -9.575 -16.966 68 HB3 HIS 9 HB3 HIS 9 -16.522 -8.640 -15.813 69 HD1 HIS 9 HD1 HIS 9 -18.086 -6.847 -16.743 70 HD2 HIS 9 HD2 HIS 9 -15.803 -8.730 -19.661 71 HE1 HIS 9 HE1 HIS 9 -19.085 -6.139 -18.940 72 HE2 HIS 9 HE2 HIS 9 -17.687 -7.289 -20.692 73 H HIS 10 H HIS 10 -13.180 -9.796 -15.771 74 HA HIS 10 HA HIS 10 -13.458 -9.623 -12.880 75 HB2 HIS 10 HB2 HIS 10 -12.222 -11.668 -14.719 76 HB3 HIS 10 HB3 HIS 10 -12.048 -11.756 -12.969 77 HD1 HIS 10 HD1 HIS 10 -14.484 -12.310 -15.719 78 HD2 HIS 10 HD2 HIS 10 -14.427 -12.380 -11.565 79 HE1 HIS 10 HE1 HIS 10 -16.623 -13.441 -15.036 80 HE2 HIS 10 HE2 HIS 10 -16.568 -13.474 -12.518 81 H GLY 11 H GLY 11 -10.824 -9.519 -15.284 82 HA2 GLY 11 HA2 GLY 11 -8.942 -8.101 -15.147 83 HA3 GLY 11 HA3 GLY 11 -9.240 -7.905 -13.428 84 H SER 12 H SER 12 -6.939 -8.862 -15.307 85 HA SER 12 HA SER 12 -6.316 -11.457 -14.116 86 HB2 SER 12 HB2 SER 12 -5.337 -9.907 -16.434 87 HB3 SER 12 HB3 SER 12 -4.120 -10.853 -15.562 88 HG SER 12 HG SER 12 -6.597 -11.921 -16.469 89 H ALA 13 H ALA 13 -4.189 -11.860 -13.216 90 HA ALA 13 HA ALA 13 -2.562 -9.698 -12.435 91 HB1 ALA 13 HB1 ALA 13 -4.100 -11.189 -10.316 92 HB2 ALA 13 HB2 ALA 13 -4.143 -9.457 -10.647 93 HB3 ALA 13 HB3 ALA 13 -2.689 -10.190 -9.970 94 H THR 14 H THR 14 -0.650 -10.478 -12.975 95 HA THR 14 HA THR 14 -0.044 -13.274 -12.718 96 HB THR 14 HB THR 14 0.469 -12.170 -14.834 97 HG1 THR 14 HG1 THR 14 1.968 -13.822 -13.596 98 HG21 THR 14 HG21 THR 14 2.294 -10.565 -15.055 99 HG22 THR 14 HG22 THR 14 2.527 -10.563 -13.307 100 HG23 THR 14 HG23 THR 14 1.036 -9.922 -13.998 101 H TYR 15 H TYR 15 0.182 -10.749 -10.661 102 HA TYR 15 HA TYR 15 2.744 -11.378 -9.562 103 HB2 TYR 15 HB2 TYR 15 1.019 -9.087 -9.566 104 HB3 TYR 15 HB3 TYR 15 1.673 -9.433 -7.974 105 HD1 TYR 15 HD1 TYR 15 4.247 -9.750 -7.834 106 HD2 TYR 15 HD2 TYR 15 2.280 -7.912 -11.127 107 HE1 TYR 15 HE1 TYR 15 6.363 -8.680 -8.490 108 HE2 TYR 15 HE2 TYR 15 4.389 -6.838 -11.794 109 HH TYR 15 HH TYR 15 6.518 -6.185 -10.806 110 H THR 16 H THR 16 3.142 -12.234 -7.723 111 HA THR 16 HA THR 16 1.004 -13.734 -6.519 112 HB THR 16 HB THR 16 2.910 -14.820 -5.217 113 HG1 THR 16 HG1 THR 16 4.258 -12.834 -6.409 114 HG21 THR 16 HG21 THR 16 2.940 -14.974 -8.230 115 HG22 THR 16 HG22 THR 16 1.883 -15.887 -7.153 116 HG23 THR 16 HG23 THR 16 3.623 -16.176 -7.134 117 H ARG 17 H ARG 17 0.902 -14.003 -4.142 118 HA ARG 17 HA ARG 17 0.784 -11.501 -2.808 119 HB2 ARG 17 HB2 ARG 17 -0.594 -13.909 -2.663 120 HB3 ARG 17 HB3 ARG 17 0.279 -13.825 -1.140 121 HG2 ARG 17 HG2 ARG 17 -1.268 -12.458 -0.331 122 HG3 ARG 17 HG3 ARG 17 -0.959 -11.300 -1.623 123 HD2 ARG 17 HD2 ARG 17 -3.307 -11.984 -1.568 124 HD3 ARG 17 HD3 ARG 17 -2.528 -12.465 -3.072 125 HE ARG 17 HE ARG 17 -2.465 -14.737 -2.218 126 HH11 ARG 17 HH11 ARG 17 -4.569 -12.502 -0.484 127 HH12 ARG 17 HH12 ARG 17 -5.574 -13.825 0.208 128 HH21 ARG 17 HH21 ARG 17 -5.106 -15.998 -0.278 129 HH22 ARG 17 HH22 ARG 17 -3.724 -16.415 -1.356 130 HA PRO 18 HA PRO 18 4.973 -12.090 -1.047 131 HB2 PRO 18 HB2 PRO 18 4.357 -9.555 0.323 132 HB3 PRO 18 HB3 PRO 18 5.700 -9.944 -0.761 133 HG2 PRO 18 HG2 PRO 18 3.719 -8.329 -1.538 134 HG3 PRO 18 HG3 PRO 18 4.505 -9.453 -2.664 135 HD2 PRO 18 HD2 PRO 18 1.854 -9.694 -1.306 136 HD3 PRO 18 HD3 PRO 18 2.325 -10.134 -2.963 137 H LEU 19 H LEU 19 1.988 -11.442 0.631 138 HA LEU 19 HA LEU 19 2.968 -12.773 3.020 139 HB2 LEU 19 HB2 LEU 19 2.239 -10.058 2.868 140 HB3 LEU 19 HB3 LEU 19 0.996 -10.872 3.749 141 HG LEU 19 HG LEU 19 2.715 -9.758 5.144 142 HD11 LEU 19 HD11 LEU 19 3.111 -11.800 6.627 143 HD12 LEU 19 HD12 LEU 19 2.249 -12.725 5.397 144 HD13 LEU 19 HD13 LEU 19 1.435 -11.398 6.239 145 HD21 LEU 19 HD21 LEU 19 4.642 -10.406 3.629 146 HD22 LEU 19 HD22 LEU 19 4.557 -12.006 4.365 147 HD23 LEU 19 HD23 LEU 19 4.911 -10.596 5.361 148 H ASP 20 H ASP 20 0.917 -12.755 4.456 149 HA ASP 20 HA ASP 20 -1.349 -13.824 3.030 150 HB2 ASP 20 HB2 ASP 20 0.353 -15.196 4.823 151 HB3 ASP 20 HB3 ASP 20 -1.240 -15.033 5.551 152 H THR 21 H THR 21 0.005 -11.973 5.508 153 HA THR 21 HA THR 21 -2.289 -10.498 6.037 154 HB THR 21 HB THR 21 -2.865 -12.588 7.257 155 HG1 THR 21 HG1 THR 21 -3.522 -11.440 9.180 156 HG21 THR 21 HG21 THR 21 -0.603 -11.798 9.100 157 HG22 THR 21 HG22 THR 21 -0.694 -13.258 8.115 158 HG23 THR 21 HG23 THR 21 -1.818 -13.027 9.454 159 H GLY 22 H GLY 22 -1.793 -9.472 8.442 160 HA2 GLY 22 HA2 GLY 22 0.797 -8.883 9.251 161 HA3 GLY 22 HA3 GLY 22 0.293 -7.636 8.119 162 H ASN 23 H ASN 23 0.332 -8.537 11.339 163 HA ASN 23 HA ASN 23 -1.364 -6.360 12.106 164 HB2 ASN 23 HB2 ASN 23 -2.640 -7.861 13.747 165 HB3 ASN 23 HB3 ASN 23 -3.120 -7.932 12.057 166 HD21 ASN 23 HD21 ASN 23 -2.196 -9.681 10.767 167 HD22 ASN 23 HD22 ASN 23 -1.889 -11.204 11.516 168 H ILE 24 H ILE 24 -0.603 -5.276 13.607 169 HA ILE 24 HA ILE 24 1.444 -6.436 15.329 170 HB ILE 24 HB ILE 24 1.013 -3.565 15.418 171 HG12 ILE 24 HG12 ILE 24 2.609 -3.391 13.319 172 HG13 ILE 24 HG13 ILE 24 1.875 -4.934 12.913 173 HG21 ILE 24 HG21 ILE 24 3.478 -3.504 15.455 174 HG22 ILE 24 HG22 ILE 24 3.479 -5.251 15.251 175 HG23 ILE 24 HG23 ILE 24 2.786 -4.541 16.703 176 HD11 ILE 24 HD11 ILE 24 0.606 -2.248 13.096 177 HD12 ILE 24 HD12 ILE 24 -0.358 -3.714 13.327 178 HD13 ILE 24 HD13 ILE 24 0.511 -3.452 11.808 179 H THR 25 H THR 25 -0.739 -7.282 16.031 180 HA THR 25 HA THR 25 -1.849 -5.671 18.221 181 HB THR 25 HB THR 25 -3.525 -6.489 16.691 182 HG1 THR 25 HG1 THR 25 -4.796 -6.872 18.325 183 HG21 THR 25 HG21 THR 25 -3.947 -8.770 16.169 184 HG22 THR 25 HG22 THR 25 -2.769 -9.328 17.357 185 HG23 THR 25 HG23 THR 25 -2.224 -8.497 15.899 186 H THR 26 H THR 26 -0.065 -8.531 17.504 187 HA THR 26 HA THR 26 0.024 -9.255 20.357 188 HB THR 26 HB THR 26 0.728 -11.195 18.174 189 HG1 THR 26 HG1 THR 26 -1.317 -11.034 17.592 190 HG21 THR 26 HG21 THR 26 1.346 -11.851 20.425 191 HG22 THR 26 HG22 THR 26 0.002 -12.851 19.873 192 HG23 THR 26 HG23 THR 26 -0.289 -11.527 21.002 193 H GLY 27 H GLY 27 2.012 -9.816 17.521 194 HA2 GLY 27 HA2 GLY 27 4.268 -8.352 18.492 195 HA3 GLY 27 HA3 GLY 27 4.482 -10.081 18.722 196 H PHE 28 H PHE 28 5.265 -7.638 16.739 197 HA PHE 28 HA PHE 28 4.840 -8.875 14.212 198 HB2 PHE 28 HB2 PHE 28 5.288 -6.275 14.983 199 HB3 PHE 28 HB3 PHE 28 6.781 -6.723 14.166 200 HD1 PHE 28 HD1 PHE 28 6.889 -6.687 11.853 201 HD2 PHE 28 HD2 PHE 28 3.073 -6.838 13.719 202 HE1 PHE 28 HE1 PHE 28 5.818 -6.440 9.663 203 HE2 PHE 28 HE2 PHE 28 1.992 -6.597 11.522 204 HZ PHE 28 HZ PHE 28 3.367 -6.406 9.498 205 H ASN 29 H ASN 29 6.404 -9.281 12.650 206 HA ASN 29 HA ASN 29 8.074 -11.317 13.318 207 HB2 ASN 29 HB2 ASN 29 7.752 -9.630 10.894 208 HB3 ASN 29 HB3 ASN 29 8.876 -10.967 10.915 209 HD21 ASN 29 HD21 ASN 29 5.683 -9.972 10.626 210 HD22 ASN 29 HD22 ASN 29 4.956 -11.517 10.419 211 H GLY 30 H GLY 30 8.903 -8.971 14.784 212 HA2 GLY 30 HA2 GLY 30 11.139 -8.743 15.680 213 HA3 GLY 30 HA3 GLY 30 11.769 -9.057 14.067 214 H TYR 31 H TYR 31 9.151 -7.202 13.647 215 HA TYR 31 HA TYR 31 10.740 -4.702 13.546 216 HB2 TYR 31 HB2 TYR 31 8.036 -5.129 12.263 217 HB3 TYR 31 HB3 TYR 31 9.204 -3.875 11.913 218 HD1 TYR 31 HD1 TYR 31 8.860 -7.612 11.732 219 HD2 TYR 31 HD2 TYR 31 10.545 -4.088 10.038 220 HE1 TYR 31 HE1 TYR 31 9.720 -8.935 9.853 221 HE2 TYR 31 HE2 TYR 31 11.418 -5.409 8.160 222 HH TYR 31 HH TYR 31 12.015 -7.738 7.662 223 HA PRO 32 HA PRO 32 7.948 -4.049 17.196 224 HB2 PRO 32 HB2 PRO 32 10.101 -2.567 18.438 225 HB3 PRO 32 HB3 PRO 32 9.390 -4.104 18.943 226 HG2 PRO 32 HG2 PRO 32 11.933 -3.883 18.001 227 HG3 PRO 32 HG3 PRO 32 10.953 -5.354 17.849 228 HD2 PRO 32 HD2 PRO 32 11.497 -3.235 15.808 229 HD3 PRO 32 HD3 PRO 32 11.448 -5.003 15.621 230 H GLY 33 H GLY 33 6.659 -2.327 17.583 231 HA2 GLY 33 HA2 GLY 33 6.049 -0.068 17.793 232 HA3 GLY 33 HA3 GLY 33 7.588 0.395 17.085 233 H HIS 34 H HIS 34 6.240 -1.968 15.207 234 HA HIS 34 HA HIS 34 5.741 -0.286 13.019 235 HB2 HIS 34 HB2 HIS 34 6.621 -2.745 13.158 236 HB3 HIS 34 HB3 HIS 34 4.917 -3.169 13.149 237 HD1 HIS 34 HD1 HIS 34 4.398 -3.976 10.858 238 HD2 HIS 34 HD2 HIS 34 6.895 -0.673 10.786 239 HE1 HIS 34 HE1 HIS 34 4.715 -3.353 8.429 240 H VAL 35 H VAL 35 3.901 0.569 12.332 241 HA VAL 35 HA VAL 35 1.390 -0.083 13.705 242 HB VAL 35 HB VAL 35 0.830 2.174 12.285 243 HG11 VAL 35 HG11 VAL 35 1.496 1.601 15.093 244 HG12 VAL 35 HG12 VAL 35 0.076 2.396 14.404 245 HG13 VAL 35 HG13 VAL 35 1.576 3.296 14.624 246 HG21 VAL 35 HG21 VAL 35 3.670 2.506 13.224 247 HG22 VAL 35 HG22 VAL 35 2.624 3.797 12.633 248 HG23 VAL 35 HG23 VAL 35 3.120 2.498 11.548 249 H GLY 36 H GLY 36 2.881 -1.062 11.019 250 HA2 GLY 36 HA2 GLY 36 0.358 -1.469 9.596 251 HA3 GLY 36 HA3 GLY 36 1.695 -0.735 8.721 252 H VAL 37 H VAL 37 1.827 -2.401 7.281 253 HA VAL 37 HA VAL 37 3.114 -4.823 8.293 254 HB VAL 37 HB VAL 37 0.800 -5.431 7.803 255 HG11 VAL 37 HG11 VAL 37 1.356 -4.138 5.189 256 HG12 VAL 37 HG12 VAL 37 -0.067 -4.018 6.222 257 HG13 VAL 37 HG13 VAL 37 0.207 -5.472 5.259 258 HG21 VAL 37 HG21 VAL 37 1.216 -7.260 6.131 259 HG22 VAL 37 HG22 VAL 37 2.366 -7.194 7.469 260 HG23 VAL 37 HG23 VAL 37 2.821 -6.574 5.884 261 H ASP 38 H ASP 38 4.651 -5.799 6.868 262 HA ASP 38 HA ASP 38 5.484 -4.105 4.608 263 HB2 ASP 38 HB2 ASP 38 7.238 -5.280 6.775 264 HB3 ASP 38 HB3 ASP 38 7.871 -4.612 5.272 265 H TYR 39 H TYR 39 6.068 -5.012 2.806 266 HA TYR 39 HA TYR 39 6.183 -7.958 2.642 267 HB2 TYR 39 HB2 TYR 39 5.027 -6.246 0.453 268 HB3 TYR 39 HB3 TYR 39 4.905 -7.973 0.656 269 HD1 TYR 39 HD1 TYR 39 3.784 -4.756 2.066 270 HD2 TYR 39 HD2 TYR 39 2.984 -8.911 1.719 271 HE1 TYR 39 HE1 TYR 39 1.556 -4.401 3.009 272 HE2 TYR 39 HE2 TYR 39 0.746 -8.562 2.674 273 HH TYR 39 HH TYR 39 -0.638 -5.493 3.027 274 H ALA 40 H ALA 40 8.257 -8.345 2.213 275 HA ALA 40 HA ALA 40 10.094 -6.718 0.938 276 HB1 ALA 40 HB1 ALA 40 10.687 -8.621 2.372 277 HB2 ALA 40 HB2 ALA 40 11.549 -8.642 0.834 278 HB3 ALA 40 HB3 ALA 40 10.178 -9.721 1.091 279 H VAL 41 H VAL 41 9.821 -5.897 -1.023 280 HA VAL 41 HA VAL 41 9.698 -7.663 -3.295 281 HB VAL 41 HB VAL 41 7.311 -7.168 -2.788 282 HG11 VAL 41 HG11 VAL 41 7.411 -4.957 -1.878 283 HG12 VAL 41 HG12 VAL 41 6.404 -4.923 -3.326 284 HG13 VAL 41 HG13 VAL 41 8.059 -4.315 -3.387 285 HG21 VAL 41 HG21 VAL 41 7.940 -7.749 -5.043 286 HG22 VAL 41 HG22 VAL 41 8.328 -6.066 -5.401 287 HG23 VAL 41 HG23 VAL 41 6.660 -6.535 -5.075 288 HA PRO 42 HA PRO 42 12.974 -4.857 -4.602 289 HB2 PRO 42 HB2 PRO 42 11.978 -5.634 -7.310 290 HB3 PRO 42 HB3 PRO 42 13.629 -5.636 -6.673 291 HG2 PRO 42 HG2 PRO 42 12.301 -7.912 -6.941 292 HG3 PRO 42 HG3 PRO 42 13.351 -7.626 -5.538 293 HD2 PRO 42 HD2 PRO 42 10.380 -7.622 -5.697 294 HD3 PRO 42 HD3 PRO 42 11.446 -8.101 -4.362 295 H VAL 43 H VAL 43 13.248 -2.973 -5.105 296 HA VAL 43 HA VAL 43 11.272 -1.047 -5.256 297 HB VAL 43 HB VAL 43 13.345 -0.594 -4.234 298 HG11 VAL 43 HG11 VAL 43 14.641 -1.323 -6.828 299 HG12 VAL 43 HG12 VAL 43 14.897 -2.008 -5.220 300 HG13 VAL 43 HG13 VAL 43 15.480 -0.385 -5.590 301 HG21 VAL 43 HG21 VAL 43 13.615 1.576 -4.879 302 HG22 VAL 43 HG22 VAL 43 12.236 1.208 -5.923 303 HG23 VAL 43 HG23 VAL 43 13.873 1.137 -6.565 304 H GLY 44 H GLY 44 10.429 0.205 -6.861 305 HA2 GLY 44 HA2 GLY 44 10.526 1.228 -9.014 306 HA3 GLY 44 HA3 GLY 44 11.491 -0.127 -9.544 307 H THR 45 H THR 45 9.036 -1.420 -7.774 308 HA THR 45 HA THR 45 7.599 -2.212 -10.112 309 HB THR 45 HB THR 45 6.859 -3.026 -7.322 310 HG1 THR 45 HG1 THR 45 9.240 -3.434 -8.505 311 HG21 THR 45 HG21 THR 45 6.756 -4.482 -9.973 312 HG22 THR 45 HG22 THR 45 5.381 -3.753 -9.143 313 HG23 THR 45 HG23 THR 45 6.216 -5.129 -8.423 314 HA PRO 46 HA PRO 46 4.613 1.129 -9.682 315 HB2 PRO 46 HB2 PRO 46 2.773 -0.675 -11.158 316 HB3 PRO 46 HB3 PRO 46 3.263 0.982 -11.535 317 HG2 PRO 46 HG2 PRO 46 4.208 -1.064 -12.946 318 HG3 PRO 46 HG3 PRO 46 5.232 0.330 -12.544 319 HD2 PRO 46 HD2 PRO 46 5.198 -2.398 -11.329 320 HD3 PRO 46 HD3 PRO 46 6.571 -1.329 -11.682 321 H VAL 47 H VAL 47 3.408 1.536 -7.989 322 HA VAL 47 HA VAL 47 1.964 -0.551 -6.643 323 HB VAL 47 HB VAL 47 2.524 2.183 -5.512 324 HG11 VAL 47 HG11 VAL 47 1.819 -0.442 -4.198 325 HG12 VAL 47 HG12 VAL 47 0.777 0.971 -4.361 326 HG13 VAL 47 HG13 VAL 47 2.211 1.047 -3.337 327 HG21 VAL 47 HG21 VAL 47 4.244 0.500 -4.181 328 HG22 VAL 47 HG22 VAL 47 4.705 1.645 -5.440 329 HG23 VAL 47 HG23 VAL 47 4.385 -0.039 -5.853 330 H ARG 48 H ARG 48 0.001 -0.680 -6.831 331 HA ARG 48 HA ARG 48 -1.515 1.490 -7.907 332 HB2 ARG 48 HB2 ARG 48 -2.067 -1.460 -7.837 333 HB3 ARG 48 HB3 ARG 48 -3.278 -0.290 -8.342 334 HG2 ARG 48 HG2 ARG 48 -2.323 0.037 -10.348 335 HG3 ARG 48 HG3 ARG 48 -0.677 -0.118 -9.717 336 HD2 ARG 48 HD2 ARG 48 -0.893 -2.518 -9.638 337 HD3 ARG 48 HD3 ARG 48 -2.589 -2.416 -10.106 338 HE ARG 48 HE ARG 48 -0.986 -1.179 -12.066 339 HH11 ARG 48 HH11 ARG 48 -1.461 -5.186 -12.418 340 HH12 ARG 48 HH12 ARG 48 -1.788 -4.386 -10.837 341 HH21 ARG 48 HH21 ARG 48 -0.784 -3.951 -14.213 342 HH22 ARG 48 HH22 ARG 48 -0.571 -2.168 -14.066 343 H ALA 49 H ALA 49 -3.602 1.984 -7.197 344 HA ALA 49 HA ALA 49 -3.722 2.153 -4.377 345 HB1 ALA 49 HB1 ALA 49 -5.745 2.969 -6.458 346 HB2 ALA 49 HB2 ALA 49 -4.510 3.998 -5.734 347 HB3 ALA 49 HB3 ALA 49 -5.832 3.379 -4.745 348 H VAL 50 H VAL 50 -4.487 0.657 -3.065 349 HA VAL 50 HA VAL 50 -5.782 -1.659 -3.921 350 HB VAL 50 HB VAL 50 -5.660 -0.679 -1.124 351 HG11 VAL 50 HG11 VAL 50 -5.634 -3.105 -0.551 352 HG12 VAL 50 HG12 VAL 50 -6.006 -3.446 -2.240 353 HG13 VAL 50 HG13 VAL 50 -7.153 -2.542 -1.251 354 HG21 VAL 50 HG21 VAL 50 -3.437 -0.653 -1.872 355 HG22 VAL 50 HG22 VAL 50 -3.638 -2.162 -2.755 356 HG23 VAL 50 HG23 VAL 50 -3.618 -2.168 -0.991 357 H ALA 51 H ALA 51 -7.142 1.368 -3.258 358 HA ALA 51 HA ALA 51 -9.731 0.613 -3.972 359 HB1 ALA 51 HB1 ALA 51 -10.112 -0.255 -1.828 360 HB2 ALA 51 HB2 ALA 51 -10.800 1.371 -1.771 361 HB3 ALA 51 HB3 ALA 51 -9.217 1.055 -1.059 362 H ASN 52 H ASN 52 -10.965 2.327 -4.503 363 HA ASN 52 HA ASN 52 -9.783 4.743 -5.082 364 HB2 ASN 52 HB2 ASN 52 -12.225 5.453 -5.454 365 HB3 ASN 52 HB3 ASN 52 -11.580 4.175 -6.420 366 HD21 ASN 52 HD21 ASN 52 -12.668 3.947 -3.134 367 HD22 ASN 52 HD22 ASN 52 -13.990 2.881 -3.433 368 H GLY 53 H GLY 53 -10.311 6.881 -4.358 369 HA2 GLY 53 HA2 GLY 53 -11.806 7.638 -2.180 370 HA3 GLY 53 HA3 GLY 53 -10.276 7.111 -1.503 371 H THR 54 H THR 54 -9.067 8.798 -0.999 372 HA THR 54 HA THR 54 -8.583 10.908 -2.842 373 HB THR 54 HB THR 54 -9.477 11.472 -0.078 374 HG1 THR 54 HG1 THR 54 -11.128 10.664 -1.662 375 HG21 THR 54 HG21 THR 54 -8.017 13.209 -1.019 376 HG22 THR 54 HG22 THR 54 -9.661 13.815 -0.812 377 HG23 THR 54 HG23 THR 54 -9.089 13.345 -2.413 378 H VAL 55 H VAL 55 -6.572 11.766 -2.589 379 HA VAL 55 HA VAL 55 -4.717 10.403 -0.900 380 HB VAL 55 HB VAL 55 -4.125 12.700 -2.764 381 HG11 VAL 55 HG11 VAL 55 -2.294 12.150 -1.289 382 HG12 VAL 55 HG12 VAL 55 -1.900 11.676 -2.942 383 HG13 VAL 55 HG13 VAL 55 -2.386 10.453 -1.765 384 HG21 VAL 55 HG21 VAL 55 -3.650 11.129 -4.550 385 HG22 VAL 55 HG22 VAL 55 -5.324 10.965 -4.027 386 HG23 VAL 55 HG23 VAL 55 -4.123 9.781 -3.517 387 H LYS 56 H LYS 56 -4.530 11.094 1.065 388 HA LYS 56 HA LYS 56 -4.989 13.829 1.854 389 HB2 LYS 56 HB2 LYS 56 -4.245 11.901 3.963 390 HB3 LYS 56 HB3 LYS 56 -5.483 13.139 3.975 391 HG2 LYS 56 HG2 LYS 56 -5.662 10.374 2.811 392 HG3 LYS 56 HG3 LYS 56 -6.542 11.022 4.188 393 HD2 LYS 56 HD2 LYS 56 -6.836 12.335 1.531 394 HD3 LYS 56 HD3 LYS 56 -7.674 10.809 1.814 395 HE2 LYS 56 HE2 LYS 56 -8.690 11.837 3.864 396 HE3 LYS 56 HE3 LYS 56 -7.977 13.374 3.377 397 HZ1 LYS 56 HZ1 LYS 56 -9.935 11.795 1.797 398 HZ2 LYS 56 HZ2 LYS 56 -9.246 13.263 1.320 399 HZ3 LYS 56 HZ3 LYS 56 -10.273 13.209 2.663 400 H PHE 57 H PHE 57 -2.479 11.774 1.138 401 HA PHE 57 HA PHE 57 -0.487 13.704 1.784 402 HB2 PHE 57 HB2 PHE 57 -0.803 12.121 3.857 403 HB3 PHE 57 HB3 PHE 57 0.048 10.952 2.854 404 HD1 PHE 57 HD1 PHE 57 0.354 13.926 4.892 405 HD2 PHE 57 HD2 PHE 57 2.361 11.386 2.129 406 HE1 PHE 57 HE1 PHE 57 2.510 14.910 5.556 407 HE2 PHE 57 HE2 PHE 57 4.516 12.361 2.789 408 HZ PHE 57 HZ PHE 57 4.595 14.127 4.506 409 H ALA 58 H ALA 58 1.237 13.536 0.515 410 HA ALA 58 HA ALA 58 1.747 11.276 -1.142 411 HB1 ALA 58 HB1 ALA 58 1.784 12.702 -3.230 412 HB2 ALA 58 HB2 ALA 58 0.899 13.920 -2.310 413 HB3 ALA 58 HB3 ALA 58 0.184 12.335 -2.591 414 H GLY 59 H GLY 59 3.634 11.129 -0.107 415 HA2 GLY 59 HA2 GLY 59 5.517 13.344 -0.080 416 HA3 GLY 59 HA3 GLY 59 5.733 11.781 0.701 417 H ASN 60 H ASN 60 6.001 13.597 -2.227 418 HA ASN 60 HA ASN 60 6.880 11.545 -3.956 419 HB2 ASN 60 HB2 ASN 60 7.028 14.549 -4.119 420 HB3 ASN 60 HB3 ASN 60 7.624 13.498 -5.399 421 HD21 ASN 60 HD21 ASN 60 4.790 13.231 -3.326 422 HD22 ASN 60 HD22 ASN 60 3.656 13.208 -4.607 423 H GLY 61 H GLY 61 8.639 10.604 -4.081 424 HA2 GLY 61 HA2 GLY 61 10.989 11.324 -2.558 425 HA3 GLY 61 HA3 GLY 61 10.773 9.873 -3.520 426 H ALA 62 H ALA 62 9.920 12.337 -5.495 427 HA ALA 62 HA ALA 62 12.291 12.160 -7.025 428 HB1 ALA 62 HB1 ALA 62 9.923 13.936 -7.486 429 HB2 ALA 62 HB2 ALA 62 10.029 12.256 -8.015 430 HB3 ALA 62 HB3 ALA 62 11.135 13.460 -8.676 431 H ASN 63 H ASN 63 10.939 14.520 -4.882 432 HA ASN 63 HA ASN 63 13.298 16.151 -5.173 433 HB2 ASN 63 HB2 ASN 63 10.874 16.895 -6.274 434 HB3 ASN 63 HB3 ASN 63 11.034 17.836 -4.806 435 HD21 ASN 63 HD21 ASN 63 11.999 17.379 -7.985 436 HD22 ASN 63 HD22 ASN 63 13.147 18.657 -8.085 437 H HIS 64 H HIS 64 12.090 14.310 -3.075 438 HA HIS 64 HA HIS 64 11.349 16.008 -0.992 439 HB2 HIS 64 HB2 HIS 64 11.226 13.997 0.363 440 HB3 HIS 64 HB3 HIS 64 10.346 13.825 -1.126 441 HD1 HIS 64 HD1 HIS 64 13.492 13.219 -2.387 442 HD2 HIS 64 HD2 HIS 64 11.158 11.102 0.323 443 HE1 HIS 64 HE1 HIS 64 14.395 10.873 -2.408 444 HE2 HIS 64 HE2 HIS 64 12.967 9.609 -0.764 445 HA PRO 65 HA PRO 65 15.581 16.874 0.412 446 HB2 PRO 65 HB2 PRO 65 14.099 18.244 2.585 447 HB3 PRO 65 HB3 PRO 65 15.335 18.901 1.491 448 HG2 PRO 65 HG2 PRO 65 12.833 19.617 1.200 449 HG3 PRO 65 HG3 PRO 65 13.813 19.221 -0.233 450 HD2 PRO 65 HD2 PRO 65 11.850 17.474 1.233 451 HD3 PRO 65 HD3 PRO 65 11.997 17.825 -0.490 452 H TRP 66 H TRP 66 16.762 16.440 2.328 453 HA TRP 66 HA TRP 66 15.549 14.360 3.940 454 HB2 TRP 66 HB2 TRP 66 18.446 15.164 3.742 455 HB3 TRP 66 HB3 TRP 66 17.802 13.878 4.753 456 HD1 TRP 66 HD1 TRP 66 18.062 14.750 0.980 457 HE1 TRP 66 HE1 TRP 66 18.219 12.548 -0.341 458 HE3 TRP 66 HE3 TRP 66 17.538 11.424 4.845 459 HZ2 TRP 66 HZ2 TRP 66 18.137 9.779 0.177 460 HZ3 TRP 66 HZ3 TRP 66 17.589 9.018 4.338 461 HH2 TRP 66 HH2 TRP 66 17.882 8.214 2.052 462 H MET 67 H MET 67 15.461 17.458 3.947 463 HA MET 67 HA MET 67 16.484 18.184 6.493 464 HB2 MET 67 HB2 MET 67 15.581 19.552 4.205 465 HB3 MET 67 HB3 MET 67 14.530 20.046 5.524 466 HG2 MET 67 HG2 MET 67 16.488 20.693 6.838 467 HG3 MET 67 HG3 MET 67 17.534 20.211 5.503 468 HE1 MET 67 HE1 MET 67 17.804 24.114 5.434 469 HE2 MET 67 HE2 MET 67 18.698 22.594 5.488 470 HE3 MET 67 HE3 MET 67 17.686 23.071 6.851 471 H LEU 68 H LEU 68 13.311 17.580 5.108 472 HA LEU 68 HA LEU 68 12.367 17.232 7.859 473 HB2 LEU 68 HB2 LEU 68 10.153 17.991 7.231 474 HB3 LEU 68 HB3 LEU 68 11.342 19.224 6.899 475 HG LEU 68 HG LEU 68 11.169 18.086 4.455 476 HD11 LEU 68 HD11 LEU 68 8.410 17.840 5.690 477 HD12 LEU 68 HD12 LEU 68 9.432 16.501 5.166 478 HD13 LEU 68 HD13 LEU 68 8.802 17.644 3.981 479 HD21 LEU 68 HD21 LEU 68 9.655 19.949 3.896 480 HD22 LEU 68 HD22 LEU 68 10.992 20.456 4.929 481 HD23 LEU 68 HD23 LEU 68 9.383 20.229 5.616 482 H TRP 69 H TRP 69 13.504 15.447 5.506 483 HA TRP 69 HA TRP 69 11.403 13.421 5.850 484 HB2 TRP 69 HB2 TRP 69 12.999 13.536 3.306 485 HB3 TRP 69 HB3 TRP 69 11.477 12.710 3.609 486 HD1 TRP 69 HD1 TRP 69 12.596 16.441 3.716 487 HE1 TRP 69 HE1 TRP 69 10.813 17.852 2.561 488 HE3 TRP 69 HE3 TRP 69 9.354 12.718 2.382 489 HZ2 TRP 69 HZ2 TRP 69 8.378 17.462 1.210 490 HZ3 TRP 69 HZ3 TRP 69 7.327 13.338 1.150 491 HH2 TRP 69 HH2 TRP 69 6.845 15.659 0.574 492 H MET 70 H MET 70 12.020 11.350 6.191 493 HA MET 70 HA MET 70 14.848 10.641 6.096 494 HB2 MET 70 HB2 MET 70 13.220 10.855 8.585 495 HB3 MET 70 HB3 MET 70 14.359 9.522 8.458 496 HG2 MET 70 HG2 MET 70 15.072 12.426 8.118 497 HG3 MET 70 HG3 MET 70 15.283 11.500 9.603 498 HE1 MET 70 HE1 MET 70 17.731 13.011 8.530 499 HE2 MET 70 HE2 MET 70 18.987 11.773 8.538 500 HE3 MET 70 HE3 MET 70 17.836 11.870 9.870 501 H ALA 71 H ALA 71 11.489 9.744 6.269 502 HA ALA 71 HA ALA 71 12.004 6.897 6.124 503 HB1 ALA 71 HB1 ALA 71 9.402 8.401 5.958 504 HB2 ALA 71 HB2 ALA 71 10.108 7.712 7.420 505 HB3 ALA 71 HB3 ALA 71 9.581 6.653 6.113 506 H GLY 72 H GLY 72 11.388 9.488 3.962 507 HA2 GLY 72 HA2 GLY 72 11.959 9.342 1.650 508 HA3 GLY 72 HA3 GLY 72 11.580 7.631 1.705 509 H ASN 73 H ASN 73 9.990 7.224 0.377 510 HA ASN 73 HA ASN 73 7.973 9.150 -0.264 511 HB2 ASN 73 HB2 ASN 73 8.536 6.374 -1.271 512 HB3 ASN 73 HB3 ASN 73 7.174 7.341 -1.826 513 HD21 ASN 73 HD21 ASN 73 10.681 7.297 -1.563 514 HD22 ASN 73 HD22 ASN 73 10.977 8.256 -2.967 515 H ALA 74 H ALA 74 5.863 9.104 0.278 516 HA ALA 74 HA ALA 74 4.707 6.798 1.530 517 HB1 ALA 74 HB1 ALA 74 4.919 9.400 3.030 518 HB2 ALA 74 HB2 ALA 74 5.688 7.871 3.460 519 HB3 ALA 74 HB3 ALA 74 3.932 8.026 3.530 520 H VAL 75 H VAL 75 2.444 6.769 1.536 521 HA VAL 75 HA VAL 75 1.073 9.033 0.306 522 HB VAL 75 HB VAL 75 0.247 6.354 -0.713 523 HG11 VAL 75 HG11 VAL 75 -0.569 7.560 -2.551 524 HG12 VAL 75 HG12 VAL 75 0.455 8.952 -2.202 525 HG13 VAL 75 HG13 VAL 75 -0.906 8.574 -1.146 526 HG21 VAL 75 HG21 VAL 75 2.721 6.382 -1.044 527 HG22 VAL 75 HG22 VAL 75 2.519 7.835 -2.017 528 HG23 VAL 75 HG23 VAL 75 1.792 6.319 -2.541 529 H LEU 76 H LEU 76 -0.613 9.496 1.493 530 HA LEU 76 HA LEU 76 -2.020 7.347 2.877 531 HB2 LEU 76 HB2 LEU 76 -0.815 9.489 4.061 532 HB3 LEU 76 HB3 LEU 76 -2.455 10.042 3.924 533 HG LEU 76 HG LEU 76 -2.176 7.337 5.047 534 HD11 LEU 76 HD11 LEU 76 -0.174 8.340 5.999 535 HD12 LEU 76 HD12 LEU 76 -1.413 8.107 7.233 536 HD13 LEU 76 HD13 LEU 76 -1.122 9.715 6.569 537 HD21 LEU 76 HD21 LEU 76 -4.313 8.372 5.082 538 HD22 LEU 76 HD22 LEU 76 -3.661 9.850 5.789 539 HD23 LEU 76 HD23 LEU 76 -3.717 8.370 6.742 540 H ILE 77 H ILE 77 -3.944 7.137 2.462 541 HA ILE 77 HA ILE 77 -5.490 9.055 1.001 542 HB ILE 77 HB ILE 77 -4.796 6.294 0.085 543 HG12 ILE 77 HG12 ILE 77 -4.936 8.582 -1.772 544 HG13 ILE 77 HG13 ILE 77 -3.649 8.608 -0.569 545 HG21 ILE 77 HG21 ILE 77 -7.253 6.478 -0.080 546 HG22 ILE 77 HG22 ILE 77 -6.483 6.364 -1.662 547 HG23 ILE 77 HG23 ILE 77 -7.055 7.924 -1.071 548 HD11 ILE 77 HD11 ILE 77 -2.733 6.576 -1.396 549 HD12 ILE 77 HD12 ILE 77 -3.014 7.637 -2.777 550 HD13 ILE 77 HD13 ILE 77 -4.125 6.308 -2.445 551 H GLN 78 H GLN 78 -7.653 8.759 1.154 552 HA GLN 78 HA GLN 78 -8.636 7.190 3.344 553 HB2 GLN 78 HB2 GLN 78 -9.105 9.563 3.480 554 HB3 GLN 78 HB3 GLN 78 -9.848 9.544 1.894 555 HG2 GLN 78 HG2 GLN 78 -11.286 7.649 3.226 556 HG3 GLN 78 HG3 GLN 78 -10.979 8.827 4.486 557 HE21 GLN 78 HE21 GLN 78 -12.352 8.193 1.444 558 HE22 GLN 78 HE22 GLN 78 -13.405 9.549 1.358 559 H HIS 79 H HIS 79 -9.505 5.384 2.844 560 HA HIS 79 HA HIS 79 -10.127 4.527 0.245 561 HB2 HIS 79 HB2 HIS 79 -10.303 3.325 2.937 562 HB3 HIS 79 HB3 HIS 79 -11.204 2.563 1.629 563 HD1 HIS 79 HD1 HIS 79 -8.885 3.309 -0.500 564 HD2 HIS 79 HD2 HIS 79 -8.474 1.189 3.048 565 HE1 HIS 79 HE1 HIS 79 -6.787 1.939 -0.773 566 HE2 HIS 79 HE2 HIS 79 -6.571 0.649 1.379 567 H ALA 80 H ALA 80 -12.207 3.032 0.173 568 HA ALA 80 HA ALA 80 -14.230 4.804 -0.465 569 HB1 ALA 80 HB1 ALA 80 -13.767 2.668 -1.635 570 HB2 ALA 80 HB2 ALA 80 -15.471 2.938 -1.269 571 HB3 ALA 80 HB3 ALA 80 -14.521 1.831 -0.278 572 H ASP 81 H ASP 81 -13.610 3.292 2.491 573 HA ASP 81 HA ASP 81 -16.341 3.556 3.399 574 HB2 ASP 81 HB2 ASP 81 -14.305 1.677 3.964 575 HB3 ASP 81 HB3 ASP 81 -14.806 2.459 5.452 576 H GLY 82 H GLY 82 -13.430 5.149 3.398 577 HA2 GLY 82 HA2 GLY 82 -13.356 7.426 4.164 578 HA3 GLY 82 HA3 GLY 82 -14.340 6.949 5.537 579 H MET 83 H MET 83 -12.368 4.446 5.282 580 HA MET 83 HA MET 83 -10.761 5.122 7.427 581 HB2 MET 83 HB2 MET 83 -9.649 2.908 6.790 582 HB3 MET 83 HB3 MET 83 -11.305 2.889 7.304 583 HG2 MET 83 HG2 MET 83 -11.600 3.109 4.627 584 HG3 MET 83 HG3 MET 83 -10.115 2.165 4.733 585 HE1 MET 83 HE1 MET 83 -12.335 1.070 3.212 586 HE2 MET 83 HE2 MET 83 -12.869 -0.472 3.881 587 HE3 MET 83 HE3 MET 83 -11.153 -0.158 3.646 588 H HIS 84 H HIS 84 -8.274 4.695 7.331 589 HA HIS 84 HA HIS 84 -7.311 6.198 5.047 590 HB2 HIS 84 HB2 HIS 84 -6.382 6.236 7.906 591 HB3 HIS 84 HB3 HIS 84 -5.404 6.889 6.600 592 HD1 HIS 84 HD1 HIS 84 -5.952 9.214 5.801 593 HD2 HIS 84 HD2 HIS 84 -8.833 7.669 8.364 594 HE1 HIS 84 HE1 HIS 84 -7.482 11.139 6.332 595 HE2 HIS 84 HE2 HIS 84 -9.222 10.180 7.881 596 H THR 85 H THR 85 -5.359 5.563 4.033 597 HA THR 85 HA THR 85 -4.088 3.146 5.001 598 HB THR 85 HB THR 85 -4.088 2.847 2.263 599 HG1 THR 85 HG1 THR 85 -6.743 2.850 2.470 600 HG21 THR 85 HG21 THR 85 -5.923 1.549 4.271 601 HG22 THR 85 HG22 THR 85 -4.259 1.067 3.940 602 HG23 THR 85 HG23 THR 85 -5.493 0.894 2.693 603 H GLY 86 H GLY 86 -2.002 3.359 4.962 604 HA2 GLY 86 HA2 GLY 86 -0.796 5.480 3.329 605 HA3 GLY 86 HA3 GLY 86 -0.095 4.806 4.793 606 H TYR 87 H TYR 87 1.185 5.089 2.269 607 HA TYR 87 HA TYR 87 1.900 2.348 1.726 608 HB2 TYR 87 HB2 TYR 87 1.586 4.486 -0.414 609 HB3 TYR 87 HB3 TYR 87 2.078 2.823 -0.678 610 HD1 TYR 87 HD1 TYR 87 0.486 1.356 -1.512 611 HD2 TYR 87 HD2 TYR 87 -0.870 4.721 0.737 612 HE1 TYR 87 HE1 TYR 87 -1.862 0.740 -1.984 613 HE2 TYR 87 HE2 TYR 87 -3.194 4.092 0.274 614 HH TYR 87 HH TYR 87 -4.460 2.809 -1.401 615 H ALA 88 H ALA 88 3.804 2.442 2.827 616 HA ALA 88 HA ALA 88 5.543 4.754 2.271 617 HB1 ALA 88 HB1 ALA 88 5.276 3.088 4.757 618 HB2 ALA 88 HB2 ALA 88 5.014 4.817 4.558 619 HB3 ALA 88 HB3 ALA 88 6.647 4.158 4.475 620 H HIS 89 H HIS 89 7.876 4.354 2.557 621 HA HIS 89 HA HIS 89 9.831 3.471 1.875 622 HB2 HIS 89 HB2 HIS 89 8.409 0.848 2.395 623 HB3 HIS 89 HB3 HIS 89 10.109 0.956 1.948 624 HD1 HIS 89 HD1 HIS 89 7.762 2.088 4.702 625 HD2 HIS 89 HD2 HIS 89 11.808 1.407 4.041 626 HE1 HIS 89 HE1 HIS 89 8.865 2.361 6.945 627 HE2 HIS 89 HE2 HIS 89 11.314 1.944 6.523 628 H LEU 90 H LEU 90 8.085 4.344 -0.064 629 HA LEU 90 HA LEU 90 8.445 2.590 -2.332 630 HB2 LEU 90 HB2 LEU 90 6.983 5.204 -2.365 631 HB3 LEU 90 HB3 LEU 90 6.811 3.857 -3.463 632 HG LEU 90 HG LEU 90 5.985 3.679 -0.564 633 HD11 LEU 90 HD11 LEU 90 3.720 4.168 -1.280 634 HD12 LEU 90 HD12 LEU 90 4.280 4.451 -2.926 635 HD13 LEU 90 HD13 LEU 90 4.787 5.525 -1.623 636 HD21 LEU 90 HD21 LEU 90 4.453 1.928 -1.597 637 HD22 LEU 90 HD22 LEU 90 6.168 1.539 -1.462 638 HD23 LEU 90 HD23 LEU 90 5.494 2.026 -3.018 639 H SER 91 H SER 91 9.122 3.708 -4.422 640 HA SER 91 HA SER 91 11.394 5.392 -3.851 641 HB2 SER 91 HB2 SER 91 11.764 3.236 -5.071 642 HB3 SER 91 HB3 SER 91 10.836 3.904 -6.409 643 HG SER 91 HG SER 91 13.310 4.805 -5.370 644 H LYS 92 H LYS 92 8.274 5.621 -5.127 645 HA LYS 92 HA LYS 92 8.562 8.308 -5.848 646 HB2 LYS 92 HB2 LYS 92 9.065 6.426 -7.954 647 HB3 LYS 92 HB3 LYS 92 7.583 7.304 -8.296 648 HG2 LYS 92 HG2 LYS 92 8.639 9.294 -8.550 649 HG3 LYS 92 HG3 LYS 92 9.950 8.859 -7.453 650 HD2 LYS 92 HD2 LYS 92 10.957 7.453 -9.096 651 HD3 LYS 92 HD3 LYS 92 9.541 7.573 -10.144 652 HE2 LYS 92 HE2 LYS 92 9.992 9.899 -10.566 653 HE3 LYS 92 HE3 LYS 92 11.300 9.905 -9.383 654 HZ1 LYS 92 HZ1 LYS 92 11.269 8.324 -11.898 655 HZ2 LYS 92 HZ2 LYS 92 12.533 8.376 -10.776 656 HZ3 LYS 92 HZ3 LYS 92 12.128 9.762 -11.656 657 H ILE 93 H ILE 93 6.665 9.252 -6.608 658 HA ILE 93 HA ILE 93 4.218 7.780 -6.125 659 HB ILE 93 HB ILE 93 5.190 10.209 -4.866 660 HG12 ILE 93 HG12 ILE 93 3.156 9.493 -3.328 661 HG13 ILE 93 HG13 ILE 93 3.386 7.977 -4.187 662 HG21 ILE 93 HG21 ILE 93 2.313 10.228 -5.598 663 HG22 ILE 93 HG22 ILE 93 3.555 11.212 -6.371 664 HG23 ILE 93 HG23 ILE 93 3.189 11.435 -4.659 665 HD11 ILE 93 HD11 ILE 93 5.218 9.381 -2.297 666 HD12 ILE 93 HD12 ILE 93 5.885 8.297 -3.517 667 HD13 ILE 93 HD13 ILE 93 4.728 7.688 -2.336 668 H SER 94 H SER 94 2.455 8.333 -7.316 669 HA SER 94 HA SER 94 2.913 9.927 -9.700 670 HB2 SER 94 HB2 SER 94 2.318 7.381 -9.750 671 HB3 SER 94 HB3 SER 94 0.695 7.974 -9.388 672 HG SER 94 HG SER 94 1.543 7.720 -11.728 673 H VAL 95 H VAL 95 1.428 9.963 -6.762 674 HA VAL 95 HA VAL 95 -0.871 11.369 -7.651 675 HB VAL 95 HB VAL 95 -1.383 11.040 -5.053 676 HG11 VAL 95 HG11 VAL 95 -1.909 9.025 -7.221 677 HG12 VAL 95 HG12 VAL 95 -2.868 10.466 -6.881 678 HG13 VAL 95 HG13 VAL 95 -2.798 9.155 -5.704 679 HG21 VAL 95 HG21 VAL 95 0.451 9.786 -4.349 680 HG22 VAL 95 HG22 VAL 95 0.446 8.796 -5.809 681 HG23 VAL 95 HG23 VAL 95 -0.816 8.584 -4.596 682 H SER 96 H SER 96 -1.581 12.783 -5.515 683 HA SER 96 HA SER 96 0.469 14.455 -4.530 684 HB2 SER 96 HB2 SER 96 -1.520 15.617 -6.500 685 HB3 SER 96 HB3 SER 96 -0.398 16.559 -5.519 686 HG SER 96 HG SER 96 0.182 14.769 -7.628 687 H THR 97 H THR 97 -0.202 15.628 -2.807 688 HA THR 97 HA THR 97 -2.267 14.678 -1.261 689 HB THR 97 HB THR 97 -1.176 17.467 -0.976 690 HG1 THR 97 HG1 THR 97 0.292 15.315 -1.177 691 HG21 THR 97 HG21 THR 97 -1.396 17.035 1.424 692 HG22 THR 97 HG22 THR 97 -1.984 15.407 1.085 693 HG23 THR 97 HG23 THR 97 -2.944 16.808 0.609 694 H ASP 98 H ASP 98 -4.392 15.025 -1.176 695 HA ASP 98 HA ASP 98 -6.418 16.079 -1.185 696 HB2 ASP 98 HB2 ASP 98 -4.774 18.350 -2.083 697 HB3 ASP 98 HB3 ASP 98 -6.427 18.358 -2.692 698 H SER 99 H SER 99 -4.632 14.979 -3.761 699 HA SER 99 HA SER 99 -6.572 15.373 -5.812 700 HB2 SER 99 HB2 SER 99 -4.208 13.500 -5.722 701 HB3 SER 99 HB3 SER 99 -5.125 13.941 -7.164 702 HG SER 99 HG SER 99 -3.243 15.407 -5.729 703 H THR 100 H THR 100 -7.917 13.773 -6.695 704 HA THR 100 HA THR 100 -8.758 11.754 -4.877 705 HB THR 100 HB THR 100 -10.403 11.212 -6.764 706 HG1 THR 100 HG1 THR 100 -9.090 13.492 -7.736 707 HG21 THR 100 HG21 THR 100 -10.452 13.870 -5.352 708 HG22 THR 100 HG22 THR 100 -11.018 12.327 -4.707 709 HG23 THR 100 HG23 THR 100 -11.855 13.074 -6.071 710 H VAL 101 H VAL 101 -8.777 9.560 -5.220 711 HA VAL 101 HA VAL 101 -7.132 8.604 -7.382 712 HB VAL 101 HB VAL 101 -6.762 6.698 -5.534 713 HG11 VAL 101 HG11 VAL 101 -5.088 9.141 -6.001 714 HG12 VAL 101 HG12 VAL 101 -5.033 7.624 -6.901 715 HG13 VAL 101 HG13 VAL 101 -4.517 7.669 -5.214 716 HG21 VAL 101 HG21 VAL 101 -6.858 9.282 -4.005 717 HG22 VAL 101 HG22 VAL 101 -6.090 7.806 -3.427 718 HG23 VAL 101 HG23 VAL 101 -7.826 7.836 -3.719 719 H LYS 102 H LYS 102 -7.349 6.236 -7.720 720 HA LYS 102 HA LYS 102 -9.916 5.127 -7.222 721 HB2 LYS 102 HB2 LYS 102 -9.848 6.390 -9.414 722 HB3 LYS 102 HB3 LYS 102 -8.751 5.133 -9.922 723 HG2 LYS 102 HG2 LYS 102 -10.561 3.476 -9.346 724 HG3 LYS 102 HG3 LYS 102 -11.635 4.858 -9.143 725 HD2 LYS 102 HD2 LYS 102 -11.219 5.526 -11.460 726 HD3 LYS 102 HD3 LYS 102 -10.151 4.138 -11.669 727 HE2 LYS 102 HE2 LYS 102 -13.036 3.876 -10.853 728 HE3 LYS 102 HE3 LYS 102 -12.517 3.876 -12.537 729 HZ1 LYS 102 HZ1 LYS 102 -11.679 1.938 -10.446 730 HZ2 LYS 102 HZ2 LYS 102 -11.112 1.950 -12.039 731 HZ3 LYS 102 HZ3 LYS 102 -12.742 1.630 -11.726 732 H GLN 103 H GLN 103 -10.002 2.982 -7.237 733 HA GLN 103 HA GLN 103 -7.845 1.567 -6.333 734 HB2 GLN 103 HB2 GLN 103 -10.362 1.082 -6.141 735 HB3 GLN 103 HB3 GLN 103 -10.180 0.270 -7.682 736 HG2 GLN 103 HG2 GLN 103 -8.319 -0.547 -5.540 737 HG3 GLN 103 HG3 GLN 103 -10.007 -1.012 -5.353 738 HE21 GLN 103 HE21 GLN 103 -8.701 -0.609 -8.479 739 HE22 GLN 103 HE22 GLN 103 -8.589 -2.258 -8.875 740 H GLY 104 H GLY 104 -6.413 0.236 -7.199 741 HA2 GLY 104 HA2 GLY 104 -5.136 -0.922 -8.703 742 HA3 GLY 104 HA3 GLY 104 -6.398 -0.717 -9.853 743 H GLN 105 H GLN 105 -5.866 2.308 -8.926 744 HA GLN 105 HA GLN 105 -4.400 2.999 -11.259 745 HB2 GLN 105 HB2 GLN 105 -6.226 4.371 -10.305 746 HB3 GLN 105 HB3 GLN 105 -5.227 4.700 -8.908 747 HG2 GLN 105 HG2 GLN 105 -3.719 6.009 -10.220 748 HG3 GLN 105 HG3 GLN 105 -4.521 5.521 -11.717 749 HE21 GLN 105 HE21 GLN 105 -5.006 7.212 -8.672 750 HE22 GLN 105 HE22 GLN 105 -6.253 8.259 -9.234 751 H ILE 106 H ILE 106 -2.387 3.649 -11.484 752 HA ILE 106 HA ILE 106 -0.546 2.759 -9.598 753 HB ILE 106 HB ILE 106 -0.111 4.226 -12.127 754 HG12 ILE 106 HG12 ILE 106 0.611 1.368 -11.566 755 HG13 ILE 106 HG13 ILE 106 -1.022 1.804 -12.051 756 HG21 ILE 106 HG21 ILE 106 1.981 2.974 -10.356 757 HG22 ILE 106 HG22 ILE 106 1.771 4.701 -10.643 758 HG23 ILE 106 HG23 ILE 106 2.278 3.644 -11.961 759 HD11 ILE 106 HD11 ILE 106 -0.036 2.824 -14.114 760 HD12 ILE 106 HD12 ILE 106 0.143 1.074 -13.983 761 HD13 ILE 106 HD13 ILE 106 1.514 2.128 -13.633 762 H ILE 107 H ILE 107 -0.515 3.771 -7.784 763 HA ILE 107 HA ILE 107 -0.562 6.612 -7.614 764 HB ILE 107 HB ILE 107 -0.472 6.016 -5.095 765 HG12 ILE 107 HG12 ILE 107 -1.840 3.497 -5.760 766 HG13 ILE 107 HG13 ILE 107 -0.096 3.476 -5.995 767 HG21 ILE 107 HG21 ILE 107 -2.891 5.796 -5.047 768 HG22 ILE 107 HG22 ILE 107 -2.888 5.359 -6.755 769 HG23 ILE 107 HG23 ILE 107 -2.394 6.977 -6.257 770 HD11 ILE 107 HD11 ILE 107 0.301 3.972 -3.714 771 HD12 ILE 107 HD12 ILE 107 -0.905 2.684 -3.763 772 HD13 ILE 107 HD13 ILE 107 -1.399 4.345 -3.433 773 H GLY 108 H GLY 108 1.871 4.358 -7.918 774 HA2 GLY 108 HA2 GLY 108 3.979 6.078 -7.748 775 HA3 GLY 108 HA3 GLY 108 3.805 5.406 -6.133 776 H TYR 109 H TYR 109 5.880 4.570 -6.502 777 HA TYR 109 HA TYR 109 5.921 1.963 -7.689 778 HB2 TYR 109 HB2 TYR 109 8.240 3.882 -7.994 779 HB3 TYR 109 HB3 TYR 109 8.116 2.264 -8.668 780 HD1 TYR 109 HD1 TYR 109 7.082 1.903 -10.783 781 HD2 TYR 109 HD2 TYR 109 6.803 5.696 -8.896 782 HE1 TYR 109 HE1 TYR 109 6.184 2.863 -12.864 783 HE2 TYR 109 HE2 TYR 109 5.903 6.675 -10.969 784 HH TYR 109 HH TYR 109 5.886 6.230 -13.355 785 H THR 110 H THR 110 7.042 0.507 -6.495 786 HA THR 110 HA THR 110 7.402 0.934 -3.768 787 HB THR 110 HB THR 110 8.818 -1.291 -4.096 788 HG1 THR 110 HG1 THR 110 8.864 -1.244 -6.343 789 HG21 THR 110 HG21 THR 110 6.705 -1.140 -2.894 790 HG22 THR 110 HG22 THR 110 6.722 -2.556 -3.943 791 HG23 THR 110 HG23 THR 110 5.833 -1.115 -4.425 792 H GLY 111 H GLY 111 9.346 0.903 -2.427 793 HA2 GLY 111 HA2 GLY 111 11.885 1.196 -3.781 794 HA3 GLY 111 HA3 GLY 111 11.296 2.666 -3.031 795 H ALA 112 H ALA 112 13.290 2.516 -1.886 796 HA ALA 112 HA ALA 112 12.899 1.254 0.637 797 HB1 ALA 112 HB1 ALA 112 15.668 0.851 -0.262 798 HB2 ALA 112 HB2 ALA 112 14.482 -0.098 -1.154 799 HB3 ALA 112 HB3 ALA 112 14.598 -0.256 0.599 800 H THR 113 H THR 113 12.593 3.839 0.133 801 HA THR 113 HA THR 113 14.997 5.388 0.351 802 HB THR 113 HB THR 113 13.407 7.326 0.595 803 HG1 THR 113 HG1 THR 113 11.388 5.461 -0.104 804 HG21 THR 113 HG21 THR 113 13.058 5.480 -1.772 805 HG22 THR 113 HG22 THR 113 14.282 6.737 -1.584 806 HG23 THR 113 HG23 THR 113 12.582 7.179 -1.738 807 H GLY 114 H GLY 114 13.527 3.595 2.654 808 HA2 GLY 114 HA2 GLY 114 13.714 5.519 4.848 809 HA3 GLY 114 HA3 GLY 114 13.204 3.837 4.974 810 H GLN 115 H GLN 115 14.680 2.270 5.419 811 HA GLN 115 HA GLN 115 17.429 3.152 6.001 812 HB2 GLN 115 HB2 GLN 115 15.750 0.863 7.015 813 HB3 GLN 115 HB3 GLN 115 17.499 0.850 7.186 814 HG2 GLN 115 HG2 GLN 115 17.252 3.106 8.327 815 HG3 GLN 115 HG3 GLN 115 15.525 2.758 8.396 816 HE21 GLN 115 HE21 GLN 115 14.781 1.126 9.742 817 HE22 GLN 115 HE22 GLN 115 15.759 0.438 10.989 818 H VAL 116 H VAL 116 19.218 1.968 5.157 819 HA VAL 116 HA VAL 116 18.574 0.641 2.656 820 HB VAL 116 HB VAL 116 21.112 0.655 2.302 821 HG11 VAL 116 HG11 VAL 116 19.636 3.272 2.535 822 HG12 VAL 116 HG12 VAL 116 19.582 2.163 1.165 823 HG13 VAL 116 HG13 VAL 116 21.087 2.988 1.573 824 HG21 VAL 116 HG21 VAL 116 21.805 1.040 4.619 825 HG22 VAL 116 HG22 VAL 116 20.987 2.603 4.612 826 HG23 VAL 116 HG23 VAL 116 22.380 2.332 3.565 827 H THR 117 H THR 117 17.905 -1.327 2.992 828 HA THR 117 HA THR 117 19.845 -3.316 3.872 829 HB THR 117 HB THR 117 18.082 -4.522 5.210 830 HG1 THR 117 HG1 THR 117 16.276 -3.317 4.366 831 HG21 THR 117 HG21 THR 117 19.795 -3.373 6.419 832 HG22 THR 117 HG22 THR 117 18.261 -3.007 7.209 833 HG23 THR 117 HG23 THR 117 19.016 -1.812 6.149 834 H GLY 118 H GLY 118 16.491 -2.830 2.801 835 HA2 GLY 118 HA2 GLY 118 16.850 -4.274 0.377 836 HA3 GLY 118 HA3 GLY 118 15.990 -5.241 1.564 837 HA PRO 119 HA PRO 119 13.176 -1.788 -0.414 838 HB2 PRO 119 HB2 PRO 119 12.590 -3.415 -2.771 839 HB3 PRO 119 HB3 PRO 119 13.117 -1.735 -2.687 840 HG2 PRO 119 HG2 PRO 119 14.713 -3.677 -3.639 841 HG3 PRO 119 HG3 PRO 119 15.341 -2.261 -2.774 842 HD2 PRO 119 HD2 PRO 119 14.898 -5.042 -1.763 843 HD3 PRO 119 HD3 PRO 119 16.260 -3.937 -1.485 844 H HIS 120 H HIS 120 10.945 -1.905 -0.028 845 HA HIS 120 HA HIS 120 9.500 -4.290 -0.304 846 HB2 HIS 120 HB2 HIS 120 8.916 -4.646 2.075 847 HB3 HIS 120 HB3 HIS 120 10.639 -4.852 1.801 848 HD1 HIS 120 HD1 HIS 120 12.197 -2.869 2.656 849 HD2 HIS 120 HD2 HIS 120 8.247 -2.756 3.942 850 HE1 HIS 120 HE1 HIS 120 12.171 -1.273 4.598 851 HE2 HIS 120 HE2 HIS 120 9.771 -1.218 5.364 852 H LEU 121 H LEU 121 7.408 -3.886 1.245 853 HA LEU 121 HA LEU 121 6.330 -1.353 0.480 854 HB2 LEU 121 HB2 LEU 121 5.385 -2.702 -1.121 855 HB3 LEU 121 HB3 LEU 121 5.300 -4.086 -0.074 856 HG LEU 121 HG LEU 121 3.398 -2.881 1.126 857 HD11 LEU 121 HD11 LEU 121 3.808 -0.631 0.258 858 HD12 LEU 121 HD12 LEU 121 2.190 -1.191 -0.163 859 HD13 LEU 121 HD13 LEU 121 3.468 -1.195 -1.378 860 HD21 LEU 121 HD21 LEU 121 1.756 -3.596 -0.527 861 HD22 LEU 121 HD22 LEU 121 3.062 -4.772 -0.378 862 HD23 LEU 121 HD23 LEU 121 3.016 -3.674 -1.758 863 H HIS 122 H HIS 122 5.147 -0.375 1.898 864 HA HIS 122 HA HIS 122 4.511 -1.677 4.374 865 HB2 HIS 122 HB2 HIS 122 6.187 0.009 4.822 866 HB3 HIS 122 HB3 HIS 122 5.305 1.194 3.871 867 HD2 HIS 122 HD2 HIS 122 2.907 2.176 5.148 868 HE1 HIS 122 HE1 HIS 122 4.061 0.808 8.967 869 HE2 HIS 122 HE2 HIS 122 2.468 2.291 7.691 870 H PHE 123 H PHE 123 2.445 -1.896 4.729 871 HA PHE 123 HA PHE 123 0.564 0.008 3.528 872 HB2 PHE 123 HB2 PHE 123 0.604 -2.240 2.372 873 HB3 PHE 123 HB3 PHE 123 0.061 -2.960 3.878 874 HD1 PHE 123 HD1 PHE 123 -0.890 -0.781 1.082 875 HD2 PHE 123 HD2 PHE 123 -2.220 -2.806 4.583 876 HE1 PHE 123 HE1 PHE 123 -3.225 -0.383 0.426 877 HE2 PHE 123 HE2 PHE 123 -4.554 -2.412 3.928 878 HZ PHE 123 HZ PHE 123 -5.060 -1.203 1.846 879 H GLU 124 H GLU 124 -0.129 1.161 5.207 880 HA GLU 124 HA GLU 124 -0.993 -0.161 7.606 881 HB2 GLU 124 HB2 GLU 124 -0.457 1.852 8.827 882 HB3 GLU 124 HB3 GLU 124 0.933 1.391 7.856 883 HG2 GLU 124 HG2 GLU 124 0.357 3.103 6.213 884 HG3 GLU 124 HG3 GLU 124 -1.019 3.585 7.203 885 H MET 125 H MET 125 -3.019 -0.073 8.054 886 HA MET 125 HA MET 125 -4.800 1.740 6.724 887 HB2 MET 125 HB2 MET 125 -5.450 -0.189 5.728 888 HB3 MET 125 HB3 MET 125 -4.819 -1.142 7.025 889 HG2 MET 125 HG2 MET 125 -7.197 -1.452 6.840 890 HG3 MET 125 HG3 MET 125 -6.787 -0.692 8.369 891 HE1 MET 125 HE1 MET 125 -9.226 0.199 8.867 892 HE2 MET 125 HE2 MET 125 -9.642 -0.813 7.484 893 HE3 MET 125 HE3 MET 125 -10.260 0.835 7.588 894 H LEU 126 H LEU 126 -6.218 2.708 7.882 895 HA LEU 126 HA LEU 126 -6.531 2.127 10.692 896 HB2 LEU 126 HB2 LEU 126 -5.308 4.574 9.486 897 HB3 LEU 126 HB3 LEU 126 -6.367 4.819 10.855 898 HG LEU 126 HG LEU 126 -4.766 2.912 11.874 899 HD11 LEU 126 HD11 LEU 126 -2.459 3.360 11.228 900 HD12 LEU 126 HD12 LEU 126 -3.018 4.467 9.974 901 HD13 LEU 126 HD13 LEU 126 -3.393 2.748 9.864 902 HD21 LEU 126 HD21 LEU 126 -3.602 4.693 13.019 903 HD22 LEU 126 HD22 LEU 126 -5.308 5.100 12.842 904 HD23 LEU 126 HD23 LEU 126 -4.110 5.850 11.789 905 HA PRO 127 HA PRO 127 -10.811 3.456 10.040 906 HB2 PRO 127 HB2 PRO 127 -11.214 5.236 12.082 907 HB3 PRO 127 HB3 PRO 127 -11.362 3.502 12.266 908 HG2 PRO 127 HG2 PRO 127 -9.098 5.279 12.974 909 HG3 PRO 127 HG3 PRO 127 -9.712 3.850 13.835 910 HD2 PRO 127 HD2 PRO 127 -7.491 3.730 12.377 911 HD3 PRO 127 HD3 PRO 127 -8.634 2.384 12.416 912 H ALA 128 H ALA 128 -12.245 5.478 10.053 913 HA ALA 128 HA ALA 128 -11.106 7.433 8.393 914 HB1 ALA 128 HB1 ALA 128 -13.299 8.515 8.495 915 HB2 ALA 128 HB2 ALA 128 -13.747 7.458 9.835 916 HB3 ALA 128 HB3 ALA 128 -13.470 6.779 8.230 917 H ASN 129 H ASN 129 -11.593 6.983 11.742 918 HA ASN 129 HA ASN 129 -10.048 9.219 12.529 919 HB2 ASN 129 HB2 ASN 129 -12.970 9.491 12.644 920 HB3 ASN 129 HB3 ASN 129 -12.200 9.722 14.211 921 HD21 ASN 129 HD21 ASN 129 -12.399 10.875 10.917 922 HD22 ASN 129 HD22 ASN 129 -11.726 12.437 11.218 923 HA PRO 130 HA PRO 130 -9.310 5.773 15.003 924 HB2 PRO 130 HB2 PRO 130 -6.794 6.980 15.764 925 HB3 PRO 130 HB3 PRO 130 -7.100 5.530 14.800 926 HG2 PRO 130 HG2 PRO 130 -6.172 7.878 13.727 927 HG3 PRO 130 HG3 PRO 130 -7.029 6.640 12.807 928 HD2 PRO 130 HD2 PRO 130 -7.994 9.234 13.885 929 HD3 PRO 130 HD3 PRO 130 -8.434 8.377 12.394 930 H ASN 131 H ASN 131 -8.712 5.229 17.067 931 HA ASN 131 HA ASN 131 -9.199 7.201 19.131 932 HB2 ASN 131 HB2 ASN 131 -10.759 5.075 18.536 933 HB3 ASN 131 HB3 ASN 131 -9.640 4.382 19.695 934 HD21 ASN 131 HD21 ASN 131 -12.157 6.628 19.118 935 HD22 ASN 131 HD22 ASN 131 -12.517 6.977 20.758 936 H TRP 132 H TRP 132 -6.885 7.483 18.732 937 HA TRP 132 HA TRP 132 -4.956 5.541 19.198 938 HB2 TRP 132 HB2 TRP 132 -4.504 8.460 19.786 939 HB3 TRP 132 HB3 TRP 132 -3.343 7.280 19.196 940 HD1 TRP 132 HD1 TRP 132 -3.688 6.495 16.583 941 HE1 TRP 132 HE1 TRP 132 -4.528 7.859 14.568 942 HE3 TRP 132 HE3 TRP 132 -6.074 10.271 19.074 943 HZ2 TRP 132 HZ2 TRP 132 -5.996 10.166 14.095 944 HZ3 TRP 132 HZ3 TRP 132 -7.181 12.027 17.748 945 HH2 TRP 132 HH2 TRP 132 -7.143 11.976 15.306 946 H GLN 133 H GLN 133 -7.112 6.146 21.321 947 HA GLN 133 HA GLN 133 -5.696 6.806 23.678 948 HB2 GLN 133 HB2 GLN 133 -8.507 5.928 23.118 949 HB3 GLN 133 HB3 GLN 133 -7.900 6.329 24.697 950 HG2 GLN 133 HG2 GLN 133 -8.917 8.309 24.069 951 HG3 GLN 133 HG3 GLN 133 -7.237 8.595 23.616 952 HE21 GLN 133 HE21 GLN 133 -6.665 8.204 21.356 953 HE22 GLN 133 HE22 GLN 133 -7.828 8.450 20.114 954 H ASN 134 H ASN 134 -4.809 4.521 22.340 955 HA ASN 134 HA ASN 134 -3.774 2.582 22.766 956 HB2 ASN 134 HB2 ASN 134 -4.902 3.016 25.529 957 HB3 ASN 134 HB3 ASN 134 -3.968 1.581 25.109 958 HD21 ASN 134 HD21 ASN 134 -3.886 5.092 25.164 959 HD22 ASN 134 HD22 ASN 134 -2.180 5.235 25.346 960 H GLY 135 H GLY 135 -4.306 0.722 21.982 961 HA2 GLY 135 HA2 GLY 135 -6.077 -1.138 22.674 962 HA3 GLY 135 HA3 GLY 135 -7.113 0.053 21.903 963 H PHE 136 H PHE 136 -5.689 0.892 19.752 964 HA PHE 136 HA PHE 136 -4.664 -1.397 18.303 965 HB2 PHE 136 HB2 PHE 136 -6.284 -0.710 16.339 966 HB3 PHE 136 HB3 PHE 136 -6.785 -1.867 17.554 967 HD1 PHE 136 HD1 PHE 136 -9.088 -1.640 17.358 968 HD2 PHE 136 HD2 PHE 136 -6.745 1.861 18.036 969 HE1 PHE 136 HE1 PHE 136 -11.132 -0.340 17.758 970 HE2 PHE 136 HE2 PHE 136 -8.782 3.145 18.413 971 HZ PHE 136 HZ PHE 136 -10.984 2.056 18.288 972 H SER 137 H SER 137 -5.046 1.945 18.697 973 HA SER 137 HA SER 137 -3.949 3.783 17.981 974 HB2 SER 137 HB2 SER 137 -2.036 1.722 16.874 975 HB3 SER 137 HB3 SER 137 -1.780 3.453 16.664 976 HG SER 137 HG SER 137 -2.262 3.143 19.199 977 H GLY 138 H GLY 138 -5.904 2.102 16.602 978 HA2 GLY 138 HA2 GLY 138 -7.345 2.501 14.875 979 HA3 GLY 138 HA3 GLY 138 -6.255 3.738 14.287 980 H ARG 139 H ARG 139 -4.141 1.384 14.607 981 HA ARG 139 HA ARG 139 -4.443 0.661 11.825 982 HB2 ARG 139 HB2 ARG 139 -2.221 -0.612 12.240 983 HB3 ARG 139 HB3 ARG 139 -2.223 1.138 12.165 984 HG2 ARG 139 HG2 ARG 139 -0.855 0.731 13.955 985 HG3 ARG 139 HG3 ARG 139 -2.401 0.996 14.752 986 HD2 ARG 139 HD2 ARG 139 -2.687 -1.312 15.154 987 HD3 ARG 139 HD3 ARG 139 -1.402 -1.747 14.029 988 HE ARG 139 HE ARG 139 0.114 -0.571 15.683 989 HH11 ARG 139 HH11 ARG 139 -2.861 -2.185 16.693 990 HH12 ARG 139 HH12 ARG 139 -2.240 -2.501 18.354 991 HH21 ARG 139 HH21 ARG 139 -0.148 -1.814 18.950 992 HH22 ARG 139 HH22 ARG 139 0.900 -0.950 17.767 993 H ILE 140 H ILE 140 -5.287 -1.125 11.031 994 HA ILE 140 HA ILE 140 -5.432 -3.458 12.763 995 HB ILE 140 HB ILE 140 -7.648 -3.381 10.922 996 HG12 ILE 140 HG12 ILE 140 -8.760 -1.833 12.899 997 HG13 ILE 140 HG13 ILE 140 -7.191 -1.067 12.669 998 HG21 ILE 140 HG21 ILE 140 -7.470 -3.798 13.893 999 HG22 ILE 140 HG22 ILE 140 -7.384 -5.058 12.662 1000 HG23 ILE 140 HG23 ILE 140 -8.876 -4.144 12.886 1001 HD11 ILE 140 HD11 ILE 140 -9.076 -1.656 10.413 1002 HD12 ILE 140 HD12 ILE 140 -7.642 -0.632 10.397 1003 HD13 ILE 140 HD13 ILE 140 -9.068 -0.134 11.304 1004 H ASP 141 H ASP 141 -6.562 -5.319 11.170 1005 HA ASP 141 HA ASP 141 -4.346 -6.208 9.676 1006 HB2 ASP 141 HB2 ASP 141 -7.069 -7.329 10.208 1007 HB3 ASP 141 HB3 ASP 141 -5.941 -8.141 9.127 1008 HA PRO 142 HA PRO 142 -5.653 -4.764 5.582 1009 HB2 PRO 142 HB2 PRO 142 -3.554 -6.285 4.353 1010 HB3 PRO 142 HB3 PRO 142 -3.621 -4.544 4.632 1011 HG2 PRO 142 HG2 PRO 142 -1.878 -6.252 5.892 1012 HG3 PRO 142 HG3 PRO 142 -2.362 -4.663 6.510 1013 HD2 PRO 142 HD2 PRO 142 -3.301 -7.371 7.314 1014 HD3 PRO 142 HD3 PRO 142 -3.042 -5.916 8.295 1015 H THR 143 H THR 143 -5.856 -7.901 6.731 1016 HA THR 143 HA THR 143 -6.067 -9.612 4.619 1017 HB THR 143 HB THR 143 -7.863 -10.711 6.193 1018 HG1 THR 143 HG1 THR 143 -8.271 -9.442 7.829 1019 HG21 THR 143 HG21 THR 143 -6.031 -11.686 7.511 1020 HG22 THR 143 HG22 THR 143 -4.955 -10.424 6.913 1021 HG23 THR 143 HG23 THR 143 -5.638 -11.603 5.794 1022 H GLY 144 H GLY 144 -8.261 -7.140 5.483 1023 HA2 GLY 144 HA2 GLY 144 -10.613 -8.217 4.217 1024 HA3 GLY 144 HA3 GLY 144 -10.387 -6.556 4.748 1025 H TYR 145 H TYR 145 -7.850 -6.454 3.180 1026 HA TYR 145 HA TYR 145 -9.002 -5.839 0.601 1027 HB2 TYR 145 HB2 TYR 145 -6.305 -4.920 1.560 1028 HB3 TYR 145 HB3 TYR 145 -7.283 -4.248 0.268 1029 HD1 TYR 145 HD1 TYR 145 -8.698 -2.431 0.679 1030 HD2 TYR 145 HD2 TYR 145 -7.164 -4.663 3.953 1031 HE1 TYR 145 HE1 TYR 145 -9.583 -0.751 2.234 1032 HE2 TYR 145 HE2 TYR 145 -8.051 -3.000 5.520 1033 HH TYR 145 HH TYR 145 -10.318 -0.871 4.866 1034 H ILE 146 H ILE 146 -7.081 -8.123 2.101 1035 HA ILE 146 HA ILE 146 -5.555 -8.738 -0.265 1036 HB ILE 146 HB ILE 146 -5.271 -10.077 2.418 1037 HG12 ILE 146 HG12 ILE 146 -4.835 -7.721 2.809 1038 HG13 ILE 146 HG13 ILE 146 -3.319 -8.602 2.863 1039 HG21 ILE 146 HG21 ILE 146 -2.946 -10.569 1.601 1040 HG22 ILE 146 HG22 ILE 146 -3.461 -9.998 0.014 1041 HG23 ILE 146 HG23 ILE 146 -4.244 -11.398 0.745 1042 HD11 ILE 146 HD11 ILE 146 -4.295 -6.910 0.561 1043 HD12 ILE 146 HD12 ILE 146 -2.763 -7.781 0.624 1044 HD13 ILE 146 HD13 ILE 146 -3.069 -6.454 1.744 1045 H ALA 147 H ALA 147 -8.367 -9.620 1.294 1046 HA ALA 147 HA ALA 147 -8.528 -12.360 0.615 1047 HB1 ALA 147 HB1 ALA 147 -10.727 -10.421 1.220 1048 HB2 ALA 147 HB2 ALA 147 -9.850 -11.381 2.412 1049 HB3 ALA 147 HB3 ALA 147 -10.869 -12.176 1.212 1050 H ASN 148 H ASN 148 -9.185 -9.433 -1.059 1051 HA ASN 148 HA ASN 148 -10.488 -10.776 -3.226 1052 HB2 ASN 148 HB2 ASN 148 -10.169 -7.831 -3.232 1053 HB3 ASN 148 HB3 ASN 148 -11.552 -8.793 -3.653 1054 HD21 ASN 148 HD21 ASN 148 -9.786 -7.397 -1.075 1055 HD22 ASN 148 HD22 ASN 148 -11.038 -7.442 0.111 1056 H ALA 149 H ALA 149 -7.630 -10.647 -2.370 1057 HA ALA 149 HA ALA 149 -6.386 -9.424 -4.600 1058 HB1 ALA 149 HB1 ALA 149 -4.446 -10.570 -2.965 1059 HB2 ALA 149 HB2 ALA 149 -5.736 -10.061 -1.875 1060 HB3 ALA 149 HB3 ALA 149 -4.974 -8.884 -2.947 1061 HA PRO 150 HA PRO 150 -5.232 -12.964 -7.060 1062 HB2 PRO 150 HB2 PRO 150 -2.461 -12.969 -6.948 1063 HB3 PRO 150 HB3 PRO 150 -3.439 -11.991 -8.052 1064 HG2 PRO 150 HG2 PRO 150 -2.236 -11.230 -5.438 1065 HG3 PRO 150 HG3 PRO 150 -2.326 -10.300 -6.946 1066 HD2 PRO 150 HD2 PRO 150 -3.998 -9.751 -4.954 1067 HD3 PRO 150 HD3 PRO 150 -4.583 -9.779 -6.632 1068 H VAL 151 H VAL 151 -3.672 -14.968 -7.085 1069 HA VAL 151 HA VAL 151 -3.881 -16.266 -4.493 1070 HB VAL 151 HB VAL 151 -4.042 -17.484 -7.198 1071 HG11 VAL 151 HG11 VAL 151 -2.921 -18.876 -5.409 1072 HG12 VAL 151 HG12 VAL 151 -4.319 -19.609 -6.213 1073 HG13 VAL 151 HG13 VAL 151 -4.495 -18.909 -4.603 1074 HG21 VAL 151 HG21 VAL 151 -6.358 -17.983 -6.680 1075 HG22 VAL 151 HG22 VAL 151 -6.065 -16.248 -6.557 1076 HG23 VAL 151 HG23 VAL 151 -6.174 -17.230 -5.096 1077 H PHE 152 H PHE 152 -2.201 -17.095 -3.639 1078 HA PHE 152 HA PHE 152 0.389 -17.093 -4.995 1079 HB2 PHE 152 HB2 PHE 152 0.265 -15.775 -2.924 1080 HB3 PHE 152 HB3 PHE 152 -0.338 -17.165 -2.039 1081 HD1 PHE 152 HD1 PHE 152 2.554 -15.420 -3.252 1082 HD2 PHE 152 HD2 PHE 152 1.181 -19.083 -1.622 1083 HE1 PHE 152 HE1 PHE 152 4.874 -16.022 -2.693 1084 HE2 PHE 152 HE2 PHE 152 3.499 -19.703 -1.041 1085 HZ PHE 152 HZ PHE 152 5.349 -18.168 -1.583 1086 H ASN 153 H ASN 153 0.413 -19.007 -6.074 1087 HA ASN 153 HA ASN 153 0.802 -21.199 -6.469 1088 HB2 ASN 153 HB2 ASN 153 1.311 -21.091 -3.544 1089 HB3 ASN 153 HB3 ASN 153 1.092 -22.681 -4.270 1090 HD21 ASN 153 HD21 ASN 153 2.968 -19.722 -4.414 1091 HD22 ASN 153 HD22 ASN 153 4.376 -20.426 -5.125 1092 H GLY 154 H GLY 154 -1.634 -20.578 -3.987 1093 HA2 GLY 154 HA2 GLY 154 -3.927 -21.270 -4.568 1094 HA3 GLY 154 HA3 GLY 154 -3.241 -22.790 -5.124 1095 H THR 155 H THR 155 -4.191 -20.909 -2.358 1096 HA THR 155 HA THR 155 -3.445 -22.965 -0.474 1097 HB THR 155 HB THR 155 -4.373 -21.250 1.152 1098 HG1 THR 155 HG1 THR 155 -5.373 -20.117 -0.842 1099 HG21 THR 155 HG21 THR 155 -1.991 -21.524 0.888 1100 HG22 THR 155 HG22 THR 155 -2.359 -19.801 0.987 1101 HG23 THR 155 HG23 THR 155 -2.016 -20.541 -0.579 1102 H THR 156 H THR 156 -4.828 -24.576 -0.497 1103 HA THR 156 HA THR 156 -7.702 -24.132 -0.673 1104 HB THR 156 HB THR 156 -7.794 -26.681 -0.656 1105 HG1 THR 156 HG1 THR 156 -5.875 -27.391 0.034 1106 HG21 THR 156 HG21 THR 156 -7.043 -26.858 -3.014 1107 HG22 THR 156 HG22 THR 156 -6.315 -25.258 -2.871 1108 HG23 THR 156 HG23 THR 156 -8.062 -25.450 -2.717 1109 HA PRO 157 HA PRO 157 -8.137 -24.758 3.728 1110 HB2 PRO 157 HB2 PRO 157 -10.942 -25.111 3.654 1111 HB3 PRO 157 HB3 PRO 157 -10.069 -23.606 3.965 1112 HG2 PRO 157 HG2 PRO 157 -11.632 -24.138 1.723 1113 HG3 PRO 157 HG3 PRO 157 -10.446 -22.830 1.880 1114 HD2 PRO 157 HD2 PRO 157 -10.184 -25.456 0.516 1115 HD3 PRO 157 HD3 PRO 157 -9.467 -23.889 0.111 1116 H THR 158 H THR 158 -9.856 -26.908 1.624 1117 HA THR 158 HA THR 158 -9.027 -29.256 2.954 1118 HB THR 158 HB THR 158 -10.820 -28.746 4.486 1119 HG1 THR 158 HG1 THR 158 -10.932 -30.856 4.385 1120 HG21 THR 158 HG21 THR 158 -12.194 -27.327 2.938 1121 HG22 THR 158 HG22 THR 158 -13.109 -28.433 3.963 1122 HG23 THR 158 HG23 THR 158 -12.837 -28.827 2.266 1123 H GLU 159 H GLU 159 -11.765 -28.210 1.053 1124 HA GLU 159 HA GLU 159 -11.361 -30.277 -0.909 1125 HB2 GLU 159 HB2 GLU 159 -13.529 -28.282 -0.404 1126 HB3 GLU 159 HB3 GLU 159 -13.446 -29.110 -1.952 1127 HG2 GLU 159 HG2 GLU 159 -13.547 -31.268 -0.774 1128 HG3 GLU 159 HG3 GLU 159 -13.711 -30.402 0.753 Start of MODEL 2 1 H1 MET 1 H1 MET 1 8.669 -3.714 -17.473 2 H2 MET 1 H2 MET 1 8.392 -2.107 -17.920 3 H3 MET 1 H3 MET 1 9.971 -2.650 -17.652 4 HA MET 1 HA MET 1 9.514 -2.436 -20.006 5 HB2 MET 1 HB2 MET 1 9.956 -5.182 -18.856 6 HB3 MET 1 HB3 MET 1 9.990 -4.904 -20.592 7 HG2 MET 1 HG2 MET 1 11.845 -3.426 -20.399 8 HG3 MET 1 HG3 MET 1 11.725 -3.412 -18.641 9 HE1 MET 1 HE1 MET 1 11.644 -6.114 -17.450 10 HE2 MET 1 HE2 MET 1 12.941 -4.969 -17.108 11 HE3 MET 1 HE3 MET 1 13.322 -6.649 -17.490 12 H ARG 2 H ARG 2 8.145 -2.613 -21.678 13 HA ARG 2 HA ARG 2 5.459 -3.588 -21.150 14 HB2 ARG 2 HB2 ARG 2 6.679 -2.050 -23.441 15 HB3 ARG 2 HB3 ARG 2 5.019 -2.625 -23.466 16 HG2 ARG 2 HG2 ARG 2 4.555 -1.311 -21.438 17 HG3 ARG 2 HG3 ARG 2 6.209 -0.697 -21.481 18 HD2 ARG 2 HD2 ARG 2 5.768 0.251 -23.713 19 HD3 ARG 2 HD3 ARG 2 4.101 -0.314 -23.605 20 HE ARG 2 HE ARG 2 5.123 1.518 -21.557 21 HH11 ARG 2 HH11 ARG 2 2.966 0.927 -24.288 22 HH12 ARG 2 HH12 ARG 2 1.996 2.411 -23.973 23 HH21 ARG 2 HH21 ARG 2 3.910 3.386 -21.144 24 HH22 ARG 2 HH22 ARG 2 2.522 3.779 -22.222 25 H GLY 3 H GLY 3 4.360 -5.132 -22.376 26 HA2 GLY 3 HA2 GLY 3 5.945 -6.754 -24.247 27 HA3 GLY 3 HA3 GLY 3 5.192 -7.540 -22.869 28 H SER 4 H SER 4 2.744 -6.708 -22.675 29 HA SER 4 HA SER 4 1.502 -7.486 -25.207 30 HB2 SER 4 HB2 SER 4 0.344 -7.292 -22.415 31 HB3 SER 4 HB3 SER 4 -0.527 -7.864 -23.838 32 HG SER 4 HG SER 4 0.412 -9.546 -22.514 33 H HIS 5 H HIS 5 -0.241 -6.346 -26.117 34 HA HIS 5 HA HIS 5 -0.507 -3.544 -25.245 35 HB2 HIS 5 HB2 HIS 5 0.787 -4.156 -27.478 36 HB3 HIS 5 HB3 HIS 5 -0.846 -4.258 -28.126 37 HD1 HIS 5 HD1 HIS 5 -2.296 -2.007 -27.933 38 HD2 HIS 5 HD2 HIS 5 1.783 -1.620 -27.241 39 HE1 HIS 5 HE1 HIS 5 -1.811 0.453 -28.132 40 HE2 HIS 5 HE2 HIS 5 0.664 0.664 -27.709 41 H HIS 6 H HIS 6 -2.064 -6.223 -26.990 42 HA HIS 6 HA HIS 6 -4.690 -5.103 -26.250 43 HB2 HIS 6 HB2 HIS 6 -3.844 -6.626 -28.710 44 HB3 HIS 6 HB3 HIS 6 -5.534 -6.491 -28.234 45 HD1 HIS 6 HD1 HIS 6 -6.708 -4.276 -28.673 46 HD2 HIS 6 HD2 HIS 6 -2.656 -4.198 -29.588 47 HE1 HIS 6 HE1 HIS 6 -6.343 -2.128 -29.929 48 HE2 HIS 6 HE2 HIS 6 -3.883 -2.101 -30.472 49 H HIS 7 H HIS 7 -6.285 -6.514 -25.516 50 HA HIS 7 HA HIS 7 -5.283 -9.114 -24.572 51 HB2 HIS 7 HB2 HIS 7 -7.102 -8.921 -22.821 52 HB3 HIS 7 HB3 HIS 7 -5.782 -7.770 -22.675 53 HD1 HIS 7 HD1 HIS 7 -9.437 -7.996 -23.066 54 HD2 HIS 7 HD2 HIS 7 -6.500 -5.076 -23.410 55 HE1 HIS 7 HE1 HIS 7 -10.666 -5.802 -23.062 56 HE2 HIS 7 HE2 HIS 7 -8.869 -4.047 -23.270 57 H HIS 8 H HIS 8 -6.404 -10.960 -24.923 58 HA HIS 8 HA HIS 8 -8.783 -10.766 -26.651 59 HB2 HIS 8 HB2 HIS 8 -6.333 -12.277 -26.912 60 HB3 HIS 8 HB3 HIS 8 -7.723 -13.356 -26.890 61 HD1 HIS 8 HD1 HIS 8 -9.314 -13.280 -28.897 62 HD2 HIS 8 HD2 HIS 8 -6.192 -10.547 -29.136 63 HE1 HIS 8 HE1 HIS 8 -9.345 -12.429 -31.263 64 HE2 HIS 8 HE2 HIS 8 -7.447 -10.776 -31.386 65 H HIS 9 H HIS 9 -7.275 -12.662 -24.048 66 HA HIS 9 HA HIS 9 -9.950 -13.648 -23.294 67 HB2 HIS 9 HB2 HIS 9 -7.243 -14.955 -23.053 68 HB3 HIS 9 HB3 HIS 9 -8.639 -15.513 -22.137 69 HD1 HIS 9 HD1 HIS 9 -7.180 -15.475 -25.566 70 HD2 HIS 9 HD2 HIS 9 -10.613 -16.829 -23.654 71 HE1 HIS 9 HE1 HIS 9 -8.300 -17.018 -27.205 72 HE2 HIS 9 HE2 HIS 9 -10.375 -17.828 -26.028 73 H HIS 10 H HIS 10 -10.553 -13.616 -21.150 74 HA HIS 10 HA HIS 10 -8.968 -11.840 -19.410 75 HB2 HIS 10 HB2 HIS 10 -11.867 -12.282 -19.832 76 HB3 HIS 10 HB3 HIS 10 -11.367 -11.998 -18.168 77 HD1 HIS 10 HD1 HIS 10 -11.503 -10.331 -21.529 78 HD2 HIS 10 HD2 HIS 10 -10.565 -9.404 -17.588 79 HE1 HIS 10 HE1 HIS 10 -11.284 -7.826 -21.460 80 HE2 HIS 10 HE2 HIS 10 -10.716 -7.286 -19.066 81 H GLY 11 H GLY 11 -8.614 -12.366 -17.235 82 HA2 GLY 11 HA2 GLY 11 -9.168 -13.941 -15.377 83 HA3 GLY 11 HA3 GLY 11 -8.997 -15.222 -16.564 84 H SER 12 H SER 12 -6.800 -12.539 -16.669 85 HA SER 12 HA SER 12 -4.601 -14.309 -15.866 86 HB2 SER 12 HB2 SER 12 -4.843 -11.946 -17.628 87 HB3 SER 12 HB3 SER 12 -3.352 -12.072 -16.682 88 HG SER 12 HG SER 12 -2.786 -13.360 -18.266 89 H ALA 13 H ALA 13 -2.850 -13.448 -14.587 90 HA ALA 13 HA ALA 13 -3.176 -11.049 -13.155 91 HB1 ALA 13 HB1 ALA 13 -4.622 -12.309 -11.733 92 HB2 ALA 13 HB2 ALA 13 -3.089 -12.146 -10.872 93 HB3 ALA 13 HB3 ALA 13 -3.489 -13.660 -11.687 94 H THR 14 H THR 14 -1.199 -10.268 -13.419 95 HA THR 14 HA THR 14 1.102 -11.988 -13.382 96 HB THR 14 HB THR 14 0.904 -10.381 -15.204 97 HG1 THR 14 HG1 THR 14 3.037 -9.583 -15.044 98 HG21 THR 14 HG21 THR 14 1.155 -8.247 -13.078 99 HG22 THR 14 HG22 THR 14 -0.245 -8.539 -14.111 100 HG23 THR 14 HG23 THR 14 1.267 -7.966 -14.816 101 H TYR 15 H TYR 15 -0.540 -10.026 -11.187 102 HA TYR 15 HA TYR 15 1.771 -9.474 -9.574 103 HB2 TYR 15 HB2 TYR 15 -0.731 -8.189 -9.982 104 HB3 TYR 15 HB3 TYR 15 -0.445 -8.467 -8.270 105 HD1 TYR 15 HD1 TYR 15 0.232 -6.345 -11.035 106 HD2 TYR 15 HD2 TYR 15 1.865 -7.719 -7.358 107 HE1 TYR 15 HE1 TYR 15 1.742 -4.404 -10.986 108 HE2 TYR 15 HE2 TYR 15 3.375 -5.779 -7.293 109 HH TYR 15 HH TYR 15 4.351 -4.169 -8.767 110 H THR 16 H THR 16 2.392 -10.614 -8.035 111 HA THR 16 HA THR 16 0.652 -12.692 -7.026 112 HB THR 16 HB THR 16 2.792 -13.595 -6.004 113 HG1 THR 16 HG1 THR 16 3.921 -11.577 -7.666 114 HG21 THR 16 HG21 THR 16 3.654 -14.455 -8.145 115 HG22 THR 16 HG22 THR 16 2.680 -13.258 -8.998 116 HG23 THR 16 HG23 THR 16 1.893 -14.529 -8.061 117 H ARG 17 H ARG 17 0.527 -13.154 -4.723 118 HA ARG 17 HA ARG 17 0.421 -10.804 -3.111 119 HB2 ARG 17 HB2 ARG 17 -0.999 -13.216 -3.198 120 HB3 ARG 17 HB3 ARG 17 -0.127 -13.252 -1.671 121 HG2 ARG 17 HG2 ARG 17 -1.646 -11.922 -0.758 122 HG3 ARG 17 HG3 ARG 17 -1.346 -10.685 -1.978 123 HD2 ARG 17 HD2 ARG 17 -3.698 -11.365 -1.925 124 HD3 ARG 17 HD3 ARG 17 -2.945 -11.732 -3.475 125 HE ARG 17 HE ARG 17 -2.813 -14.072 -2.700 126 HH11 ARG 17 HH11 ARG 17 -5.125 -11.924 -1.113 127 HH12 ARG 17 HH12 ARG 17 -6.183 -13.285 -0.593 128 HH21 ARG 17 HH21 ARG 17 -5.639 -15.434 -1.123 129 HH22 ARG 17 HH22 ARG 17 -4.148 -15.792 -2.069 130 HA PRO 18 HA PRO 18 4.573 -11.797 -1.473 131 HB2 PRO 18 HB2 PRO 18 4.250 -9.315 0.049 132 HB3 PRO 18 HB3 PRO 18 5.474 -9.729 -1.158 133 HG2 PRO 18 HG2 PRO 18 3.568 -7.908 -1.657 134 HG3 PRO 18 HG3 PRO 18 4.206 -8.979 -2.920 135 HD2 PRO 18 HD2 PRO 18 1.637 -9.182 -1.402 136 HD3 PRO 18 HD3 PRO 18 1.962 -9.475 -3.125 137 H LEU 19 H LEU 19 1.664 -11.020 0.257 138 HA LEU 19 HA LEU 19 2.566 -12.529 2.566 139 HB2 LEU 19 HB2 LEU 19 1.987 -9.770 2.561 140 HB3 LEU 19 HB3 LEU 19 0.716 -10.565 3.417 141 HG LEU 19 HG LEU 19 2.508 -9.623 4.841 142 HD11 LEU 19 HD11 LEU 19 1.881 -12.569 4.921 143 HD12 LEU 19 HD12 LEU 19 1.181 -11.258 5.880 144 HD13 LEU 19 HD13 LEU 19 2.839 -11.788 6.181 145 HD21 LEU 19 HD21 LEU 19 4.667 -10.550 4.957 146 HD22 LEU 19 HD22 LEU 19 4.369 -10.299 3.236 147 HD23 LEU 19 HD23 LEU 19 4.228 -11.914 3.930 148 H ASP 20 H ASP 20 0.534 -12.458 4.008 149 HA ASP 20 HA ASP 20 -1.813 -13.299 2.569 150 HB2 ASP 20 HB2 ASP 20 -0.164 -14.902 4.208 151 HB3 ASP 20 HB3 ASP 20 -1.718 -14.686 5.001 152 H THR 21 H THR 21 -0.282 -11.707 5.122 153 HA THR 21 HA THR 21 -2.483 -10.157 5.828 154 HB THR 21 HB THR 21 -3.128 -12.285 6.925 155 HG1 THR 21 HG1 THR 21 -2.746 -10.646 9.117 156 HG21 THR 21 HG21 THR 21 -0.782 -11.771 8.764 157 HG22 THR 21 HG22 THR 21 -0.916 -13.097 7.609 158 HG23 THR 21 HG23 THR 21 -2.018 -13.011 8.983 159 H GLY 22 H GLY 22 -1.884 -9.334 8.271 160 HA2 GLY 22 HA2 GLY 22 0.687 -8.894 9.139 161 HA3 GLY 22 HA3 GLY 22 0.324 -7.597 8.010 162 H ASN 23 H ASN 23 0.182 -8.509 11.227 163 HA ASN 23 HA ASN 23 -1.454 -6.272 11.935 164 HB2 ASN 23 HB2 ASN 23 -2.888 -7.712 13.491 165 HB3 ASN 23 HB3 ASN 23 -3.276 -7.752 11.778 166 HD21 ASN 23 HD21 ASN 23 -2.381 -9.543 10.529 167 HD22 ASN 23 HD22 ASN 23 -2.193 -11.083 11.285 168 H ILE 24 H ILE 24 -0.769 -5.228 13.478 169 HA ILE 24 HA ILE 24 1.141 -6.440 15.315 170 HB ILE 24 HB ILE 24 0.762 -3.569 15.437 171 HG12 ILE 24 HG12 ILE 24 2.418 -3.344 13.401 172 HG13 ILE 24 HG13 ILE 24 1.700 -4.875 12.924 173 HG21 ILE 24 HG21 ILE 24 2.489 -4.386 16.763 174 HG22 ILE 24 HG22 ILE 24 3.311 -3.656 15.384 175 HG23 ILE 24 HG23 ILE 24 3.111 -5.401 15.469 176 HD11 ILE 24 HD11 ILE 24 0.389 -2.203 13.181 177 HD12 ILE 24 HD12 ILE 24 -0.549 -3.699 13.234 178 HD13 ILE 24 HD13 ILE 24 0.414 -3.309 11.803 179 H THR 25 H THR 25 -1.096 -7.255 15.882 180 HA THR 25 HA THR 25 -2.372 -5.620 17.952 181 HB THR 25 HB THR 25 -3.926 -6.539 16.373 182 HG1 THR 25 HG1 THR 25 -4.323 -8.263 18.555 183 HG21 THR 25 HG21 THR 25 -2.525 -8.465 15.626 184 HG22 THR 25 HG22 THR 25 -4.223 -8.868 15.888 185 HG23 THR 25 HG23 THR 25 -3.012 -9.324 17.089 186 H THR 26 H THR 26 -0.467 -8.450 17.468 187 HA THR 26 HA THR 26 -0.510 -9.034 20.354 188 HB THR 26 HB THR 26 0.365 -11.053 18.308 189 HG1 THR 26 HG1 THR 26 -1.675 -11.595 17.897 190 HG21 THR 26 HG21 THR 26 -0.387 -12.647 20.053 191 HG22 THR 26 HG22 THR 26 -0.777 -11.280 21.098 192 HG23 THR 26 HG23 THR 26 0.894 -11.572 20.614 193 H GLY 27 H GLY 27 1.627 -9.660 17.646 194 HA2 GLY 27 HA2 GLY 27 3.786 -8.074 18.644 195 HA3 GLY 27 HA3 GLY 27 4.045 -9.782 18.972 196 H PHE 28 H PHE 28 4.864 -7.422 16.903 197 HA PHE 28 HA PHE 28 4.564 -8.750 14.412 198 HB2 PHE 28 HB2 PHE 28 5.060 -6.136 15.130 199 HB3 PHE 28 HB3 PHE 28 6.569 -6.657 14.391 200 HD1 PHE 28 HD1 PHE 28 2.869 -6.801 13.757 201 HD2 PHE 28 HD2 PHE 28 6.782 -6.538 12.107 202 HE1 PHE 28 HE1 PHE 28 1.909 -6.558 11.510 203 HE2 PHE 28 HE2 PHE 28 5.825 -6.281 9.865 204 HZ PHE 28 HZ PHE 28 3.386 -6.302 9.567 205 H ASN 29 H ASN 29 6.200 -9.261 12.952 206 HA ASN 29 HA ASN 29 7.750 -11.327 13.771 207 HB2 ASN 29 HB2 ASN 29 7.674 -9.691 11.291 208 HB3 ASN 29 HB3 ASN 29 8.708 -11.093 11.421 209 HD21 ASN 29 HD21 ASN 29 5.606 -9.908 10.907 210 HD22 ASN 29 HD22 ASN 29 4.797 -11.410 10.685 211 H GLY 30 H GLY 30 8.580 -8.983 15.236 212 HA2 GLY 30 HA2 GLY 30 10.757 -8.832 16.278 213 HA3 GLY 30 HA3 GLY 30 11.480 -9.219 14.721 214 H TYR 31 H TYR 31 9.010 -7.260 14.038 215 HA TYR 31 HA TYR 31 10.726 -4.844 14.008 216 HB2 TYR 31 HB2 TYR 31 8.115 -5.165 12.521 217 HB3 TYR 31 HB3 TYR 31 9.381 -3.993 12.230 218 HD1 TYR 31 HD1 TYR 31 8.720 -7.674 12.059 219 HD2 TYR 31 HD2 TYR 31 10.956 -4.376 10.563 220 HE1 TYR 31 HE1 TYR 31 9.657 -9.113 10.301 221 HE2 TYR 31 HE2 TYR 31 11.900 -5.810 8.806 222 HH TYR 31 HH TYR 31 10.659 -8.863 8.057 223 HA PRO 32 HA PRO 32 7.680 -3.930 17.391 224 HB2 PRO 32 HB2 PRO 32 9.803 -2.492 18.747 225 HB3 PRO 32 HB3 PRO 32 8.968 -3.964 19.257 226 HG2 PRO 32 HG2 PRO 32 11.585 -3.928 18.526 227 HG3 PRO 32 HG3 PRO 32 10.535 -5.347 18.344 228 HD2 PRO 32 HD2 PRO 32 11.372 -3.345 16.282 229 HD3 PRO 32 HD3 PRO 32 11.239 -5.113 16.154 230 H GLY 33 H GLY 33 6.438 -2.150 17.580 231 HA2 GLY 33 HA2 GLY 33 5.941 0.154 17.689 232 HA3 GLY 33 HA3 GLY 33 7.523 0.509 17.015 233 H HIS 34 H HIS 34 6.150 -1.893 15.202 234 HA HIS 34 HA HIS 34 5.737 -0.251 12.947 235 HB2 HIS 34 HB2 HIS 34 6.663 -2.685 13.136 236 HB3 HIS 34 HB3 HIS 34 4.968 -3.151 13.108 237 HD1 HIS 34 HD1 HIS 34 4.426 -3.952 10.823 238 HD2 HIS 34 HD2 HIS 34 6.994 -0.705 10.727 239 HE1 HIS 34 HE1 HIS 34 4.774 -3.369 8.389 240 H VAL 35 H VAL 35 3.896 0.596 12.235 241 HA VAL 35 HA VAL 35 1.386 -0.032 13.588 242 HB VAL 35 HB VAL 35 0.744 2.065 12.024 243 HG11 VAL 35 HG11 VAL 35 1.579 1.767 14.821 244 HG12 VAL 35 HG12 VAL 35 0.121 2.497 14.141 245 HG13 VAL 35 HG13 VAL 35 1.626 3.414 14.198 246 HG21 VAL 35 HG21 VAL 35 2.951 2.387 11.099 247 HG22 VAL 35 HG22 VAL 35 3.640 2.506 12.718 248 HG23 VAL 35 HG23 VAL 35 2.535 3.751 12.137 249 H GLY 36 H GLY 36 2.960 -0.648 10.624 250 HA2 GLY 36 HA2 GLY 36 0.378 -1.385 9.401 251 HA3 GLY 36 HA3 GLY 36 1.688 -0.679 8.466 252 H VAL 37 H VAL 37 1.788 -2.394 7.101 253 HA VAL 37 HA VAL 37 3.086 -4.787 8.178 254 HB VAL 37 HB VAL 37 0.795 -5.421 7.667 255 HG11 VAL 37 HG11 VAL 37 -0.131 -4.055 6.103 256 HG12 VAL 37 HG12 VAL 37 0.250 -5.444 5.082 257 HG13 VAL 37 HG13 VAL 37 1.320 -4.044 5.104 258 HG21 VAL 37 HG21 VAL 37 2.404 -7.159 7.302 259 HG22 VAL 37 HG22 VAL 37 2.787 -6.538 5.699 260 HG23 VAL 37 HG23 VAL 37 1.204 -7.246 6.011 261 H ASP 38 H ASP 38 4.612 -5.819 6.738 262 HA ASP 38 HA ASP 38 5.532 -4.082 4.545 263 HB2 ASP 38 HB2 ASP 38 7.163 -5.354 6.743 264 HB3 ASP 38 HB3 ASP 38 7.892 -4.737 5.264 265 H TYR 39 H TYR 39 5.951 -4.944 2.698 266 HA TYR 39 HA TYR 39 6.094 -7.878 2.433 267 HB2 TYR 39 HB2 TYR 39 4.986 -6.111 0.269 268 HB3 TYR 39 HB3 TYR 39 4.803 -7.830 0.471 269 HD1 TYR 39 HD1 TYR 39 3.819 -4.605 2.014 270 HD2 TYR 39 HD2 TYR 39 2.777 -8.673 1.350 271 HE1 TYR 39 HE1 TYR 39 1.589 -4.184 2.925 272 HE2 TYR 39 HE2 TYR 39 0.537 -8.249 2.266 273 HH TYR 39 HH TYR 39 -0.557 -6.651 3.780 274 H ALA 40 H ALA 40 8.148 -8.286 1.952 275 HA ALA 40 HA ALA 40 9.999 -6.607 0.747 276 HB1 ALA 40 HB1 ALA 40 11.423 -8.581 0.521 277 HB2 ALA 40 HB2 ALA 40 10.038 -9.614 0.872 278 HB3 ALA 40 HB3 ALA 40 10.651 -8.513 2.104 279 H VAL 41 H VAL 41 9.730 -5.728 -1.191 280 HA VAL 41 HA VAL 41 9.551 -7.436 -3.512 281 HB VAL 41 HB VAL 41 7.193 -6.885 -3.001 282 HG11 VAL 41 HG11 VAL 41 6.394 -4.544 -3.483 283 HG12 VAL 41 HG12 VAL 41 8.077 -4.035 -3.328 284 HG13 VAL 41 HG13 VAL 41 7.251 -4.777 -1.959 285 HG21 VAL 41 HG21 VAL 41 7.779 -7.347 -5.288 286 HG22 VAL 41 HG22 VAL 41 8.245 -5.666 -5.547 287 HG23 VAL 41 HG23 VAL 41 6.557 -6.076 -5.243 288 HA PRO 42 HA PRO 42 12.959 -4.710 -4.691 289 HB2 PRO 42 HB2 PRO 42 12.030 -5.500 -7.421 290 HB3 PRO 42 HB3 PRO 42 13.663 -5.511 -6.740 291 HG2 PRO 42 HG2 PRO 42 12.333 -7.779 -7.015 292 HG3 PRO 42 HG3 PRO 42 13.328 -7.479 -5.576 293 HD2 PRO 42 HD2 PRO 42 10.365 -7.444 -5.854 294 HD3 PRO 42 HD3 PRO 42 11.371 -7.928 -4.474 295 H VAL 43 H VAL 43 13.285 -2.829 -5.196 296 HA VAL 43 HA VAL 43 11.362 -0.858 -5.417 297 HB VAL 43 HB VAL 43 13.437 -0.462 -4.354 298 HG11 VAL 43 HG11 VAL 43 14.763 -1.139 -6.951 299 HG12 VAL 43 HG12 VAL 43 14.946 -1.918 -5.378 300 HG13 VAL 43 HG13 VAL 43 15.593 -0.299 -5.639 301 HG21 VAL 43 HG21 VAL 43 14.084 1.298 -6.614 302 HG22 VAL 43 HG22 VAL 43 13.681 1.716 -4.951 303 HG23 VAL 43 HG23 VAL 43 12.395 1.362 -6.113 304 H GLY 44 H GLY 44 10.591 0.402 -7.039 305 HA2 GLY 44 HA2 GLY 44 10.735 1.414 -9.190 306 HA3 GLY 44 HA3 GLY 44 11.707 0.055 -9.695 307 H THR 45 H THR 45 9.198 -1.236 -8.004 308 HA THR 45 HA THR 45 7.805 -1.962 -10.395 309 HB THR 45 HB THR 45 7.025 -2.911 -7.667 310 HG1 THR 45 HG1 THR 45 8.731 -4.230 -7.560 311 HG21 THR 45 HG21 THR 45 7.125 -4.365 -10.315 312 HG22 THR 45 HG22 THR 45 5.692 -3.554 -9.687 313 HG23 THR 45 HG23 THR 45 6.376 -4.929 -8.821 314 HA PRO 46 HA PRO 46 4.759 1.319 -9.844 315 HB2 PRO 46 HB2 PRO 46 2.964 -0.499 -11.365 316 HB3 PRO 46 HB3 PRO 46 3.380 1.192 -11.680 317 HG2 PRO 46 HG2 PRO 46 4.395 -0.749 -13.182 318 HG3 PRO 46 HG3 PRO 46 5.370 0.662 -12.723 319 HD2 PRO 46 HD2 PRO 46 5.449 -2.118 -11.641 320 HD3 PRO 46 HD3 PRO 46 6.776 -0.977 -11.936 321 H VAL 47 H VAL 47 3.553 1.638 -8.118 322 HA VAL 47 HA VAL 47 2.228 -0.543 -6.806 323 HB VAL 47 HB VAL 47 2.563 2.205 -5.639 324 HG11 VAL 47 HG11 VAL 47 2.241 -0.501 -4.340 325 HG12 VAL 47 HG12 VAL 47 0.979 0.719 -4.517 326 HG13 VAL 47 HG13 VAL 47 2.379 1.041 -3.493 327 HG21 VAL 47 HG21 VAL 47 4.482 0.683 -4.390 328 HG22 VAL 47 HG22 VAL 47 4.787 1.917 -5.613 329 HG23 VAL 47 HG23 VAL 47 4.651 0.221 -6.082 330 H ARG 48 H ARG 48 0.279 -0.808 -7.013 331 HA ARG 48 HA ARG 48 -1.378 1.294 -8.011 332 HB2 ARG 48 HB2 ARG 48 -1.745 -1.686 -8.068 333 HB3 ARG 48 HB3 ARG 48 -3.025 -0.572 -8.523 334 HG2 ARG 48 HG2 ARG 48 -2.135 -0.160 -10.528 335 HG3 ARG 48 HG3 ARG 48 -0.486 -0.079 -9.894 336 HD2 ARG 48 HD2 ARG 48 -0.472 -1.933 -11.319 337 HD3 ARG 48 HD3 ARG 48 -0.637 -2.633 -9.712 338 HE ARG 48 HE ARG 48 -3.200 -2.376 -10.536 339 HH11 ARG 48 HH11 ARG 48 -1.326 -5.075 -12.908 340 HH12 ARG 48 HH12 ARG 48 -0.355 -3.853 -12.011 341 HH21 ARG 48 HH21 ARG 48 -3.599 -5.102 -12.717 342 HH22 ARG 48 HH22 ARG 48 -4.441 -3.902 -11.670 343 H ALA 49 H ALA 49 -3.445 1.688 -7.250 344 HA ALA 49 HA ALA 49 -3.538 1.764 -4.438 345 HB1 ALA 49 HB1 ALA 49 -4.442 3.565 -5.830 346 HB2 ALA 49 HB2 ALA 49 -5.651 2.936 -4.711 347 HB3 ALA 49 HB3 ALA 49 -5.701 2.475 -6.413 348 H VAL 50 H VAL 50 -4.248 0.264 -3.110 349 HA VAL 50 HA VAL 50 -5.467 -2.112 -3.965 350 HB VAL 50 HB VAL 50 -5.300 -1.167 -1.157 351 HG11 VAL 50 HG11 VAL 50 -5.447 -3.435 -0.468 352 HG12 VAL 50 HG12 VAL 50 -5.264 -4.009 -2.125 353 HG13 VAL 50 HG13 VAL 50 -6.743 -3.183 -1.638 354 HG21 VAL 50 HG21 VAL 50 -3.156 -2.215 -0.965 355 HG22 VAL 50 HG22 VAL 50 -3.111 -1.105 -2.335 356 HG23 VAL 50 HG23 VAL 50 -3.273 -2.837 -2.611 357 H ALA 51 H ALA 51 -6.869 0.872 -3.267 358 HA ALA 51 HA ALA 51 -9.469 0.056 -3.872 359 HB1 ALA 51 HB1 ALA 51 -8.824 0.490 -0.991 360 HB2 ALA 51 HB2 ALA 51 -9.810 -0.774 -1.729 361 HB3 ALA 51 HB3 ALA 51 -10.428 0.875 -1.614 362 H ASN 52 H ASN 52 -10.766 1.723 -4.363 363 HA ASN 52 HA ASN 52 -9.665 4.165 -5.013 364 HB2 ASN 52 HB2 ASN 52 -12.136 4.783 -5.352 365 HB3 ASN 52 HB3 ASN 52 -11.461 3.516 -6.311 366 HD21 ASN 52 HD21 ASN 52 -12.478 3.271 -3.005 367 HD22 ASN 52 HD22 ASN 52 -13.773 2.163 -3.274 368 H GLY 53 H GLY 53 -10.291 6.301 -4.316 369 HA2 GLY 53 HA2 GLY 53 -11.757 7.024 -2.106 370 HA3 GLY 53 HA3 GLY 53 -10.186 6.579 -1.466 371 H THR 54 H THR 54 -9.078 8.338 -1.005 372 HA THR 54 HA THR 54 -8.707 10.429 -2.898 373 HB THR 54 HB THR 54 -9.562 11.016 -0.128 374 HG1 THR 54 HG1 THR 54 -11.580 10.981 -0.762 375 HG21 THR 54 HG21 THR 54 -8.216 12.791 -1.167 376 HG22 THR 54 HG22 THR 54 -9.877 13.325 -0.915 377 HG23 THR 54 HG23 THR 54 -9.342 12.838 -2.523 378 H VAL 55 H VAL 55 -6.714 11.369 -2.686 379 HA VAL 55 HA VAL 55 -4.791 10.103 -0.998 380 HB VAL 55 HB VAL 55 -4.303 12.408 -2.887 381 HG11 VAL 55 HG11 VAL 55 -2.441 10.218 -1.987 382 HG12 VAL 55 HG12 VAL 55 -2.472 11.860 -1.343 383 HG13 VAL 55 HG13 VAL 55 -2.034 11.584 -3.030 384 HG21 VAL 55 HG21 VAL 55 -5.430 10.631 -4.144 385 HG22 VAL 55 HG22 VAL 55 -4.203 9.483 -3.612 386 HG23 VAL 55 HG23 VAL 55 -3.756 10.830 -4.656 387 H LYS 56 H LYS 56 -4.616 10.825 0.955 388 HA LYS 56 HA LYS 56 -5.172 13.549 1.719 389 HB2 LYS 56 HB2 LYS 56 -4.346 11.643 3.829 390 HB3 LYS 56 HB3 LYS 56 -5.598 12.868 3.862 391 HG2 LYS 56 HG2 LYS 56 -5.758 10.095 2.718 392 HG3 LYS 56 HG3 LYS 56 -6.648 10.754 4.082 393 HD2 LYS 56 HD2 LYS 56 -6.951 12.054 1.427 394 HD3 LYS 56 HD3 LYS 56 -7.747 10.501 1.683 395 HE2 LYS 56 HE2 LYS 56 -8.813 11.482 3.736 396 HE3 LYS 56 HE3 LYS 56 -8.152 13.046 3.254 397 HZ1 LYS 56 HZ1 LYS 56 -10.027 11.395 1.647 398 HZ2 LYS 56 HZ2 LYS 56 -9.402 12.900 1.194 399 HZ3 LYS 56 HZ3 LYS 56 -10.440 12.782 2.524 400 H PHE 57 H PHE 57 -2.582 11.600 0.988 401 HA PHE 57 HA PHE 57 -0.668 13.612 1.622 402 HB2 PHE 57 HB2 PHE 57 -0.909 12.058 3.711 403 HB3 PHE 57 HB3 PHE 57 -0.047 10.885 2.722 404 HD1 PHE 57 HD1 PHE 57 0.212 13.970 4.628 405 HD2 PHE 57 HD2 PHE 57 2.262 11.274 2.050 406 HE1 PHE 57 HE1 PHE 57 2.358 14.995 5.264 407 HE2 PHE 57 HE2 PHE 57 4.406 12.291 2.681 408 HZ PHE 57 HZ PHE 57 4.459 14.155 4.291 409 H ALA 58 H ALA 58 1.102 13.473 0.404 410 HA ALA 58 HA ALA 58 1.646 11.252 -1.299 411 HB1 ALA 58 HB1 ALA 58 1.704 12.656 -3.352 412 HB2 ALA 58 HB2 ALA 58 0.965 13.966 -2.431 413 HB3 ALA 58 HB3 ALA 58 0.081 12.462 -2.690 414 H GLY 59 H GLY 59 3.485 11.037 -0.220 415 HA2 GLY 59 HA2 GLY 59 5.406 13.202 0.005 416 HA3 GLY 59 HA3 GLY 59 5.547 11.597 0.706 417 H ASN 60 H ASN 60 6.000 13.546 -2.130 418 HA ASN 60 HA ASN 60 6.982 11.566 -3.880 419 HB2 ASN 60 HB2 ASN 60 7.158 14.571 -3.886 420 HB3 ASN 60 HB3 ASN 60 7.853 13.582 -5.164 421 HD21 ASN 60 HD21 ASN 60 4.874 13.113 -3.359 422 HD22 ASN 60 HD22 ASN 60 3.838 13.220 -4.716 423 H GLY 61 H GLY 61 8.746 10.627 -3.983 424 HA2 GLY 61 HA2 GLY 61 10.991 11.197 -2.260 425 HA3 GLY 61 HA3 GLY 61 10.823 9.824 -3.337 426 H ALA 62 H ALA 62 10.141 12.442 -5.185 427 HA ALA 62 HA ALA 62 12.625 12.332 -6.544 428 HB1 ALA 62 HB1 ALA 62 10.291 14.136 -7.063 429 HB2 ALA 62 HB2 ALA 62 10.477 12.509 -7.720 430 HB3 ALA 62 HB3 ALA 62 11.610 13.781 -8.177 431 H ASN 63 H ASN 63 11.129 14.561 -4.371 432 HA ASN 63 HA ASN 63 13.521 16.178 -4.341 433 HB2 ASN 63 HB2 ASN 63 11.293 17.059 -5.649 434 HB3 ASN 63 HB3 ASN 63 11.154 17.783 -4.060 435 HD21 ASN 63 HD21 ASN 63 12.692 17.798 -7.044 436 HD22 ASN 63 HD22 ASN 63 13.755 19.122 -6.768 437 H HIS 64 H HIS 64 12.400 14.195 -2.518 438 HA HIS 64 HA HIS 64 11.296 15.573 -0.354 439 HB2 HIS 64 HB2 HIS 64 11.392 13.383 0.777 440 HB3 HIS 64 HB3 HIS 64 10.541 13.350 -0.743 441 HD1 HIS 64 HD1 HIS 64 11.340 10.701 0.207 442 HD2 HIS 64 HD2 HIS 64 14.007 13.064 -1.934 443 HE1 HIS 64 HE1 HIS 64 13.046 9.117 -0.735 444 HE2 HIS 64 HE2 HIS 64 14.648 10.563 -2.025 445 HA PRO 65 HA PRO 65 15.332 16.705 1.460 446 HB2 PRO 65 HB2 PRO 65 13.546 17.936 3.478 447 HB3 PRO 65 HB3 PRO 65 14.844 18.690 2.530 448 HG2 PRO 65 HG2 PRO 65 12.343 19.257 1.996 449 HG3 PRO 65 HG3 PRO 65 13.489 18.962 0.666 450 HD2 PRO 65 HD2 PRO 65 11.506 17.056 1.884 451 HD3 PRO 65 HD3 PRO 65 11.803 17.462 0.194 452 H TRP 66 H TRP 66 16.323 16.289 3.479 453 HA TRP 66 HA TRP 66 15.079 14.106 4.922 454 HB2 TRP 66 HB2 TRP 66 17.912 15.117 5.084 455 HB3 TRP 66 HB3 TRP 66 17.248 13.762 5.984 456 HD1 TRP 66 HD1 TRP 66 17.864 14.747 2.278 457 HE1 TRP 66 HE1 TRP 66 18.374 12.601 0.955 458 HE3 TRP 66 HE3 TRP 66 17.223 11.302 6.015 459 HZ2 TRP 66 HZ2 TRP 66 18.492 9.824 1.426 460 HZ3 TRP 66 HZ3 TRP 66 17.557 8.923 5.489 461 HH2 TRP 66 HH2 TRP 66 18.177 8.201 3.242 462 H MET 67 H MET 67 14.800 17.210 4.972 463 HA MET 67 HA MET 67 15.467 17.905 7.644 464 HB2 MET 67 HB2 MET 67 14.015 19.303 5.433 465 HB3 MET 67 HB3 MET 67 14.022 19.973 7.058 466 HG2 MET 67 HG2 MET 67 16.451 20.092 7.019 467 HG3 MET 67 HG3 MET 67 16.470 19.378 5.407 468 HE1 MET 67 HE1 MET 67 14.519 20.785 3.524 469 HE2 MET 67 HE2 MET 67 16.255 20.575 3.295 470 HE3 MET 67 HE3 MET 67 15.519 22.158 3.045 471 H LEU 68 H LEU 68 12.531 17.141 5.875 472 HA LEU 68 HA LEU 68 11.285 16.689 8.486 473 HB2 LEU 68 HB2 LEU 68 9.124 17.338 7.624 474 HB3 LEU 68 HB3 LEU 68 10.268 18.638 7.416 475 HG LEU 68 HG LEU 68 10.425 17.531 4.968 476 HD11 LEU 68 HD11 LEU 68 8.165 16.912 4.236 477 HD12 LEU 68 HD12 LEU 68 7.576 17.045 5.894 478 HD13 LEU 68 HD13 LEU 68 8.753 15.801 5.472 479 HD21 LEU 68 HD21 LEU 68 10.005 19.871 5.443 480 HD22 LEU 68 HD22 LEU 68 8.355 19.503 5.944 481 HD23 LEU 68 HD23 LEU 68 8.838 19.277 4.263 482 H TRP 69 H TRP 69 12.801 15.021 6.258 483 HA TRP 69 HA TRP 69 10.802 12.865 6.343 484 HB2 TRP 69 HB2 TRP 69 12.655 13.110 3.991 485 HB3 TRP 69 HB3 TRP 69 11.162 12.193 4.118 486 HD1 TRP 69 HD1 TRP 69 12.012 15.981 4.411 487 HE1 TRP 69 HE1 TRP 69 10.305 17.303 3.055 488 HE3 TRP 69 HE3 TRP 69 9.222 12.094 2.599 489 HZ2 TRP 69 HZ2 TRP 69 8.105 16.797 1.389 490 HZ3 TRP 69 HZ3 TRP 69 7.341 12.621 1.117 491 HH2 TRP 69 HH2 TRP 69 6.790 14.923 0.525 492 H MET 70 H MET 70 11.560 10.742 6.415 493 HA MET 70 HA MET 70 14.410 10.274 6.803 494 HB2 MET 70 HB2 MET 70 12.336 9.973 8.939 495 HB3 MET 70 HB3 MET 70 13.669 8.826 8.881 496 HG2 MET 70 HG2 MET 70 15.258 10.697 9.000 497 HG3 MET 70 HG3 MET 70 13.903 11.817 9.125 498 HE1 MET 70 HE1 MET 70 15.310 12.692 11.276 499 HE2 MET 70 HE2 MET 70 16.464 11.360 11.229 500 HE3 MET 70 HE3 MET 70 15.587 11.715 12.717 501 H ALA 71 H ALA 71 11.136 9.004 6.497 502 HA ALA 71 HA ALA 71 12.052 6.321 5.884 503 HB1 ALA 71 HB1 ALA 71 9.692 5.760 5.701 504 HB2 ALA 71 HB2 ALA 71 9.269 7.466 5.840 505 HB3 ALA 71 HB3 ALA 71 10.019 6.631 7.200 506 H GLY 72 H GLY 72 11.178 9.171 4.196 507 HA2 GLY 72 HA2 GLY 72 11.837 9.528 1.932 508 HA3 GLY 72 HA3 GLY 72 11.671 7.807 1.650 509 H ASN 73 H ASN 73 10.044 7.266 0.415 510 HA ASN 73 HA ASN 73 7.963 9.110 -0.228 511 HB2 ASN 73 HB2 ASN 73 8.605 6.347 -1.223 512 HB3 ASN 73 HB3 ASN 73 7.247 7.301 -1.811 513 HD21 ASN 73 HD21 ASN 73 10.753 7.340 -1.432 514 HD22 ASN 73 HD22 ASN 73 11.069 8.281 -2.843 515 H ALA 74 H ALA 74 5.862 9.024 0.302 516 HA ALA 74 HA ALA 74 4.705 6.691 1.490 517 HB1 ALA 74 HB1 ALA 74 3.895 7.853 3.510 518 HB2 ALA 74 HB2 ALA 74 4.861 9.258 3.060 519 HB3 ALA 74 HB3 ALA 74 5.654 7.735 3.463 520 H VAL 75 H VAL 75 2.443 6.652 1.441 521 HA VAL 75 HA VAL 75 1.092 8.942 0.237 522 HB VAL 75 HB VAL 75 0.270 6.283 -0.836 523 HG11 VAL 75 HG11 VAL 75 -0.486 7.529 -2.683 524 HG12 VAL 75 HG12 VAL 75 0.518 8.916 -2.261 525 HG13 VAL 75 HG13 VAL 75 -0.874 8.499 -1.262 526 HG21 VAL 75 HG21 VAL 75 2.532 7.768 -2.136 527 HG22 VAL 75 HG22 VAL 75 1.853 6.211 -2.599 528 HG23 VAL 75 HG23 VAL 75 2.778 6.364 -1.105 529 H LEU 76 H LEU 76 -0.625 9.380 1.395 530 HA LEU 76 HA LEU 76 -1.985 7.207 2.777 531 HB2 LEU 76 HB2 LEU 76 -0.858 9.404 3.933 532 HB3 LEU 76 HB3 LEU 76 -2.515 9.907 3.768 533 HG LEU 76 HG LEU 76 -2.327 7.243 4.904 534 HD11 LEU 76 HD11 LEU 76 -0.169 8.033 5.725 535 HD12 LEU 76 HD12 LEU 76 -1.335 7.872 7.038 536 HD13 LEU 76 HD13 LEU 76 -0.944 9.467 6.396 537 HD21 LEU 76 HD21 LEU 76 -3.494 9.885 5.763 538 HD22 LEU 76 HD22 LEU 76 -3.630 8.415 6.721 539 HD23 LEU 76 HD23 LEU 76 -4.340 8.483 5.107 540 H ILE 77 H ILE 77 -3.919 6.948 2.425 541 HA ILE 77 HA ILE 77 -5.545 8.763 0.921 542 HB ILE 77 HB ILE 77 -4.781 6.000 0.060 543 HG12 ILE 77 HG12 ILE 77 -4.967 8.244 -1.847 544 HG13 ILE 77 HG13 ILE 77 -3.674 8.314 -0.654 545 HG21 ILE 77 HG21 ILE 77 -6.474 6.016 -1.691 546 HG22 ILE 77 HG22 ILE 77 -7.079 7.566 -1.106 547 HG23 ILE 77 HG23 ILE 77 -7.236 6.123 -0.104 548 HD11 ILE 77 HD11 ILE 77 -4.141 6.016 -2.542 549 HD12 ILE 77 HD12 ILE 77 -2.787 6.214 -1.429 550 HD13 ILE 77 HD13 ILE 77 -2.975 7.315 -2.794 551 H GLN 78 H GLN 78 -7.706 8.376 1.120 552 HA GLN 78 HA GLN 78 -8.571 6.819 3.369 553 HB2 GLN 78 HB2 GLN 78 -9.149 9.177 3.456 554 HB3 GLN 78 HB3 GLN 78 -9.923 9.075 1.888 555 HG2 GLN 78 HG2 GLN 78 -11.238 7.148 3.314 556 HG3 GLN 78 HG3 GLN 78 -10.970 8.391 4.521 557 HE21 GLN 78 HE21 GLN 78 -12.351 7.573 1.527 558 HE22 GLN 78 HE22 GLN 78 -13.475 8.867 1.410 559 H HIS 79 H HIS 79 -9.384 4.969 2.941 560 HA HIS 79 HA HIS 79 -10.055 4.032 0.373 561 HB2 HIS 79 HB2 HIS 79 -10.134 2.859 3.094 562 HB3 HIS 79 HB3 HIS 79 -10.985 2.041 1.790 563 HD1 HIS 79 HD1 HIS 79 -8.722 2.868 -0.354 564 HD2 HIS 79 HD2 HIS 79 -8.179 0.848 3.236 565 HE1 HIS 79 HE1 HIS 79 -6.559 1.595 -0.615 566 HE2 HIS 79 HE2 HIS 79 -6.261 0.371 1.566 567 H ALA 80 H ALA 80 -12.041 2.485 0.334 568 HA ALA 80 HA ALA 80 -14.203 4.137 -0.148 569 HB1 ALA 80 HB1 ALA 80 -13.675 2.048 -1.379 570 HB2 ALA 80 HB2 ALA 80 -15.370 2.209 -0.917 571 HB3 ALA 80 HB3 ALA 80 -14.303 1.147 0.002 572 H ASP 81 H ASP 81 -13.294 2.634 2.732 573 HA ASP 81 HA ASP 81 -15.956 2.620 3.842 574 HB2 ASP 81 HB2 ASP 81 -13.711 0.988 4.231 575 HB3 ASP 81 HB3 ASP 81 -14.045 1.812 5.745 576 H GLY 82 H GLY 82 -13.181 4.479 3.667 577 HA2 GLY 82 HA2 GLY 82 -13.272 6.783 4.341 578 HA3 GLY 82 HA3 GLY 82 -14.193 6.288 5.751 579 H MET 83 H MET 83 -12.023 3.930 5.517 580 HA MET 83 HA MET 83 -10.452 4.865 7.608 581 HB2 MET 83 HB2 MET 83 -9.225 2.711 7.215 582 HB3 MET 83 HB3 MET 83 -10.900 2.587 7.621 583 HG2 MET 83 HG2 MET 83 -11.404 2.192 5.241 584 HG3 MET 83 HG3 MET 83 -9.676 2.265 4.908 585 HE1 MET 83 HE1 MET 83 -11.995 0.552 7.621 586 HE2 MET 83 HE2 MET 83 -11.851 -1.135 7.133 587 HE3 MET 83 HE3 MET 83 -12.636 0.025 6.065 588 H HIS 84 H HIS 84 -7.991 4.684 7.539 589 HA HIS 84 HA HIS 84 -7.137 6.037 5.130 590 HB2 HIS 84 HB2 HIS 84 -6.145 6.290 7.958 591 HB3 HIS 84 HB3 HIS 84 -5.243 6.923 6.590 592 HD1 HIS 84 HD1 HIS 84 -5.944 9.170 5.690 593 HD2 HIS 84 HD2 HIS 84 -8.655 7.607 8.420 594 HE1 HIS 84 HE1 HIS 84 -7.557 11.038 6.181 595 HE2 HIS 84 HE2 HIS 84 -9.195 10.067 7.829 596 H THR 85 H THR 85 -5.292 5.347 4.033 597 HA THR 85 HA THR 85 -3.872 3.080 5.148 598 HB THR 85 HB THR 85 -3.906 2.535 2.487 599 HG1 THR 85 HG1 THR 85 -5.940 4.164 2.832 600 HG21 THR 85 HG21 THR 85 -4.146 0.862 4.168 601 HG22 THR 85 HG22 THR 85 -5.561 0.751 3.120 602 HG23 THR 85 HG23 THR 85 -5.689 1.537 4.693 603 H GLY 86 H GLY 86 -1.805 3.356 5.055 604 HA2 GLY 86 HA2 GLY 86 -0.696 5.435 3.309 605 HA3 GLY 86 HA3 GLY 86 0.067 4.816 4.764 606 H TYR 87 H TYR 87 1.266 5.059 2.199 607 HA TYR 87 HA TYR 87 2.003 2.312 1.665 608 HB2 TYR 87 HB2 TYR 87 1.630 4.477 -0.439 609 HB3 TYR 87 HB3 TYR 87 2.189 2.841 -0.740 610 HD1 TYR 87 HD1 TYR 87 -0.816 4.604 0.714 611 HD2 TYR 87 HD2 TYR 87 0.653 1.301 -1.558 612 HE1 TYR 87 HE1 TYR 87 -3.118 3.885 0.269 613 HE2 TYR 87 HE2 TYR 87 -1.672 0.586 -2.005 614 HH TYR 87 HH TYR 87 -4.346 2.544 -1.398 615 H ALA 88 H ALA 88 3.926 2.414 2.765 616 HA ALA 88 HA ALA 88 5.643 4.733 2.191 617 HB1 ALA 88 HB1 ALA 88 6.688 4.424 4.361 618 HB2 ALA 88 HB2 ALA 88 5.666 3.026 4.672 619 HB3 ALA 88 HB3 ALA 88 4.945 4.625 4.521 620 H HIS 89 H HIS 89 7.991 4.341 2.507 621 HA HIS 89 HA HIS 89 9.941 3.475 1.799 622 HB2 HIS 89 HB2 HIS 89 8.523 0.851 2.307 623 HB3 HIS 89 HB3 HIS 89 10.212 0.951 1.824 624 HD1 HIS 89 HD1 HIS 89 11.670 2.607 3.551 625 HD2 HIS 89 HD2 HIS 89 8.218 0.807 4.988 626 HE1 HIS 89 HE1 HIS 89 11.870 2.659 6.058 627 HE2 HIS 89 HE2 HIS 89 9.772 1.559 6.905 628 H LEU 90 H LEU 90 8.191 4.372 -0.127 629 HA LEU 90 HA LEU 90 8.551 2.648 -2.422 630 HB2 LEU 90 HB2 LEU 90 7.071 5.252 -2.408 631 HB3 LEU 90 HB3 LEU 90 6.915 3.930 -3.536 632 HG LEU 90 HG LEU 90 6.059 3.704 -0.646 633 HD11 LEU 90 HD11 LEU 90 4.311 4.347 -3.012 634 HD12 LEU 90 HD12 LEU 90 4.858 5.532 -1.827 635 HD13 LEU 90 HD13 LEU 90 3.824 4.200 -1.325 636 HD21 LEU 90 HD21 LEU 90 6.339 1.575 -1.577 637 HD22 LEU 90 HD22 LEU 90 5.620 2.057 -3.112 638 HD23 LEU 90 HD23 LEU 90 4.608 1.903 -1.676 639 H SER 91 H SER 91 9.136 3.926 -4.520 640 HA SER 91 HA SER 91 11.443 5.550 -3.896 641 HB2 SER 91 HB2 SER 91 11.834 3.411 -5.161 642 HB3 SER 91 HB3 SER 91 10.909 4.108 -6.488 643 HG SER 91 HG SER 91 13.321 5.119 -5.383 644 H LYS 92 H LYS 92 8.325 5.729 -5.190 645 HA LYS 92 HA LYS 92 8.550 8.435 -5.834 646 HB2 LYS 92 HB2 LYS 92 9.326 6.750 -7.929 647 HB3 LYS 92 HB3 LYS 92 7.698 7.273 -8.327 648 HG2 LYS 92 HG2 LYS 92 8.304 9.546 -8.268 649 HG3 LYS 92 HG3 LYS 92 9.874 9.160 -7.559 650 HD2 LYS 92 HD2 LYS 92 10.579 8.063 -9.578 651 HD3 LYS 92 HD3 LYS 92 8.960 8.212 -10.269 652 HE2 LYS 92 HE2 LYS 92 9.180 10.609 -10.383 653 HE3 LYS 92 HE3 LYS 92 10.721 10.549 -9.529 654 HZ1 LYS 92 HZ1 LYS 92 11.641 9.296 -11.403 655 HZ2 LYS 92 HZ2 LYS 92 11.079 10.818 -11.884 656 HZ3 LYS 92 HZ3 LYS 92 10.168 9.433 -12.226 657 H ILE 93 H ILE 93 6.632 9.342 -6.613 658 HA ILE 93 HA ILE 93 4.231 7.795 -6.136 659 HB ILE 93 HB ILE 93 5.132 10.270 -4.926 660 HG12 ILE 93 HG12 ILE 93 3.136 9.551 -3.364 661 HG13 ILE 93 HG13 ILE 93 3.332 8.032 -4.231 662 HG21 ILE 93 HG21 ILE 93 3.424 11.138 -6.509 663 HG22 ILE 93 HG22 ILE 93 3.176 11.520 -4.804 664 HG23 ILE 93 HG23 ILE 93 2.236 10.240 -5.567 665 HD11 ILE 93 HD11 ILE 93 5.226 9.414 -2.381 666 HD12 ILE 93 HD12 ILE 93 5.842 8.303 -3.603 667 HD13 ILE 93 HD13 ILE 93 4.699 7.732 -2.391 668 H SER 94 H SER 94 2.439 8.285 -7.317 669 HA SER 94 HA SER 94 2.836 9.817 -9.754 670 HB2 SER 94 HB2 SER 94 2.342 7.248 -9.716 671 HB3 SER 94 HB3 SER 94 0.698 7.792 -9.372 672 HG SER 94 HG SER 94 1.924 7.664 -11.730 673 H VAL 95 H VAL 95 1.363 9.892 -6.808 674 HA VAL 95 HA VAL 95 -0.981 11.193 -7.754 675 HB VAL 95 HB VAL 95 -1.497 10.841 -5.133 676 HG11 VAL 95 HG11 VAL 95 -3.013 10.337 -6.949 677 HG12 VAL 95 HG12 VAL 95 -2.924 8.970 -5.841 678 HG13 VAL 95 HG13 VAL 95 -2.061 8.917 -7.376 679 HG21 VAL 95 HG21 VAL 95 0.303 8.602 -5.977 680 HG22 VAL 95 HG22 VAL 95 -0.956 8.362 -4.766 681 HG23 VAL 95 HG23 VAL 95 0.325 9.541 -4.482 682 H SER 96 H SER 96 -1.781 12.593 -5.639 683 HA SER 96 HA SER 96 0.211 14.321 -4.626 684 HB2 SER 96 HB2 SER 96 -1.801 15.418 -6.607 685 HB3 SER 96 HB3 SER 96 -0.720 16.396 -5.615 686 HG SER 96 HG SER 96 0.650 14.502 -6.973 687 H THR 97 H THR 97 -0.508 15.480 -2.921 688 HA THR 97 HA THR 97 -2.544 14.466 -1.376 689 HB THR 97 HB THR 97 -1.542 17.288 -1.094 690 HG1 THR 97 HG1 THR 97 0.178 16.221 0.178 691 HG21 THR 97 HG21 THR 97 -1.761 16.862 1.301 692 HG22 THR 97 HG22 THR 97 -2.267 15.205 0.974 693 HG23 THR 97 HG23 THR 97 -3.295 16.552 0.484 694 H ASP 98 H ASP 98 -4.673 14.735 -1.309 695 HA ASP 98 HA ASP 98 -6.731 15.737 -1.297 696 HB2 ASP 98 HB2 ASP 98 -5.279 18.031 -1.545 697 HB3 ASP 98 HB3 ASP 98 -6.162 18.026 -3.070 698 H SER 99 H SER 99 -4.922 14.661 -3.866 699 HA SER 99 HA SER 99 -6.880 14.969 -5.917 700 HB2 SER 99 HB2 SER 99 -4.373 14.787 -6.288 701 HB3 SER 99 HB3 SER 99 -4.542 13.074 -5.898 702 HG SER 99 HG SER 99 -5.726 14.491 -8.052 703 H THR 100 H THR 100 -8.183 13.327 -6.767 704 HA THR 100 HA THR 100 -8.945 11.291 -4.935 705 HB THR 100 HB THR 100 -10.575 10.684 -6.820 706 HG1 THR 100 HG1 THR 100 -10.550 13.233 -7.762 707 HG21 THR 100 HG21 THR 100 -12.089 12.494 -6.126 708 HG22 THR 100 HG22 THR 100 -10.714 13.343 -5.414 709 HG23 THR 100 HG23 THR 100 -11.222 11.782 -4.762 710 H VAL 101 H VAL 101 -8.897 9.093 -5.265 711 HA VAL 101 HA VAL 101 -7.238 8.170 -7.428 712 HB VAL 101 HB VAL 101 -6.758 6.314 -5.557 713 HG11 VAL 101 HG11 VAL 101 -5.087 7.292 -6.955 714 HG12 VAL 101 HG12 VAL 101 -4.555 7.402 -5.276 715 HG13 VAL 101 HG13 VAL 101 -5.207 8.825 -6.091 716 HG21 VAL 101 HG21 VAL 101 -6.125 7.450 -3.469 717 HG22 VAL 101 HG22 VAL 101 -7.864 7.458 -3.754 718 HG23 VAL 101 HG23 VAL 101 -6.914 8.913 -4.055 719 H LYS 102 H LYS 102 -7.359 5.775 -7.699 720 HA LYS 102 HA LYS 102 -9.865 4.570 -7.132 721 HB2 LYS 102 HB2 LYS 102 -9.943 5.807 -9.333 722 HB3 LYS 102 HB3 LYS 102 -8.782 4.619 -9.868 723 HG2 LYS 102 HG2 LYS 102 -10.482 2.859 -9.190 724 HG3 LYS 102 HG3 LYS 102 -11.630 4.187 -9.035 725 HD2 LYS 102 HD2 LYS 102 -11.173 4.791 -11.397 726 HD3 LYS 102 HD3 LYS 102 -10.150 3.358 -11.526 727 HE2 LYS 102 HE2 LYS 102 -12.097 1.965 -10.897 728 HE3 LYS 102 HE3 LYS 102 -13.100 3.415 -10.898 729 HZ1 LYS 102 HZ1 LYS 102 -13.310 2.222 -12.974 730 HZ2 LYS 102 HZ2 LYS 102 -11.641 2.306 -13.235 731 HZ3 LYS 102 HZ3 LYS 102 -12.569 3.720 -13.246 732 H GLN 103 H GLN 103 -9.858 2.410 -7.159 733 HA GLN 103 HA GLN 103 -7.616 1.095 -6.320 734 HB2 GLN 103 HB2 GLN 103 -10.104 0.499 -6.059 735 HB3 GLN 103 HB3 GLN 103 -9.928 -0.299 -7.608 736 HG2 GLN 103 HG2 GLN 103 -7.972 -1.038 -5.527 737 HG3 GLN 103 HG3 GLN 103 -9.632 -1.574 -5.287 738 HE21 GLN 103 HE21 GLN 103 -8.432 -1.115 -8.453 739 HE22 GLN 103 HE22 GLN 103 -8.270 -2.756 -8.854 740 H GLY 104 H GLY 104 -6.160 -0.188 -7.234 741 HA2 GLY 104 HA2 GLY 104 -4.877 -1.272 -8.788 742 HA3 GLY 104 HA3 GLY 104 -6.173 -1.099 -9.901 743 H GLN 105 H GLN 105 -5.732 1.933 -8.952 744 HA GLN 105 HA GLN 105 -4.342 2.696 -11.313 745 HB2 GLN 105 HB2 GLN 105 -6.224 3.973 -10.310 746 HB3 GLN 105 HB3 GLN 105 -5.198 4.365 -8.949 747 HG2 GLN 105 HG2 GLN 105 -3.797 5.729 -10.326 748 HG3 GLN 105 HG3 GLN 105 -4.632 5.193 -11.788 749 HE21 GLN 105 HE21 GLN 105 -5.075 6.890 -8.741 750 HE22 GLN 105 HE22 GLN 105 -6.391 7.871 -9.262 751 H ILE 106 H ILE 106 -2.369 3.499 -11.546 752 HA ILE 106 HA ILE 106 -0.465 2.655 -9.693 753 HB ILE 106 HB ILE 106 -0.137 4.159 -12.216 754 HG12 ILE 106 HG12 ILE 106 0.821 1.370 -11.685 755 HG13 ILE 106 HG13 ILE 106 -0.865 1.659 -12.091 756 HG21 ILE 106 HG21 ILE 106 2.042 3.072 -10.441 757 HG22 ILE 106 HG22 ILE 106 1.728 4.773 -10.782 758 HG23 ILE 106 HG23 ILE 106 2.293 3.707 -12.068 759 HD11 ILE 106 HD11 ILE 106 0.304 1.025 -14.070 760 HD12 ILE 106 HD12 ILE 106 1.546 2.246 -13.790 761 HD13 ILE 106 HD13 ILE 106 -0.099 2.738 -14.200 762 H ILE 107 H ILE 107 -0.481 3.649 -7.862 763 HA ILE 107 HA ILE 107 -0.642 6.482 -7.663 764 HB ILE 107 HB ILE 107 -0.547 5.883 -5.154 765 HG12 ILE 107 HG12 ILE 107 -1.772 3.292 -5.841 766 HG13 ILE 107 HG13 ILE 107 -0.025 3.370 -6.035 767 HG21 ILE 107 HG21 ILE 107 -2.507 6.745 -6.336 768 HG22 ILE 107 HG22 ILE 107 -2.953 5.547 -5.121 769 HG23 ILE 107 HG23 ILE 107 -2.918 5.101 -6.828 770 HD11 ILE 107 HD11 ILE 107 -0.713 2.519 -3.837 771 HD12 ILE 107 HD12 ILE 107 -1.513 4.056 -3.510 772 HD13 ILE 107 HD13 ILE 107 0.237 4.000 -3.720 773 H GLY 108 H GLY 108 1.876 4.322 -7.967 774 HA2 GLY 108 HA2 GLY 108 3.903 6.146 -7.727 775 HA3 GLY 108 HA3 GLY 108 3.754 5.388 -6.149 776 H TYR 109 H TYR 109 5.851 4.656 -6.512 777 HA TYR 109 HA TYR 109 6.041 2.124 -7.841 778 HB2 TYR 109 HB2 TYR 109 8.240 4.197 -8.031 779 HB3 TYR 109 HB3 TYR 109 8.246 2.596 -8.754 780 HD1 TYR 109 HD1 TYR 109 7.336 2.243 -10.915 781 HD2 TYR 109 HD2 TYR 109 6.627 5.914 -8.894 782 HE1 TYR 109 HE1 TYR 109 6.409 3.194 -12.986 783 HE2 TYR 109 HE2 TYR 109 5.697 6.882 -10.960 784 HH TYR 109 HH TYR 109 4.855 5.014 -13.644 785 H THR 110 H THR 110 7.211 0.664 -6.699 786 HA THR 110 HA THR 110 7.533 1.001 -3.947 787 HB THR 110 HB THR 110 8.982 -1.196 -4.369 788 HG1 THR 110 HG1 THR 110 7.789 -2.180 -6.276 789 HG21 THR 110 HG21 THR 110 6.806 -2.463 -4.374 790 HG22 THR 110 HG22 THR 110 5.997 -0.908 -4.516 791 HG23 THR 110 HG23 THR 110 6.979 -1.263 -3.095 792 H GLY 111 H GLY 111 9.442 1.030 -2.596 793 HA2 GLY 111 HA2 GLY 111 12.007 1.303 -3.905 794 HA3 GLY 111 HA3 GLY 111 11.414 2.771 -3.161 795 H ALA 112 H ALA 112 13.427 2.574 -2.005 796 HA ALA 112 HA ALA 112 12.977 1.335 0.519 797 HB1 ALA 112 HB1 ALA 112 14.562 -0.050 -1.258 798 HB2 ALA 112 HB2 ALA 112 14.622 -0.228 0.497 799 HB3 ALA 112 HB3 ALA 112 15.746 0.857 -0.318 800 H THR 113 H THR 113 12.708 3.883 0.164 801 HA THR 113 HA THR 113 15.145 5.405 0.300 802 HB THR 113 HB THR 113 13.591 7.354 0.605 803 HG1 THR 113 HG1 THR 113 11.330 6.800 0.141 804 HG21 THR 113 HG21 THR 113 13.251 5.486 -1.738 805 HG22 THR 113 HG22 THR 113 14.307 6.895 -1.613 806 HG23 THR 113 HG23 THR 113 12.558 7.107 -1.703 807 H GLY 114 H GLY 114 13.690 3.598 2.611 808 HA2 GLY 114 HA2 GLY 114 14.221 5.505 4.797 809 HA3 GLY 114 HA3 GLY 114 13.236 4.057 4.931 810 H GLN 115 H GLN 115 14.584 3.665 6.857 811 HA GLN 115 HA GLN 115 17.334 2.830 6.324 812 HB2 GLN 115 HB2 GLN 115 15.746 3.394 8.796 813 HB3 GLN 115 HB3 GLN 115 17.165 2.363 8.913 814 HG2 GLN 115 HG2 GLN 115 18.522 4.158 7.920 815 HG3 GLN 115 HG3 GLN 115 17.093 5.190 7.884 816 HE21 GLN 115 HE21 GLN 115 16.290 6.030 9.798 817 HE22 GLN 115 HE22 GLN 115 17.195 6.013 11.270 818 H VAL 116 H VAL 116 17.097 0.971 5.150 819 HA VAL 116 HA VAL 116 16.473 -1.423 6.645 820 HB VAL 116 HB VAL 116 15.118 -2.352 4.649 821 HG11 VAL 116 HG11 VAL 116 13.075 -1.816 5.691 822 HG12 VAL 116 HG12 VAL 116 13.697 -0.284 6.302 823 HG13 VAL 116 HG13 VAL 116 14.286 -1.806 6.971 824 HG21 VAL 116 HG21 VAL 116 15.547 -0.325 3.197 825 HG22 VAL 116 HG22 VAL 116 14.415 0.552 4.227 826 HG23 VAL 116 HG23 VAL 116 13.866 -0.845 3.302 827 H THR 117 H THR 117 16.996 -3.427 5.326 828 HA THR 117 HA THR 117 19.542 -2.983 3.985 829 HB THR 117 HB THR 117 19.646 -5.534 4.026 830 HG1 THR 117 HG1 THR 117 18.199 -6.462 5.613 831 HG21 THR 117 HG21 THR 117 19.459 -4.016 6.631 832 HG22 THR 117 HG22 THR 117 20.887 -4.172 5.609 833 HG23 THR 117 HG23 THR 117 20.228 -5.590 6.425 834 H GLY 118 H GLY 118 16.319 -3.411 3.044 835 HA2 GLY 118 HA2 GLY 118 17.106 -3.699 0.280 836 HA3 GLY 118 HA3 GLY 118 16.211 -5.073 0.907 837 HA PRO 119 HA PRO 119 13.218 -1.629 -0.465 838 HB2 PRO 119 HB2 PRO 119 12.603 -3.022 -2.919 839 HB3 PRO 119 HB3 PRO 119 13.315 -1.422 -2.719 840 HG2 PRO 119 HG2 PRO 119 14.678 -3.529 -3.768 841 HG3 PRO 119 HG3 PRO 119 15.454 -2.180 -2.918 842 HD2 PRO 119 HD2 PRO 119 14.757 -4.905 -1.891 843 HD3 PRO 119 HD3 PRO 119 16.236 -3.950 -1.650 844 H HIS 120 H HIS 120 10.974 -1.768 -0.173 845 HA HIS 120 HA HIS 120 9.557 -4.169 -0.524 846 HB2 HIS 120 HB2 HIS 120 8.949 -4.594 1.817 847 HB3 HIS 120 HB3 HIS 120 10.694 -4.688 1.619 848 HD1 HIS 120 HD1 HIS 120 11.958 -2.308 2.300 849 HD2 HIS 120 HD2 HIS 120 8.190 -3.035 3.890 850 HE1 HIS 120 HE1 HIS 120 11.744 -0.755 4.265 851 HE2 HIS 120 HE2 HIS 120 9.471 -1.237 5.235 852 H LEU 121 H LEU 121 7.480 -3.733 1.158 853 HA LEU 121 HA LEU 121 6.358 -1.235 0.355 854 HB2 LEU 121 HB2 LEU 121 5.431 -2.651 -1.230 855 HB3 LEU 121 HB3 LEU 121 5.281 -3.978 -0.118 856 HG LEU 121 HG LEU 121 3.407 -2.675 0.996 857 HD11 LEU 121 HD11 LEU 121 2.311 -0.936 -0.304 858 HD12 LEU 121 HD12 LEU 121 3.563 -1.044 -1.542 859 HD13 LEU 121 HD13 LEU 121 3.968 -0.462 0.073 860 HD21 LEU 121 HD21 LEU 121 3.028 -4.573 -0.499 861 HD22 LEU 121 HD22 LEU 121 3.025 -3.479 -1.883 862 HD23 LEU 121 HD23 LEU 121 1.764 -3.352 -0.658 863 H HIS 122 H HIS 122 5.124 -0.284 1.801 864 HA HIS 122 HA HIS 122 4.575 -1.636 4.277 865 HB2 HIS 122 HB2 HIS 122 6.305 -0.082 4.779 866 HB3 HIS 122 HB3 HIS 122 5.532 1.184 3.841 867 HD2 HIS 122 HD2 HIS 122 3.157 2.281 5.133 868 HE1 HIS 122 HE1 HIS 122 4.295 0.853 8.928 869 HE2 HIS 122 HE2 HIS 122 2.752 2.409 7.680 870 H PHE 123 H PHE 123 2.497 -1.935 4.524 871 HA PHE 123 HA PHE 123 0.629 0.103 3.547 872 HB2 PHE 123 HB2 PHE 123 0.678 -2.211 2.409 873 HB3 PHE 123 HB3 PHE 123 -0.038 -2.820 3.892 874 HD1 PHE 123 HD1 PHE 123 -2.365 -2.402 4.411 875 HD2 PHE 123 HD2 PHE 123 -0.548 -0.719 0.943 876 HE1 PHE 123 HE1 PHE 123 -4.583 -1.831 3.522 877 HE2 PHE 123 HE2 PHE 123 -2.766 -0.145 0.056 878 HZ PHE 123 HZ PHE 123 -4.787 -0.704 1.344 879 H GLU 124 H GLU 124 0.021 1.210 5.276 880 HA GLU 124 HA GLU 124 -0.722 -0.121 7.706 881 HB2 GLU 124 HB2 GLU 124 -0.152 1.893 8.903 882 HB3 GLU 124 HB3 GLU 124 1.194 1.485 7.851 883 HG2 GLU 124 HG2 GLU 124 0.552 3.209 6.289 884 HG3 GLU 124 HG3 GLU 124 -0.870 3.596 7.258 885 H MET 125 H MET 125 -2.729 -0.041 8.259 886 HA MET 125 HA MET 125 -4.573 1.717 6.938 887 HB2 MET 125 HB2 MET 125 -5.030 -0.293 5.921 888 HB3 MET 125 HB3 MET 125 -4.599 -1.173 7.345 889 HG2 MET 125 HG2 MET 125 -6.701 -0.890 8.321 890 HG3 MET 125 HG3 MET 125 -7.117 0.423 7.221 891 HE1 MET 125 HE1 MET 125 -8.212 -2.716 8.202 892 HE2 MET 125 HE2 MET 125 -9.153 -3.207 6.793 893 HE3 MET 125 HE3 MET 125 -9.392 -1.609 7.500 894 H LEU 126 H LEU 126 -5.953 2.701 8.117 895 HA LEU 126 HA LEU 126 -6.279 2.136 10.935 896 HB2 LEU 126 HB2 LEU 126 -5.026 4.551 9.713 897 HB3 LEU 126 HB3 LEU 126 -6.103 4.829 11.062 898 HG LEU 126 HG LEU 126 -4.542 2.925 12.139 899 HD11 LEU 126 HD11 LEU 126 -2.745 4.421 10.237 900 HD12 LEU 126 HD12 LEU 126 -3.142 2.705 10.153 901 HD13 LEU 126 HD13 LEU 126 -2.220 3.331 11.519 902 HD21 LEU 126 HD21 LEU 126 -3.937 5.870 12.000 903 HD22 LEU 126 HD22 LEU 126 -3.318 4.751 13.215 904 HD23 LEU 126 HD23 LEU 126 -5.048 5.077 13.115 905 HA PRO 127 HA PRO 127 -10.561 3.454 10.242 906 HB2 PRO 127 HB2 PRO 127 -10.971 5.286 12.239 907 HB3 PRO 127 HB3 PRO 127 -11.143 3.559 12.454 908 HG2 PRO 127 HG2 PRO 127 -8.871 5.325 13.159 909 HG3 PRO 127 HG3 PRO 127 -9.502 3.910 14.032 910 HD2 PRO 127 HD2 PRO 127 -7.263 3.764 12.600 911 HD3 PRO 127 HD3 PRO 127 -8.409 2.421 12.647 912 H ALA 128 H ALA 128 -12.001 5.461 10.190 913 HA ALA 128 HA ALA 128 -10.905 7.366 8.465 914 HB1 ALA 128 HB1 ALA 128 -13.490 7.458 10.003 915 HB2 ALA 128 HB2 ALA 128 -13.276 6.749 8.401 916 HB3 ALA 128 HB3 ALA 128 -13.080 8.486 8.630 917 H ASN 129 H ASN 129 -11.310 7.044 11.847 918 HA ASN 129 HA ASN 129 -9.675 9.247 12.524 919 HB2 ASN 129 HB2 ASN 129 -12.576 9.664 12.661 920 HB3 ASN 129 HB3 ASN 129 -11.785 9.896 14.217 921 HD21 ASN 129 HD21 ASN 129 -11.932 10.968 10.892 922 HD22 ASN 129 HD22 ASN 129 -11.188 12.505 11.152 923 HA PRO 130 HA PRO 130 -9.033 5.881 15.122 924 HB2 PRO 130 HB2 PRO 130 -6.478 7.053 15.828 925 HB3 PRO 130 HB3 PRO 130 -6.831 5.564 14.939 926 HG2 PRO 130 HG2 PRO 130 -5.839 7.812 13.732 927 HG3 PRO 130 HG3 PRO 130 -6.771 6.575 12.886 928 HD2 PRO 130 HD2 PRO 130 -7.600 9.250 13.884 929 HD3 PRO 130 HD3 PRO 130 -8.091 8.369 12.422 930 H ASN 131 H ASN 131 -8.442 5.388 17.208 931 HA ASN 131 HA ASN 131 -8.889 7.446 19.198 932 HB2 ASN 131 HB2 ASN 131 -10.478 5.314 18.685 933 HB3 ASN 131 HB3 ASN 131 -9.375 4.666 19.885 934 HD21 ASN 131 HD21 ASN 131 -11.872 6.895 19.189 935 HD22 ASN 131 HD22 ASN 131 -12.227 7.337 20.807 936 H TRP 132 H TRP 132 -6.557 7.651 18.760 937 HA TRP 132 HA TRP 132 -4.676 5.692 19.327 938 HB2 TRP 132 HB2 TRP 132 -4.176 8.630 19.778 939 HB3 TRP 132 HB3 TRP 132 -3.024 7.404 19.270 940 HD1 TRP 132 HD1 TRP 132 -3.404 6.454 16.692 941 HE1 TRP 132 HE1 TRP 132 -4.169 7.742 14.597 942 HE3 TRP 132 HE3 TRP 132 -5.626 10.466 18.954 943 HZ2 TRP 132 HZ2 TRP 132 -5.532 10.085 13.989 944 HZ3 TRP 132 HZ3 TRP 132 -6.649 12.194 17.528 945 HH2 TRP 132 HH2 TRP 132 -6.602 12.009 15.091 946 H GLN 133 H GLN 133 -6.827 6.490 21.412 947 HA GLN 133 HA GLN 133 -5.388 7.201 23.740 948 HB2 GLN 133 HB2 GLN 133 -8.235 6.414 23.221 949 HB3 GLN 133 HB3 GLN 133 -7.609 6.886 24.772 950 HG2 GLN 133 HG2 GLN 133 -8.555 8.860 24.018 951 HG3 GLN 133 HG3 GLN 133 -6.863 9.056 23.566 952 HE21 GLN 133 HE21 GLN 133 -6.289 8.520 21.336 953 HE22 GLN 133 HE22 GLN 133 -7.434 8.742 20.071 954 H ASN 134 H ASN 134 -4.616 4.809 22.511 955 HA ASN 134 HA ASN 134 -3.665 2.852 23.040 956 HB2 ASN 134 HB2 ASN 134 -4.812 3.445 25.765 957 HB3 ASN 134 HB3 ASN 134 -3.929 1.959 25.416 958 HD21 ASN 134 HD21 ASN 134 -3.710 5.464 25.315 959 HD22 ASN 134 HD22 ASN 134 -2.002 5.549 25.526 960 H GLY 135 H GLY 135 -4.260 0.982 22.345 961 HA2 GLY 135 HA2 GLY 135 -6.114 -0.772 23.090 962 HA3 GLY 135 HA3 GLY 135 -7.091 0.419 22.243 963 H PHE 136 H PHE 136 -5.595 1.099 20.082 964 HA PHE 136 HA PHE 136 -4.603 -1.278 18.772 965 HB2 PHE 136 HB2 PHE 136 -6.173 -0.727 16.751 966 HB3 PHE 136 HB3 PHE 136 -6.737 -1.755 18.050 967 HD1 PHE 136 HD1 PHE 136 -9.022 -1.471 17.635 968 HD2 PHE 136 HD2 PHE 136 -6.607 1.976 18.332 969 HE1 PHE 136 HE1 PHE 136 -11.042 -0.094 17.858 970 HE2 PHE 136 HE2 PHE 136 -8.623 3.339 18.534 971 HZ PHE 136 HZ PHE 136 -10.846 2.316 18.308 972 H SER 137 H SER 137 -4.934 2.078 18.984 973 HA SER 137 HA SER 137 -3.782 3.856 18.204 974 HB2 SER 137 HB2 SER 137 -1.928 1.684 17.223 975 HB3 SER 137 HB3 SER 137 -1.630 3.384 16.865 976 HG SER 137 HG SER 137 -1.286 3.779 18.977 977 H GLY 138 H GLY 138 -5.776 2.150 16.871 978 HA2 GLY 138 HA2 GLY 138 -7.189 2.475 15.112 979 HA3 GLY 138 HA3 GLY 138 -6.120 3.733 14.531 980 H ARG 139 H ARG 139 -3.978 1.432 14.895 981 HA ARG 139 HA ARG 139 -4.092 0.739 12.108 982 HB2 ARG 139 HB2 ARG 139 -1.936 -0.554 12.649 983 HB3 ARG 139 HB3 ARG 139 -1.909 1.192 12.774 984 HG2 ARG 139 HG2 ARG 139 -0.863 0.736 14.722 985 HG3 ARG 139 HG3 ARG 139 -2.514 0.605 15.313 986 HD2 ARG 139 HD2 ARG 139 -2.155 -1.512 15.893 987 HD3 ARG 139 HD3 ARG 139 -1.708 -1.919 14.238 988 HE ARG 139 HE ARG 139 0.569 -1.431 14.781 989 HH11 ARG 139 HH11 ARG 139 -1.597 -1.476 17.571 990 HH12 ARG 139 HH12 ARG 139 -0.247 -1.710 18.740 991 HH21 ARG 139 HH21 ARG 139 1.906 -1.847 17.999 992 HH22 ARG 139 HH22 ARG 139 2.276 -1.723 16.241 993 H ILE 140 H ILE 140 -4.980 -0.975 11.216 994 HA ILE 140 HA ILE 140 -5.393 -3.350 12.835 995 HB ILE 140 HB ILE 140 -7.472 -3.114 10.880 996 HG12 ILE 140 HG12 ILE 140 -8.743 -1.433 12.478 997 HG13 ILE 140 HG13 ILE 140 -7.114 -0.852 12.801 998 HG21 ILE 140 HG21 ILE 140 -8.878 -3.704 12.791 999 HG22 ILE 140 HG22 ILE 140 -7.502 -3.452 13.864 1000 HG23 ILE 140 HG23 ILE 140 -7.457 -4.742 12.663 1001 HD11 ILE 140 HD11 ILE 140 -6.793 -0.256 10.529 1002 HD12 ILE 140 HD12 ILE 140 -8.363 0.380 11.021 1003 HD13 ILE 140 HD13 ILE 140 -8.270 -1.083 10.038 1004 H ASP 141 H ASP 141 -6.516 -5.064 11.096 1005 HA ASP 141 HA ASP 141 -4.281 -5.849 9.525 1006 HB2 ASP 141 HB2 ASP 141 -5.676 -7.885 9.036 1007 HB3 ASP 141 HB3 ASP 141 -5.351 -7.578 10.735 1008 HA PRO 142 HA PRO 142 -5.894 -4.177 5.624 1009 HB2 PRO 142 HB2 PRO 142 -3.777 -5.508 4.193 1010 HB3 PRO 142 HB3 PRO 142 -3.953 -3.791 4.550 1011 HG2 PRO 142 HG2 PRO 142 -2.011 -5.378 5.632 1012 HG3 PRO 142 HG3 PRO 142 -2.614 -3.889 6.379 1013 HD2 PRO 142 HD2 PRO 142 -3.259 -6.725 7.029 1014 HD3 PRO 142 HD3 PRO 142 -3.064 -5.325 8.103 1015 H THR 143 H THR 143 -5.803 -7.404 6.530 1016 HA THR 143 HA THR 143 -6.022 -8.972 4.319 1017 HB THR 143 HB THR 143 -7.632 -10.310 5.920 1018 HG1 THR 143 HG1 THR 143 -6.505 -9.479 8.104 1019 HG21 THR 143 HG21 THR 143 -4.704 -9.886 6.467 1020 HG22 THR 143 HG22 THR 143 -5.381 -11.000 5.281 1021 HG23 THR 143 HG23 THR 143 -5.658 -11.269 7.002 1022 H GLY 144 H GLY 144 -8.336 -6.738 5.442 1023 HA2 GLY 144 HA2 GLY 144 -10.706 -7.964 4.385 1024 HA3 GLY 144 HA3 GLY 144 -10.543 -6.290 4.891 1025 H TYR 145 H TYR 145 -8.262 -5.850 3.102 1026 HA TYR 145 HA TYR 145 -9.736 -5.501 0.642 1027 HB2 TYR 145 HB2 TYR 145 -7.322 -4.017 1.670 1028 HB3 TYR 145 HB3 TYR 145 -8.108 -3.705 0.125 1029 HD1 TYR 145 HD1 TYR 145 -8.684 -3.720 3.777 1030 HD2 TYR 145 HD2 TYR 145 -9.946 -2.259 -0.006 1031 HE1 TYR 145 HE1 TYR 145 -10.253 -2.174 4.902 1032 HE2 TYR 145 HE2 TYR 145 -11.516 -0.716 1.092 1033 HH TYR 145 HH TYR 145 -12.697 -0.493 3.199 1034 H ILE 146 H ILE 146 -7.277 -7.305 1.973 1035 HA ILE 146 HA ILE 146 -5.888 -7.736 -0.522 1036 HB ILE 146 HB ILE 146 -5.219 -9.027 2.112 1037 HG12 ILE 146 HG12 ILE 146 -5.117 -6.637 2.519 1038 HG13 ILE 146 HG13 ILE 146 -3.483 -7.273 2.448 1039 HG21 ILE 146 HG21 ILE 146 -2.942 -9.250 1.168 1040 HG22 ILE 146 HG22 ILE 146 -3.536 -8.586 -0.353 1041 HG23 ILE 146 HG23 ILE 146 -4.162 -10.123 0.241 1042 HD11 ILE 146 HD11 ILE 146 -4.873 -5.740 0.250 1043 HD12 ILE 146 HD12 ILE 146 -3.221 -6.353 0.195 1044 HD13 ILE 146 HD13 ILE 146 -3.658 -5.100 1.356 1045 H ALA 147 H ALA 147 -8.445 -9.032 1.158 1046 HA ALA 147 HA ALA 147 -8.191 -11.766 0.438 1047 HB1 ALA 147 HB1 ALA 147 -10.629 -10.230 1.254 1048 HB2 ALA 147 HB2 ALA 147 -9.523 -11.052 2.355 1049 HB3 ALA 147 HB3 ALA 147 -10.477 -11.984 1.202 1050 H ASN 148 H ASN 148 -9.246 -8.948 -1.136 1051 HA ASN 148 HA ASN 148 -10.598 -10.377 -3.214 1052 HB2 ASN 148 HB2 ASN 148 -10.466 -7.402 -3.094 1053 HB3 ASN 148 HB3 ASN 148 -11.760 -8.423 -3.634 1054 HD21 ASN 148 HD21 ASN 148 -10.194 -7.073 -0.913 1055 HD22 ASN 148 HD22 ASN 148 -11.465 -7.311 0.230 1056 H ALA 149 H ALA 149 -7.698 -9.996 -2.533 1057 HA ALA 149 HA ALA 149 -6.704 -8.659 -4.808 1058 HB1 ALA 149 HB1 ALA 149 -4.612 -9.845 -3.347 1059 HB2 ALA 149 HB2 ALA 149 -5.822 -9.309 -2.177 1060 HB3 ALA 149 HB3 ALA 149 -5.122 -8.154 -3.314 1061 HA PRO 150 HA PRO 150 -5.577 -11.960 -7.576 1062 HB2 PRO 150 HB2 PRO 150 -2.806 -11.877 -7.645 1063 HB3 PRO 150 HB3 PRO 150 -3.887 -10.859 -8.607 1064 HG2 PRO 150 HG2 PRO 150 -2.528 -10.244 -6.033 1065 HG3 PRO 150 HG3 PRO 150 -2.757 -9.213 -7.458 1066 HD2 PRO 150 HD2 PRO 150 -4.293 -8.877 -5.314 1067 HD3 PRO 150 HD3 PRO 150 -4.996 -8.791 -6.942 1068 H VAL 151 H VAL 151 -3.960 -13.893 -7.868 1069 HA VAL 151 HA VAL 151 -4.010 -15.433 -5.407 1070 HB VAL 151 HB VAL 151 -4.190 -16.374 -8.220 1071 HG11 VAL 151 HG11 VAL 151 -4.491 -18.088 -5.783 1072 HG12 VAL 151 HG12 VAL 151 -2.948 -17.894 -6.625 1073 HG13 VAL 151 HG13 VAL 151 -4.337 -18.601 -7.465 1074 HG21 VAL 151 HG21 VAL 151 -6.258 -16.449 -6.041 1075 HG22 VAL 151 HG22 VAL 151 -6.460 -17.043 -7.690 1076 HG23 VAL 151 HG23 VAL 151 -6.244 -15.317 -7.394 1077 H PHE 152 H PHE 152 -2.291 -16.241 -4.666 1078 HA PHE 152 HA PHE 152 0.275 -16.017 -6.057 1079 HB2 PHE 152 HB2 PHE 152 0.230 -14.841 -3.940 1080 HB3 PHE 152 HB3 PHE 152 -0.444 -16.232 -3.109 1081 HD1 PHE 152 HD1 PHE 152 0.976 -18.162 -2.602 1082 HD2 PHE 152 HD2 PHE 152 2.561 -14.630 -4.326 1083 HE1 PHE 152 HE1 PHE 152 3.250 -18.893 -1.992 1084 HE2 PHE 152 HE2 PHE 152 4.839 -15.342 -3.734 1085 HZ PHE 152 HZ PHE 152 5.186 -17.481 -2.565 1086 H ASN 153 H ASN 153 0.389 -17.835 -7.265 1087 HA ASN 153 HA ASN 153 0.886 -19.973 -7.820 1088 HB2 ASN 153 HB2 ASN 153 1.334 -20.099 -4.879 1089 HB3 ASN 153 HB3 ASN 153 1.238 -21.617 -5.767 1090 HD21 ASN 153 HD21 ASN 153 2.907 -18.535 -5.588 1091 HD22 ASN 153 HD22 ASN 153 4.382 -19.079 -6.304 1092 H GLY 154 H GLY 154 -1.579 -19.656 -5.315 1093 HA2 GLY 154 HA2 GLY 154 -3.772 -20.582 -6.436 1094 HA3 GLY 154 HA3 GLY 154 -2.917 -22.102 -6.217 1095 H THR 155 H THR 155 -4.290 -19.332 -4.529 1096 HA THR 155 HA THR 155 -4.096 -20.600 -1.956 1097 HB THR 155 HB THR 155 -5.256 -18.424 -1.276 1098 HG1 THR 155 HG1 THR 155 -5.984 -17.770 -3.315 1099 HG21 THR 155 HG21 THR 155 -2.890 -18.815 -0.878 1100 HG22 THR 155 HG22 THR 155 -3.152 -17.146 -1.387 1101 HG23 THR 155 HG23 THR 155 -2.524 -18.330 -2.535 1102 H THR 156 H THR 156 -5.525 -22.136 -1.703 1103 HA THR 156 HA THR 156 -8.314 -21.792 -2.513 1104 HB THR 156 HB THR 156 -8.525 -24.212 -1.743 1105 HG1 THR 156 HG1 THR 156 -6.202 -25.148 -1.949 1106 HG21 THR 156 HG21 THR 156 -7.482 -25.108 -3.784 1107 HG22 THR 156 HG22 THR 156 -6.624 -23.582 -4.004 1108 HG23 THR 156 HG23 THR 156 -8.384 -23.625 -4.103 1109 HA PRO 157 HA PRO 157 -9.189 -20.903 1.798 1110 HB2 PRO 157 HB2 PRO 157 -11.946 -20.513 1.380 1111 HB3 PRO 157 HB3 PRO 157 -10.698 -19.265 1.433 1112 HG2 PRO 157 HG2 PRO 157 -12.183 -20.033 -0.818 1113 HG3 PRO 157 HG3 PRO 157 -10.743 -19.000 -0.800 1114 HD2 PRO 157 HD2 PRO 157 -10.991 -21.860 -1.513 1115 HD3 PRO 157 HD3 PRO 157 -9.830 -20.645 -2.068 1116 H THR 158 H THR 158 -11.414 -22.933 0.044 1117 HA THR 158 HA THR 158 -11.311 -25.040 1.918 1118 HB THR 158 HB THR 158 -12.859 -23.719 3.195 1119 HG1 THR 158 HG1 THR 158 -13.370 -25.874 3.276 1120 HG21 THR 158 HG21 THR 158 -14.897 -22.791 2.498 1121 HG22 THR 158 HG22 THR 158 -14.872 -23.684 0.978 1122 HG23 THR 158 HG23 THR 158 -13.740 -22.355 1.239 1123 H GLU 159 H GLU 159 -13.736 -23.807 -0.284 1124 HA GLU 159 HA GLU 159 -14.008 -26.298 -1.657 1125 HB2 GLU 159 HB2 GLU 159 -15.323 -23.618 -1.932 1126 HB3 GLU 159 HB3 GLU 159 -15.583 -24.871 -3.136 1127 HG2 GLU 159 HG2 GLU 159 -16.045 -25.437 -0.235 1128 HG3 GLU 159 HG3 GLU 159 -17.267 -24.605 -1.196 Start of MODEL 3 1 H1 MET 1 H1 MET 1 -8.756 -12.602 -36.204 2 H2 MET 1 H2 MET 1 -10.022 -13.713 -36.360 3 H3 MET 1 H3 MET 1 -10.304 -12.067 -36.628 4 HA MET 1 HA MET 1 -8.539 -13.795 -38.261 5 HB2 MET 1 HB2 MET 1 -11.362 -12.833 -38.646 6 HB3 MET 1 HB3 MET 1 -10.351 -13.255 -40.021 7 HG2 MET 1 HG2 MET 1 -10.049 -15.509 -39.064 8 HG3 MET 1 HG3 MET 1 -11.148 -15.071 -37.756 9 HE1 MET 1 HE1 MET 1 -12.489 -17.337 -38.468 10 HE2 MET 1 HE2 MET 1 -11.424 -17.594 -39.849 11 HE3 MET 1 HE3 MET 1 -13.172 -17.584 -40.075 12 H ARG 2 H ARG 2 -9.890 -10.603 -37.637 13 HA ARG 2 HA ARG 2 -8.163 -9.446 -39.723 14 HB2 ARG 2 HB2 ARG 2 -10.667 -8.479 -38.372 15 HB3 ARG 2 HB3 ARG 2 -9.591 -7.350 -39.183 16 HG2 ARG 2 HG2 ARG 2 -9.880 -8.545 -41.277 17 HG3 ARG 2 HG3 ARG 2 -10.919 -9.725 -40.473 18 HD2 ARG 2 HD2 ARG 2 -12.591 -8.098 -40.051 19 HD3 ARG 2 HD3 ARG 2 -11.516 -6.777 -40.507 20 HE ARG 2 HE ARG 2 -12.244 -8.757 -42.537 21 HH11 ARG 2 HH11 ARG 2 -12.534 -5.473 -41.281 22 HH12 ARG 2 HH12 ARG 2 -13.239 -4.839 -42.812 23 HH21 ARG 2 HH21 ARG 2 -13.129 -7.975 -44.477 24 HH22 ARG 2 HH22 ARG 2 -13.569 -6.232 -44.589 25 H GLY 3 H GLY 3 -8.998 -9.208 -36.289 26 HA2 GLY 3 HA2 GLY 3 -7.285 -8.794 -34.653 27 HA3 GLY 3 HA3 GLY 3 -6.443 -7.812 -35.841 28 H SER 4 H SER 4 -9.789 -7.829 -34.607 29 HA SER 4 HA SER 4 -9.435 -5.004 -33.841 30 HB2 SER 4 HB2 SER 4 -10.868 -5.321 -35.879 31 HB3 SER 4 HB3 SER 4 -11.995 -6.240 -34.884 32 HG SER 4 HG SER 4 -11.355 -3.845 -33.762 33 H HIS 5 H HIS 5 -10.114 -4.411 -31.854 34 HA HIS 5 HA HIS 5 -11.257 -6.516 -30.146 35 HB2 HIS 5 HB2 HIS 5 -10.302 -5.164 -28.236 36 HB3 HIS 5 HB3 HIS 5 -9.116 -5.900 -29.302 37 HD1 HIS 5 HD1 HIS 5 -7.678 -4.302 -30.760 38 HD2 HIS 5 HD2 HIS 5 -10.331 -2.364 -28.214 39 HE1 HIS 5 HE1 HIS 5 -6.960 -1.892 -30.748 40 HE2 HIS 5 HE2 HIS 5 -8.579 -0.737 -29.201 41 H HIS 6 H HIS 6 -13.122 -6.226 -29.096 42 HA HIS 6 HA HIS 6 -14.394 -3.572 -29.210 43 HB2 HIS 6 HB2 HIS 6 -15.602 -6.279 -29.752 44 HB3 HIS 6 HB3 HIS 6 -16.593 -4.889 -29.324 45 HD1 HIS 6 HD1 HIS 6 -17.025 -3.154 -31.126 46 HD2 HIS 6 HD2 HIS 6 -14.333 -6.097 -32.297 47 HE1 HIS 6 HE1 HIS 6 -16.710 -2.832 -33.600 48 HE2 HIS 6 HE2 HIS 6 -15.076 -4.623 -34.288 49 H HIS 7 H HIS 7 -14.213 -6.670 -27.479 50 HA HIS 7 HA HIS 7 -15.026 -5.258 -25.024 51 HB2 HIS 7 HB2 HIS 7 -15.860 -7.996 -25.972 52 HB3 HIS 7 HB3 HIS 7 -16.009 -7.491 -24.292 53 HD1 HIS 7 HD1 HIS 7 -17.572 -5.301 -23.923 54 HD2 HIS 7 HD2 HIS 7 -17.962 -7.292 -27.550 55 HE1 HIS 7 HE1 HIS 7 -19.766 -4.530 -24.880 56 HE2 HIS 7 HE2 HIS 7 -19.982 -5.747 -27.076 57 H HIS 8 H HIS 8 -14.061 -5.882 -23.106 58 HA HIS 8 HA HIS 8 -11.756 -7.704 -23.306 59 HB2 HIS 8 HB2 HIS 8 -11.885 -4.963 -22.058 60 HB3 HIS 8 HB3 HIS 8 -10.652 -6.134 -21.605 61 HD1 HIS 8 HD1 HIS 8 -11.867 -4.231 -24.648 62 HD2 HIS 8 HD2 HIS 8 -8.488 -6.216 -23.266 63 HE1 HIS 8 HE1 HIS 8 -10.070 -3.762 -26.344 64 HE2 HIS 8 HE2 HIS 8 -8.033 -4.971 -25.487 65 H HIS 9 H HIS 9 -11.559 -9.161 -21.706 66 HA HIS 9 HA HIS 9 -13.459 -8.981 -19.466 67 HB2 HIS 9 HB2 HIS 9 -13.173 -11.507 -19.337 68 HB3 HIS 9 HB3 HIS 9 -14.046 -10.893 -20.733 69 HD1 HIS 9 HD1 HIS 9 -13.097 -11.417 -23.024 70 HD2 HIS 9 HD2 HIS 9 -10.551 -12.514 -19.929 71 HE1 HIS 9 HE1 HIS 9 -11.274 -12.772 -24.102 72 HE2 HIS 9 HE2 HIS 9 -9.742 -13.425 -22.210 73 H HIS 10 H HIS 10 -12.647 -8.599 -17.547 74 HA HIS 10 HA HIS 10 -9.780 -8.957 -17.059 75 HB2 HIS 10 HB2 HIS 10 -11.956 -7.412 -15.652 76 HB3 HIS 10 HB3 HIS 10 -10.381 -7.676 -14.909 77 HD1 HIS 10 HD1 HIS 10 -11.920 -6.053 -17.964 78 HD2 HIS 10 HD2 HIS 10 -8.418 -5.954 -15.727 79 HE1 HIS 10 HE1 HIS 10 -10.579 -4.142 -18.899 80 HE2 HIS 10 HE2 HIS 10 -8.463 -4.099 -17.530 81 H GLY 11 H GLY 11 -8.955 -10.148 -15.336 82 HA2 GLY 11 HA2 GLY 11 -10.065 -11.314 -13.186 83 HA3 GLY 11 HA3 GLY 11 -10.612 -12.374 -14.475 84 H SER 12 H SER 12 -7.520 -10.832 -14.770 85 HA SER 12 HA SER 12 -6.181 -13.429 -14.575 86 HB2 SER 12 HB2 SER 12 -5.643 -10.877 -15.954 87 HB3 SER 12 HB3 SER 12 -4.224 -11.683 -15.268 88 HG SER 12 HG SER 12 -5.705 -13.522 -16.488 89 H ALA 13 H ALA 13 -3.963 -13.441 -13.631 90 HA ALA 13 HA ALA 13 -3.292 -11.473 -11.732 91 HB1 ALA 13 HB1 ALA 13 -4.287 -14.142 -10.797 92 HB2 ALA 13 HB2 ALA 13 -4.741 -12.536 -10.223 93 HB3 ALA 13 HB3 ALA 13 -3.156 -13.202 -9.828 94 H THR 14 H THR 14 -1.260 -11.212 -12.392 95 HA THR 14 HA THR 14 0.399 -13.498 -12.968 96 HB THR 14 HB THR 14 0.298 -11.728 -14.646 97 HG1 THR 14 HG1 THR 14 2.897 -11.726 -13.502 98 HG21 THR 14 HG21 THR 14 1.601 -9.957 -12.572 99 HG22 THR 14 HG22 THR 14 -0.015 -9.758 -13.248 100 HG23 THR 14 HG23 THR 14 1.402 -9.556 -14.278 101 H TYR 15 H TYR 15 0.011 -11.023 -10.586 102 HA TYR 15 HA TYR 15 2.536 -11.581 -9.355 103 HB2 TYR 15 HB2 TYR 15 0.764 -9.315 -9.457 104 HB3 TYR 15 HB3 TYR 15 1.382 -9.638 -7.848 105 HD1 TYR 15 HD1 TYR 15 3.955 -9.889 -7.631 106 HD2 TYR 15 HD2 TYR 15 2.042 -8.127 -10.997 107 HE1 TYR 15 HE1 TYR 15 6.063 -8.774 -8.237 108 HE2 TYR 15 HE2 TYR 15 4.143 -7.010 -11.614 109 HH TYR 15 HH TYR 15 7.127 -7.835 -10.263 110 H THR 16 H THR 16 2.811 -12.429 -7.469 111 HA THR 16 HA THR 16 0.517 -13.788 -6.358 112 HB THR 16 HB THR 16 2.190 -15.131 -5.075 113 HG1 THR 16 HG1 THR 16 4.059 -13.734 -6.711 114 HG21 THR 16 HG21 THR 16 2.453 -15.073 -8.078 115 HG22 THR 16 HG22 THR 16 1.332 -16.045 -7.124 116 HG23 THR 16 HG23 THR 16 3.064 -16.372 -7.052 117 H ARG 17 H ARG 17 0.689 -14.177 -3.873 118 HA ARG 17 HA ARG 17 0.547 -11.654 -2.575 119 HB2 ARG 17 HB2 ARG 17 -0.731 -14.115 -2.346 120 HB3 ARG 17 HB3 ARG 17 0.209 -13.975 -0.870 121 HG2 ARG 17 HG2 ARG 17 -1.238 -12.523 0.003 122 HG3 ARG 17 HG3 ARG 17 -1.244 -11.531 -1.455 123 HD2 ARG 17 HD2 ARG 17 -3.471 -12.439 -0.930 124 HD3 ARG 17 HD3 ARG 17 -2.870 -12.987 -2.490 125 HE ARG 17 HE ARG 17 -2.226 -15.091 -1.239 126 HH11 ARG 17 HH11 ARG 17 -4.966 -13.096 -0.249 127 HH12 ARG 17 HH12 ARG 17 -5.833 -14.483 0.504 128 HH21 ARG 17 HH21 ARG 17 -4.915 -16.567 0.472 129 HH22 ARG 17 HH22 ARG 17 -3.314 -16.848 -0.306 130 HA PRO 18 HA PRO 18 4.833 -12.127 -0.994 131 HB2 PRO 18 HB2 PRO 18 4.235 -9.571 0.338 132 HB3 PRO 18 HB3 PRO 18 5.540 -9.965 -0.792 133 HG2 PRO 18 HG2 PRO 18 3.503 -8.392 -1.517 134 HG3 PRO 18 HG3 PRO 18 4.262 -9.525 -2.654 135 HD2 PRO 18 HD2 PRO 18 1.669 -9.781 -1.191 136 HD3 PRO 18 HD3 PRO 18 2.083 -10.249 -2.855 137 H LEU 19 H LEU 19 1.909 -11.421 0.761 138 HA LEU 19 HA LEU 19 2.965 -12.682 3.157 139 HB2 LEU 19 HB2 LEU 19 2.156 -9.993 2.942 140 HB3 LEU 19 HB3 LEU 19 0.951 -10.816 3.867 141 HG LEU 19 HG LEU 19 2.661 -9.624 5.205 142 HD11 LEU 19 HD11 LEU 19 2.315 -12.603 5.530 143 HD12 LEU 19 HD12 LEU 19 1.442 -11.293 6.342 144 HD13 LEU 19 HD13 LEU 19 3.138 -11.603 6.731 145 HD21 LEU 19 HD21 LEU 19 4.557 -11.833 4.451 146 HD22 LEU 19 HD22 LEU 19 4.886 -10.374 5.385 147 HD23 LEU 19 HD23 LEU 19 4.573 -10.260 3.653 148 H ASP 20 H ASP 20 0.925 -12.679 4.628 149 HA ASP 20 HA ASP 20 -1.323 -13.843 3.244 150 HB2 ASP 20 HB2 ASP 20 0.431 -15.143 5.038 151 HB3 ASP 20 HB3 ASP 20 -1.149 -14.997 5.793 152 H THR 21 H THR 21 0.017 -11.919 5.669 153 HA THR 21 HA THR 21 -2.294 -10.472 6.202 154 HB THR 21 HB THR 21 -2.818 -12.567 7.458 155 HG1 THR 21 HG1 THR 21 -2.993 -11.083 9.580 156 HG21 THR 21 HG21 THR 21 -0.565 -11.680 9.268 157 HG22 THR 21 HG22 THR 21 -0.634 -13.169 8.326 158 HG23 THR 21 HG23 THR 21 -1.753 -12.921 9.667 159 H GLY 22 H GLY 22 -1.798 -9.405 8.575 160 HA2 GLY 22 HA2 GLY 22 0.808 -8.811 9.364 161 HA3 GLY 22 HA3 GLY 22 0.260 -7.552 8.261 162 H ASN 23 H ASN 23 0.351 -8.533 11.468 163 HA ASN 23 HA ASN 23 -1.367 -6.402 12.317 164 HB2 ASN 23 HB2 ASN 23 -2.620 -7.970 13.912 165 HB3 ASN 23 HB3 ASN 23 -3.108 -7.985 12.224 166 HD21 ASN 23 HD21 ASN 23 -2.180 -9.684 10.870 167 HD22 ASN 23 HD22 ASN 23 -1.862 -11.231 11.565 168 H ILE 24 H ILE 24 -0.594 -5.356 13.851 169 HA ILE 24 HA ILE 24 1.417 -6.606 15.559 170 HB ILE 24 HB ILE 24 1.057 -3.737 15.791 171 HG12 ILE 24 HG12 ILE 24 2.651 -3.422 13.745 172 HG13 ILE 24 HG13 ILE 24 2.001 -4.970 13.232 173 HG21 ILE 24 HG21 ILE 24 2.790 -4.740 17.046 174 HG22 ILE 24 HG22 ILE 24 3.560 -3.792 15.774 175 HG23 ILE 24 HG23 ILE 24 3.433 -5.540 15.617 176 HD11 ILE 24 HD11 ILE 24 -0.294 -3.764 13.706 177 HD12 ILE 24 HD12 ILE 24 0.553 -3.603 12.161 178 HD13 ILE 24 HD13 ILE 24 0.684 -2.328 13.375 179 H THR 25 H THR 25 -0.753 -7.466 16.205 180 HA THR 25 HA THR 25 -1.946 -5.936 18.405 181 HB THR 25 HB THR 25 -3.564 -6.771 16.837 182 HG1 THR 25 HG1 THR 25 -4.019 -6.920 19.162 183 HG21 THR 25 HG21 THR 25 -2.179 -8.685 15.985 184 HG22 THR 25 HG22 THR 25 -3.886 -9.052 16.231 185 HG23 THR 25 HG23 THR 25 -2.688 -9.597 17.406 186 H THR 26 H THR 26 -0.067 -8.740 17.698 187 HA THR 26 HA THR 26 0.009 -9.466 20.551 188 HB THR 26 HB THR 26 0.750 -11.401 18.374 189 HG1 THR 26 HG1 THR 26 -1.790 -10.534 19.111 190 HG21 THR 26 HG21 THR 26 1.379 -12.004 20.652 191 HG22 THR 26 HG22 THR 26 0.106 -13.072 20.065 192 HG23 THR 26 HG23 THR 26 -0.284 -11.772 21.192 193 H GLY 27 H GLY 27 2.000 -9.984 17.715 194 HA2 GLY 27 HA2 GLY 27 4.237 -8.484 18.672 195 HA3 GLY 27 HA3 GLY 27 4.484 -10.211 18.897 196 H PHE 28 H PHE 28 5.228 -7.757 16.900 197 HA PHE 28 HA PHE 28 4.712 -8.923 14.370 198 HB2 PHE 28 HB2 PHE 28 5.357 -6.386 15.200 199 HB3 PHE 28 HB3 PHE 28 6.801 -6.910 14.339 200 HD1 PHE 28 HD1 PHE 28 3.072 -6.990 13.916 201 HD2 PHE 28 HD2 PHE 28 6.875 -6.567 12.077 202 HE1 PHE 28 HE1 PHE 28 1.980 -6.600 11.747 203 HE2 PHE 28 HE2 PHE 28 5.797 -6.162 9.912 204 HZ PHE 28 HZ PHE 28 3.343 -6.189 9.749 205 H ASN 29 H ASN 29 6.195 -9.409 12.753 206 HA ASN 29 HA ASN 29 7.728 -11.579 13.340 207 HB2 ASN 29 HB2 ASN 29 7.400 -9.850 10.954 208 HB3 ASN 29 HB3 ASN 29 8.478 -11.224 10.905 209 HD21 ASN 29 HD21 ASN 29 5.306 -10.123 10.784 210 HD22 ASN 29 HD22 ASN 29 4.523 -11.641 10.585 211 H GLY 30 H GLY 30 8.779 -9.321 14.791 212 HA2 GLY 30 HA2 GLY 30 11.055 -9.269 15.611 213 HA3 GLY 30 HA3 GLY 30 11.604 -9.621 13.977 214 H TYR 31 H TYR 31 9.166 -7.569 13.559 215 HA TYR 31 HA TYR 31 10.951 -5.204 13.497 216 HB2 TYR 31 HB2 TYR 31 8.243 -5.336 12.173 217 HB3 TYR 31 HB3 TYR 31 9.577 -4.265 11.813 218 HD1 TYR 31 HD1 TYR 31 11.110 -4.783 10.122 219 HD2 TYR 31 HD2 TYR 31 8.503 -7.835 11.545 220 HE1 TYR 31 HE1 TYR 31 11.818 -6.248 8.282 221 HE2 TYR 31 HE2 TYR 31 9.211 -9.301 9.705 222 HH TYR 31 HH TYR 31 10.180 -9.053 7.420 223 HA PRO 32 HA PRO 32 8.159 -4.326 17.104 224 HB2 PRO 32 HB2 PRO 32 10.404 -3.045 18.402 225 HB3 PRO 32 HB3 PRO 32 9.560 -4.524 18.872 226 HG2 PRO 32 HG2 PRO 32 12.133 -4.496 17.976 227 HG3 PRO 32 HG3 PRO 32 11.042 -5.886 17.802 228 HD2 PRO 32 HD2 PRO 32 11.788 -3.810 15.780 229 HD3 PRO 32 HD3 PRO 32 11.597 -5.566 15.583 230 H GLY 33 H GLY 33 7.011 -2.513 17.465 231 HA2 GLY 33 HA2 GLY 33 6.635 -0.193 17.722 232 HA3 GLY 33 HA3 GLY 33 8.180 0.124 16.951 233 H HIS 34 H HIS 34 6.557 -2.122 15.146 234 HA HIS 34 HA HIS 34 6.047 -0.339 13.015 235 HB2 HIS 34 HB2 HIS 34 6.959 -2.795 12.998 236 HB3 HIS 34 HB3 HIS 34 5.258 -3.235 13.035 237 HD1 HIS 34 HD1 HIS 34 4.571 -3.862 10.736 238 HD2 HIS 34 HD2 HIS 34 7.187 -0.653 10.728 239 HE1 HIS 34 HE1 HIS 34 4.794 -3.117 8.333 240 H VAL 35 H VAL 35 4.115 0.375 12.290 241 HA VAL 35 HA VAL 35 1.742 -0.290 13.892 242 HB VAL 35 HB VAL 35 1.041 1.921 12.397 243 HG11 VAL 35 HG11 VAL 35 1.762 1.421 15.223 244 HG12 VAL 35 HG12 VAL 35 0.261 2.056 14.533 245 HG13 VAL 35 HG13 VAL 35 1.668 3.104 14.712 246 HG21 VAL 35 HG21 VAL 35 3.318 2.337 11.680 247 HG22 VAL 35 HG22 VAL 35 3.867 2.334 13.356 248 HG23 VAL 35 HG23 VAL 35 2.787 3.606 12.785 249 H GLY 36 H GLY 36 3.127 -0.747 10.842 250 HA2 GLY 36 HA2 GLY 36 0.499 -1.480 9.719 251 HA3 GLY 36 HA3 GLY 36 1.757 -0.727 8.748 252 H VAL 37 H VAL 37 1.843 -2.420 7.327 253 HA VAL 37 HA VAL 37 3.231 -4.792 8.329 254 HB VAL 37 HB VAL 37 0.887 -5.401 7.902 255 HG11 VAL 37 HG11 VAL 37 1.436 -4.278 5.201 256 HG12 VAL 37 HG12 VAL 37 0.032 -4.063 6.245 257 HG13 VAL 37 HG13 VAL 37 0.269 -5.585 5.384 258 HG21 VAL 37 HG21 VAL 37 2.979 -6.642 6.142 259 HG22 VAL 37 HG22 VAL 37 1.341 -7.290 6.248 260 HG23 VAL 37 HG23 VAL 37 2.357 -7.214 7.690 261 H ASP 38 H ASP 38 4.681 -5.814 6.808 262 HA ASP 38 HA ASP 38 5.459 -4.096 4.550 263 HB2 ASP 38 HB2 ASP 38 7.249 -5.212 6.714 264 HB3 ASP 38 HB3 ASP 38 7.872 -4.595 5.188 265 H TYR 39 H TYR 39 5.892 -5.014 2.727 266 HA TYR 39 HA TYR 39 6.131 -7.950 2.580 267 HB2 TYR 39 HB2 TYR 39 4.913 -6.315 0.373 268 HB3 TYR 39 HB3 TYR 39 4.785 -8.028 0.658 269 HD1 TYR 39 HD1 TYR 39 2.842 -8.895 1.724 270 HD2 TYR 39 HD2 TYR 39 3.731 -4.753 1.996 271 HE1 TYR 39 HE1 TYR 39 0.623 -8.491 2.686 272 HE2 TYR 39 HE2 TYR 39 1.521 -4.339 2.964 273 HH TYR 39 HH TYR 39 -0.475 -6.789 4.130 274 H ALA 40 H ALA 40 8.182 -8.309 2.080 275 HA ALA 40 HA ALA 40 9.986 -6.645 0.812 276 HB1 ALA 40 HB1 ALA 40 11.408 -8.630 0.546 277 HB2 ALA 40 HB2 ALA 40 10.033 -9.650 0.969 278 HB3 ALA 40 HB3 ALA 40 10.695 -8.525 2.155 279 H VAL 41 H VAL 41 9.652 -5.758 -1.117 280 HA VAL 41 HA VAL 41 9.474 -7.468 -3.440 281 HB VAL 41 HB VAL 41 7.113 -6.938 -2.908 282 HG11 VAL 41 HG11 VAL 41 7.240 -4.791 -1.875 283 HG12 VAL 41 HG12 VAL 41 6.250 -4.644 -3.327 284 HG13 VAL 41 HG13 VAL 41 7.917 -4.068 -3.332 285 HG21 VAL 41 HG21 VAL 41 7.662 -7.409 -5.191 286 HG22 VAL 41 HG22 VAL 41 8.157 -5.738 -5.465 287 HG23 VAL 41 HG23 VAL 41 6.464 -6.114 -5.152 288 HA PRO 42 HA PRO 42 12.848 -4.710 -4.636 289 HB2 PRO 42 HB2 PRO 42 11.918 -5.500 -7.362 290 HB3 PRO 42 HB3 PRO 42 13.552 -5.501 -6.685 291 HG2 PRO 42 HG2 PRO 42 12.225 -7.776 -6.970 292 HG3 PRO 42 HG3 PRO 42 13.245 -7.484 -5.548 293 HD2 PRO 42 HD2 PRO 42 10.280 -7.487 -5.766 294 HD3 PRO 42 HD3 PRO 42 11.321 -7.941 -4.402 295 H VAL 43 H VAL 43 13.157 -2.848 -5.165 296 HA VAL 43 HA VAL 43 11.241 -0.876 -5.364 297 HB VAL 43 HB VAL 43 13.331 -0.469 -4.358 298 HG11 VAL 43 HG11 VAL 43 15.471 -0.380 -5.682 299 HG12 VAL 43 HG12 VAL 43 14.608 -1.260 -6.945 300 HG13 VAL 43 HG13 VAL 43 14.805 -1.976 -5.344 301 HG21 VAL 43 HG21 VAL 43 12.270 1.392 -5.871 302 HG22 VAL 43 HG22 VAL 43 13.721 1.157 -6.836 303 HG23 VAL 43 HG23 VAL 43 13.860 1.649 -5.148 304 H GLY 44 H GLY 44 10.426 0.368 -6.985 305 HA2 GLY 44 HA2 GLY 44 10.540 1.369 -9.140 306 HA3 GLY 44 HA3 GLY 44 11.490 0.001 -9.658 307 H THR 45 H THR 45 8.989 -1.249 -7.903 308 HA THR 45 HA THR 45 7.571 -1.999 -10.273 309 HB THR 45 HB THR 45 6.824 -2.891 -7.510 310 HG1 THR 45 HG1 THR 45 8.375 -4.605 -7.823 311 HG21 THR 45 HG21 THR 45 5.356 -3.577 -9.349 312 HG22 THR 45 HG22 THR 45 6.205 -4.970 -8.681 313 HG23 THR 45 HG23 THR 45 6.736 -4.262 -10.207 314 HA PRO 46 HA PRO 46 4.609 1.373 -9.776 315 HB2 PRO 46 HB2 PRO 46 2.812 -0.416 -11.333 316 HB3 PRO 46 HB3 PRO 46 3.255 1.271 -11.631 317 HG2 PRO 46 HG2 PRO 46 4.277 -0.674 -13.122 318 HG3 PRO 46 HG3 PRO 46 5.256 0.725 -12.639 319 HD2 PRO 46 HD2 PRO 46 5.299 -2.061 -11.579 320 HD3 PRO 46 HD3 PRO 46 6.635 -0.919 -11.827 321 H VAL 47 H VAL 47 3.384 1.728 -8.080 322 HA VAL 47 HA VAL 47 1.932 -0.391 -6.802 323 HB VAL 47 HB VAL 47 2.363 2.341 -5.629 324 HG11 VAL 47 HG11 VAL 47 0.674 0.912 -4.564 325 HG12 VAL 47 HG12 VAL 47 2.038 1.220 -3.489 326 HG13 VAL 47 HG13 VAL 47 1.895 -0.335 -4.310 327 HG21 VAL 47 HG21 VAL 47 4.283 0.053 -5.705 328 HG22 VAL 47 HG22 VAL 47 4.231 1.109 -4.298 329 HG23 VAL 47 HG23 VAL 47 4.591 1.780 -5.888 330 H ARG 48 H ARG 48 -0.033 -0.561 -7.062 331 HA ARG 48 HA ARG 48 -1.553 1.645 -8.059 332 HB2 ARG 48 HB2 ARG 48 -2.137 -1.303 -8.176 333 HB3 ARG 48 HB3 ARG 48 -3.275 -0.074 -8.710 334 HG2 ARG 48 HG2 ARG 48 -2.362 -0.272 -10.724 335 HG3 ARG 48 HG3 ARG 48 -0.942 0.548 -10.067 336 HD2 ARG 48 HD2 ARG 48 0.029 -1.614 -9.467 337 HD3 ARG 48 HD3 ARG 48 -1.398 -2.435 -10.101 338 HE ARG 48 HE ARG 48 -0.411 -0.869 -12.158 339 HH11 ARG 48 HH11 ARG 48 1.782 -4.221 -11.561 340 HH12 ARG 48 HH12 ARG 48 0.738 -3.596 -10.233 341 HH21 ARG 48 HH21 ARG 48 1.872 -3.137 -13.561 342 HH22 ARG 48 HH22 ARG 48 0.902 -1.644 -13.836 343 H ALA 49 H ALA 49 -3.647 2.094 -7.349 344 HA ALA 49 HA ALA 49 -3.799 2.139 -4.536 345 HB1 ALA 49 HB1 ALA 49 -5.920 3.356 -4.889 346 HB2 ALA 49 HB2 ALA 49 -5.796 3.014 -6.615 347 HB3 ALA 49 HB3 ALA 49 -4.583 4.022 -5.825 348 H VAL 50 H VAL 50 -4.597 0.633 -3.254 349 HA VAL 50 HA VAL 50 -5.900 -1.663 -4.168 350 HB VAL 50 HB VAL 50 -5.772 -0.730 -1.352 351 HG11 VAL 50 HG11 VAL 50 -6.194 -3.479 -2.490 352 HG12 VAL 50 HG12 VAL 50 -7.318 -2.553 -1.493 353 HG13 VAL 50 HG13 VAL 50 -5.815 -3.161 -0.798 354 HG21 VAL 50 HG21 VAL 50 -3.735 -2.023 -1.117 355 HG22 VAL 50 HG22 VAL 50 -3.551 -0.801 -2.373 356 HG23 VAL 50 HG23 VAL 50 -3.825 -2.483 -2.816 357 H ALA 51 H ALA 51 -7.229 1.364 -3.466 358 HA ALA 51 HA ALA 51 -9.819 0.652 -4.221 359 HB1 ALA 51 HB1 ALA 51 -9.330 1.026 -1.296 360 HB2 ALA 51 HB2 ALA 51 -10.267 -0.231 -2.105 361 HB3 ALA 51 HB3 ALA 51 -10.892 1.418 -2.014 362 H ASN 52 H ASN 52 -11.038 2.393 -4.720 363 HA ASN 52 HA ASN 52 -9.808 4.798 -5.257 364 HB2 ASN 52 HB2 ASN 52 -12.230 5.546 -5.670 365 HB3 ASN 52 HB3 ASN 52 -11.589 4.265 -6.635 366 HD21 ASN 52 HD21 ASN 52 -12.709 3.958 -3.370 367 HD22 ASN 52 HD22 ASN 52 -14.062 2.946 -3.716 368 H GLY 53 H GLY 53 -10.366 6.941 -4.530 369 HA2 GLY 53 HA2 GLY 53 -11.866 7.669 -2.349 370 HA3 GLY 53 HA3 GLY 53 -10.341 7.133 -1.671 371 H THR 54 H THR 54 -9.138 8.800 -1.136 372 HA THR 54 HA THR 54 -8.641 10.951 -2.929 373 HB THR 54 HB THR 54 -9.515 11.458 -0.148 374 HG1 THR 54 HG1 THR 54 -11.517 12.015 -0.934 375 HG21 THR 54 HG21 THR 54 -9.642 13.805 -0.771 376 HG22 THR 54 HG22 THR 54 -9.231 13.404 -2.438 377 HG23 THR 54 HG23 THR 54 -8.036 13.187 -1.159 378 H VAL 55 H VAL 55 -6.625 11.800 -2.639 379 HA VAL 55 HA VAL 55 -4.777 10.367 -1.005 380 HB VAL 55 HB VAL 55 -4.168 12.739 -2.765 381 HG11 VAL 55 HG11 VAL 55 -2.350 12.089 -1.296 382 HG12 VAL 55 HG12 VAL 55 -1.945 11.735 -2.976 383 HG13 VAL 55 HG13 VAL 55 -2.440 10.431 -1.894 384 HG21 VAL 55 HG21 VAL 55 -5.371 11.084 -4.118 385 HG22 VAL 55 HG22 VAL 55 -4.201 9.853 -3.641 386 HG23 VAL 55 HG23 VAL 55 -3.686 11.231 -4.613 387 H LYS 56 H LYS 56 -4.620 10.962 0.990 388 HA LYS 56 HA LYS 56 -5.061 13.661 1.905 389 HB2 LYS 56 HB2 LYS 56 -4.346 11.558 3.876 390 HB3 LYS 56 HB3 LYS 56 -5.488 12.876 4.027 391 HG2 LYS 56 HG2 LYS 56 -5.893 10.204 2.721 392 HG3 LYS 56 HG3 LYS 56 -6.738 10.880 4.105 393 HD2 LYS 56 HD2 LYS 56 -6.900 12.315 1.509 394 HD3 LYS 56 HD3 LYS 56 -7.825 10.824 1.686 395 HE2 LYS 56 HE2 LYS 56 -8.870 11.768 3.736 396 HE3 LYS 56 HE3 LYS 56 -8.018 13.282 3.431 397 HZ1 LYS 56 HZ1 LYS 56 -10.027 12.015 1.648 398 HZ2 LYS 56 HZ2 LYS 56 -9.181 13.437 1.300 399 HZ3 LYS 56 HZ3 LYS 56 -10.265 13.396 2.597 400 H PHE 57 H PHE 57 -2.558 11.614 1.125 401 HA PHE 57 HA PHE 57 -0.566 13.513 1.874 402 HB2 PHE 57 HB2 PHE 57 -0.885 11.787 3.835 403 HB3 PHE 57 HB3 PHE 57 -0.009 10.703 2.758 404 HD1 PHE 57 HD1 PHE 57 2.309 11.188 2.115 405 HD2 PHE 57 HD2 PHE 57 0.230 13.571 4.964 406 HE1 PHE 57 HE1 PHE 57 4.443 12.156 2.856 407 HE2 PHE 57 HE2 PHE 57 2.363 14.541 5.713 408 HZ PHE 57 HZ PHE 57 4.474 13.836 4.657 409 H ALA 58 H ALA 58 1.166 13.426 0.624 410 HA ALA 58 HA ALA 58 1.664 11.294 -1.203 411 HB1 ALA 58 HB1 ALA 58 1.723 12.803 -3.175 412 HB2 ALA 58 HB2 ALA 58 1.019 14.077 -2.177 413 HB3 ALA 58 HB3 ALA 58 0.105 12.606 -2.506 414 H GLY 59 H GLY 59 3.509 10.994 -0.153 415 HA2 GLY 59 HA2 GLY 59 5.453 13.143 0.122 416 HA3 GLY 59 HA3 GLY 59 5.570 11.534 0.817 417 H ASN 60 H ASN 60 6.053 13.489 -2.009 418 HA ASN 60 HA ASN 60 7.043 11.484 -3.741 419 HB2 ASN 60 HB2 ASN 60 7.201 14.492 -3.805 420 HB3 ASN 60 HB3 ASN 60 7.883 13.475 -5.069 421 HD21 ASN 60 HD21 ASN 60 4.914 13.150 -3.211 422 HD22 ASN 60 HD22 ASN 60 3.870 13.177 -4.566 423 H GLY 61 H GLY 61 8.840 10.615 -3.882 424 HA2 GLY 61 HA2 GLY 61 11.046 11.204 -2.113 425 HA3 GLY 61 HA3 GLY 61 10.949 9.871 -3.250 426 H ALA 62 H ALA 62 10.183 12.523 -4.991 427 HA ALA 62 HA ALA 62 12.703 12.594 -6.297 428 HB1 ALA 62 HB1 ALA 62 10.576 12.631 -7.524 429 HB2 ALA 62 HB2 ALA 62 11.624 13.990 -7.934 430 HB3 ALA 62 HB3 ALA 62 10.256 14.229 -6.847 431 H ASN 63 H ASN 63 11.001 14.656 -4.104 432 HA ASN 63 HA ASN 63 13.247 16.463 -4.033 433 HB2 ASN 63 HB2 ASN 63 10.866 17.139 -5.266 434 HB3 ASN 63 HB3 ASN 63 10.833 17.936 -3.706 435 HD21 ASN 63 HD21 ASN 63 11.992 17.950 -6.835 436 HD22 ASN 63 HD22 ASN 63 13.065 19.290 -6.707 437 H HIS 64 H HIS 64 12.100 14.350 -2.218 438 HA HIS 64 HA HIS 64 11.014 15.756 -0.065 439 HB2 HIS 64 HB2 HIS 64 11.028 13.604 1.091 440 HB3 HIS 64 HB3 HIS 64 10.234 13.529 -0.452 441 HD1 HIS 64 HD1 HIS 64 13.615 13.362 -1.400 442 HD2 HIS 64 HD2 HIS 64 11.072 10.702 0.529 443 HE1 HIS 64 HE1 HIS 64 14.685 11.101 -1.659 444 HE2 HIS 64 HE2 HIS 64 13.132 9.507 -0.479 445 HA PRO 65 HA PRO 65 15.041 16.880 1.756 446 HB2 PRO 65 HB2 PRO 65 13.245 17.991 3.844 447 HB3 PRO 65 HB3 PRO 65 14.529 18.808 2.927 448 HG2 PRO 65 HG2 PRO 65 12.030 19.363 2.406 449 HG3 PRO 65 HG3 PRO 65 13.170 19.105 1.063 450 HD2 PRO 65 HD2 PRO 65 11.219 17.150 2.259 451 HD3 PRO 65 HD3 PRO 65 11.479 17.608 0.575 452 H TRP 66 H TRP 66 16.074 16.431 3.744 453 HA TRP 66 HA TRP 66 14.892 14.185 5.144 454 HB2 TRP 66 HB2 TRP 66 17.729 15.202 5.207 455 HB3 TRP 66 HB3 TRP 66 17.110 13.847 6.141 456 HD1 TRP 66 HD1 TRP 66 17.593 14.834 2.421 457 HE1 TRP 66 HE1 TRP 66 18.002 12.681 1.071 458 HE3 TRP 66 HE3 TRP 66 16.978 11.381 6.159 459 HZ2 TRP 66 HZ2 TRP 66 18.057 9.898 1.524 460 HZ3 TRP 66 HZ3 TRP 66 17.224 8.996 5.608 461 HH2 TRP 66 HH2 TRP 66 17.752 8.273 3.338 462 H MET 67 H MET 67 14.574 17.276 5.280 463 HA MET 67 HA MET 67 15.309 17.942 7.938 464 HB2 MET 67 HB2 MET 67 13.736 19.317 5.798 465 HB3 MET 67 HB3 MET 67 13.712 19.945 7.438 466 HG2 MET 67 HG2 MET 67 16.233 19.491 5.864 467 HG3 MET 67 HG3 MET 67 15.361 21.022 5.904 468 HE1 MET 67 HE1 MET 67 17.411 22.340 6.693 469 HE2 MET 67 HE2 MET 67 18.456 20.921 6.733 470 HE3 MET 67 HE3 MET 67 18.363 21.986 8.135 471 H LEU 68 H LEU 68 12.329 17.127 6.261 472 HA LEU 68 HA LEU 68 11.203 16.540 8.903 473 HB2 LEU 68 HB2 LEU 68 8.990 17.145 8.139 474 HB3 LEU 68 HB3 LEU 68 10.085 18.489 7.945 475 HG LEU 68 HG LEU 68 10.196 17.472 5.453 476 HD11 LEU 68 HD11 LEU 68 7.923 16.829 4.773 477 HD12 LEU 68 HD12 LEU 68 7.398 16.870 6.456 478 HD13 LEU 68 HD13 LEU 68 8.593 15.682 5.933 479 HD21 LEU 68 HD21 LEU 68 9.737 19.782 6.027 480 HD22 LEU 68 HD22 LEU 68 8.112 19.355 6.565 481 HD23 LEU 68 HD23 LEU 68 8.546 19.202 4.863 482 H TRP 69 H TRP 69 12.684 15.005 6.568 483 HA TRP 69 HA TRP 69 10.760 12.787 6.621 484 HB2 TRP 69 HB2 TRP 69 12.530 13.185 4.229 485 HB3 TRP 69 HB3 TRP 69 11.064 12.225 4.362 486 HD1 TRP 69 HD1 TRP 69 11.829 16.024 4.779 487 HE1 TRP 69 HE1 TRP 69 10.045 17.350 3.528 488 HE3 TRP 69 HE3 TRP 69 9.089 12.132 2.916 489 HZ2 TRP 69 HZ2 TRP 69 7.801 16.839 1.909 490 HZ3 TRP 69 HZ3 TRP 69 7.150 12.652 1.517 491 HH2 TRP 69 HH2 TRP 69 6.512 14.955 1.022 492 H MET 70 H MET 70 11.548 10.725 6.757 493 HA MET 70 HA MET 70 14.426 10.282 6.920 494 HB2 MET 70 HB2 MET 70 13.145 10.792 9.249 495 HB3 MET 70 HB3 MET 70 12.881 9.058 9.137 496 HG2 MET 70 HG2 MET 70 14.855 9.486 10.433 497 HG3 MET 70 HG3 MET 70 15.309 8.724 8.911 498 HE1 MET 70 HE1 MET 70 17.258 10.367 10.977 499 HE2 MET 70 HE2 MET 70 18.288 11.191 9.807 500 HE3 MET 70 HE3 MET 70 17.837 9.506 9.551 501 H ALA 71 H ALA 71 11.146 9.072 6.719 502 HA ALA 71 HA ALA 71 11.973 6.331 6.243 503 HB1 ALA 71 HB1 ALA 71 9.230 7.565 6.192 504 HB2 ALA 71 HB2 ALA 71 9.974 6.740 7.562 505 HB3 ALA 71 HB3 ALA 71 9.588 5.841 6.095 506 H GLY 72 H GLY 72 11.167 9.107 4.390 507 HA2 GLY 72 HA2 GLY 72 11.808 9.268 2.092 508 HA3 GLY 72 HA3 GLY 72 11.541 7.544 1.932 509 H ASN 73 H ASN 73 9.991 7.213 0.506 510 HA ASN 73 HA ASN 73 7.916 9.080 -0.034 511 HB2 ASN 73 HB2 ASN 73 8.540 6.351 -1.127 512 HB3 ASN 73 HB3 ASN 73 7.144 7.291 -1.642 513 HD21 ASN 73 HD21 ASN 73 10.652 7.308 -1.446 514 HD22 ASN 73 HD22 ASN 73 10.900 8.333 -2.811 515 H ALA 74 H ALA 74 5.787 8.966 0.397 516 HA ALA 74 HA ALA 74 4.595 6.639 1.547 517 HB1 ALA 74 HB1 ALA 74 3.789 7.727 3.590 518 HB2 ALA 74 HB2 ALA 74 4.721 9.168 3.181 519 HB3 ALA 74 HB3 ALA 74 5.551 7.656 3.550 520 H VAL 75 H VAL 75 2.357 6.603 1.436 521 HA VAL 75 HA VAL 75 1.034 8.946 0.302 522 HB VAL 75 HB VAL 75 0.198 6.337 -0.865 523 HG11 VAL 75 HG11 VAL 75 -0.892 8.596 -1.238 524 HG12 VAL 75 HG12 VAL 75 -0.521 7.647 -2.678 525 HG13 VAL 75 HG13 VAL 75 0.516 8.999 -2.222 526 HG21 VAL 75 HG21 VAL 75 1.802 6.300 -2.618 527 HG22 VAL 75 HG22 VAL 75 2.701 6.358 -1.101 528 HG23 VAL 75 HG23 VAL 75 2.518 7.814 -2.074 529 H LEU 76 H LEU 76 -0.678 9.359 1.465 530 HA LEU 76 HA LEU 76 -2.113 7.146 2.699 531 HB2 LEU 76 HB2 LEU 76 -0.962 9.270 4.003 532 HB3 LEU 76 HB3 LEU 76 -2.631 9.751 3.887 533 HG LEU 76 HG LEU 76 -2.565 7.052 4.789 534 HD11 LEU 76 HD11 LEU 76 -1.284 7.235 6.830 535 HD12 LEU 76 HD12 LEU 76 -0.778 8.868 6.399 536 HD13 LEU 76 HD13 LEU 76 -0.237 7.493 5.435 537 HD21 LEU 76 HD21 LEU 76 -4.346 8.555 5.314 538 HD22 LEU 76 HD22 LEU 76 -3.241 9.669 6.120 539 HD23 LEU 76 HD23 LEU 76 -3.568 8.086 6.825 540 H ILE 77 H ILE 77 -4.059 6.992 2.311 541 HA ILE 77 HA ILE 77 -5.576 8.967 0.898 542 HB ILE 77 HB ILE 77 -4.906 6.236 -0.124 543 HG12 ILE 77 HG12 ILE 77 -5.005 8.603 -1.884 544 HG13 ILE 77 HG13 ILE 77 -3.715 8.548 -0.687 545 HG21 ILE 77 HG21 ILE 77 -6.578 6.471 -1.912 546 HG22 ILE 77 HG22 ILE 77 -7.171 7.946 -1.148 547 HG23 ILE 77 HG23 ILE 77 -7.334 6.397 -0.320 548 HD11 ILE 77 HD11 ILE 77 -4.257 6.391 -2.716 549 HD12 ILE 77 HD12 ILE 77 -2.894 6.483 -1.600 550 HD13 ILE 77 HD13 ILE 77 -3.055 7.668 -2.896 551 H GLN 78 H GLN 78 -7.745 8.669 1.035 552 HA GLN 78 HA GLN 78 -8.732 7.052 3.183 553 HB2 GLN 78 HB2 GLN 78 -9.224 9.412 3.345 554 HB3 GLN 78 HB3 GLN 78 -9.935 9.413 1.742 555 HG2 GLN 78 HG2 GLN 78 -11.410 7.511 2.983 556 HG3 GLN 78 HG3 GLN 78 -11.101 8.620 4.306 557 HE21 GLN 78 HE21 GLN 78 -12.458 8.163 1.222 558 HE22 GLN 78 HE22 GLN 78 -13.486 9.538 1.198 559 H HIS 79 H HIS 79 -9.569 5.232 2.655 560 HA HIS 79 HA HIS 79 -10.172 4.407 0.041 561 HB2 HIS 79 HB2 HIS 79 -10.281 3.153 2.710 562 HB3 HIS 79 HB3 HIS 79 -11.214 2.401 1.418 563 HD1 HIS 79 HD1 HIS 79 -8.899 3.298 -0.718 564 HD2 HIS 79 HD2 HIS 79 -8.500 0.942 2.678 565 HE1 HIS 79 HE1 HIS 79 -6.799 1.948 -1.078 566 HE2 HIS 79 HE2 HIS 79 -6.593 0.513 0.982 567 H ALA 80 H ALA 80 -12.214 2.863 -0.037 568 HA ALA 80 HA ALA 80 -14.280 4.578 -0.674 569 HB1 ALA 80 HB1 ALA 80 -14.432 1.594 -0.477 570 HB2 ALA 80 HB2 ALA 80 -13.809 2.488 -1.865 571 HB3 ALA 80 HB3 ALA 80 -15.504 2.643 -1.404 572 H ASP 81 H ASP 81 -13.621 3.109 2.295 573 HA ASP 81 HA ASP 81 -16.358 3.328 3.202 574 HB2 ASP 81 HB2 ASP 81 -14.303 1.480 3.772 575 HB3 ASP 81 HB3 ASP 81 -14.784 2.277 5.259 576 H GLY 82 H GLY 82 -13.464 4.963 3.207 577 HA2 GLY 82 HA2 GLY 82 -13.426 7.247 3.962 578 HA3 GLY 82 HA3 GLY 82 -14.415 6.763 5.329 579 H MET 83 H MET 83 -12.396 4.290 5.087 580 HA MET 83 HA MET 83 -10.815 4.988 7.251 581 HB2 MET 83 HB2 MET 83 -9.688 2.777 6.639 582 HB3 MET 83 HB3 MET 83 -11.356 2.748 7.119 583 HG2 MET 83 HG2 MET 83 -11.566 2.986 4.422 584 HG3 MET 83 HG3 MET 83 -10.110 2.005 4.585 585 HE1 MET 83 HE1 MET 83 -12.266 0.921 2.984 586 HE2 MET 83 HE2 MET 83 -12.861 -0.598 3.656 587 HE3 MET 83 HE3 MET 83 -11.127 -0.320 3.505 588 H HIS 84 H HIS 84 -8.323 4.596 7.181 589 HA HIS 84 HA HIS 84 -7.363 6.066 4.872 590 HB2 HIS 84 HB2 HIS 84 -6.388 6.128 7.719 591 HB3 HIS 84 HB3 HIS 84 -5.451 6.794 6.388 592 HD1 HIS 84 HD1 HIS 84 -5.970 9.147 5.722 593 HD2 HIS 84 HD2 HIS 84 -8.930 7.491 8.118 594 HE1 HIS 84 HE1 HIS 84 -7.529 11.042 6.272 595 HE2 HIS 84 HE2 HIS 84 -9.319 10.016 7.715 596 H THR 85 H THR 85 -5.476 5.386 3.811 597 HA THR 85 HA THR 85 -4.197 2.980 4.807 598 HB THR 85 HB THR 85 -4.185 2.669 2.073 599 HG1 THR 85 HG1 THR 85 -5.829 4.045 1.614 600 HG21 THR 85 HG21 THR 85 -4.409 0.865 3.673 601 HG22 THR 85 HG22 THR 85 -5.732 0.783 2.510 602 HG23 THR 85 HG23 THR 85 -6.017 1.433 4.123 603 H GLY 86 H GLY 86 -2.116 3.182 4.788 604 HA2 GLY 86 HA2 GLY 86 -0.882 5.319 3.208 605 HA3 GLY 86 HA3 GLY 86 -0.201 4.611 4.665 606 H TYR 87 H TYR 87 1.091 4.953 2.162 607 HA TYR 87 HA TYR 87 1.848 2.232 1.553 608 HB2 TYR 87 HB2 TYR 87 1.520 4.417 -0.539 609 HB3 TYR 87 HB3 TYR 87 2.000 2.756 -0.838 610 HD1 TYR 87 HD1 TYR 87 0.382 1.286 -1.656 611 HD2 TYR 87 HD2 TYR 87 -0.922 4.675 0.589 612 HE1 TYR 87 HE1 TYR 87 -1.980 0.702 -2.123 613 HE2 TYR 87 HE2 TYR 87 -3.256 4.080 0.133 614 HH TYR 87 HH TYR 87 -4.535 2.801 -1.578 615 H ALA 88 H ALA 88 3.763 2.350 2.671 616 HA ALA 88 HA ALA 88 5.461 4.692 2.135 617 HB1 ALA 88 HB1 ALA 88 4.743 4.619 4.444 618 HB2 ALA 88 HB2 ALA 88 6.483 4.362 4.331 619 HB3 ALA 88 HB3 ALA 88 5.409 2.999 4.624 620 H HIS 89 H HIS 89 7.830 4.282 2.532 621 HA HIS 89 HA HIS 89 9.781 3.413 1.838 622 HB2 HIS 89 HB2 HIS 89 8.311 0.832 2.365 623 HB3 HIS 89 HB3 HIS 89 9.986 0.861 1.819 624 HD1 HIS 89 HD1 HIS 89 11.570 2.472 3.448 625 HD2 HIS 89 HD2 HIS 89 8.097 0.870 5.058 626 HE1 HIS 89 HE1 HIS 89 11.861 2.596 5.939 627 HE2 HIS 89 HE2 HIS 89 9.757 1.603 6.896 628 H LEU 90 H LEU 90 8.100 4.358 -0.089 629 HA LEU 90 HA LEU 90 8.459 2.657 -2.403 630 HB2 LEU 90 HB2 LEU 90 6.972 5.253 -2.375 631 HB3 LEU 90 HB3 LEU 90 6.811 3.928 -3.501 632 HG LEU 90 HG LEU 90 5.959 3.733 -0.606 633 HD11 LEU 90 HD11 LEU 90 4.729 5.519 -1.777 634 HD12 LEU 90 HD12 LEU 90 3.704 4.155 -1.337 635 HD13 LEU 90 HD13 LEU 90 4.243 4.348 -3.004 636 HD21 LEU 90 HD21 LEU 90 4.477 1.930 -1.700 637 HD22 LEU 90 HD22 LEU 90 6.176 1.576 -1.385 638 HD23 LEU 90 HD23 LEU 90 5.653 1.997 -3.012 639 H SER 91 H SER 91 9.066 3.931 -4.474 640 HA SER 91 HA SER 91 11.370 5.556 -3.836 641 HB2 SER 91 HB2 SER 91 11.738 3.441 -5.135 642 HB3 SER 91 HB3 SER 91 10.804 4.156 -6.443 643 HG SER 91 HG SER 91 12.433 5.423 -6.928 644 H LYS 92 H LYS 92 8.253 5.774 -5.143 645 HA LYS 92 HA LYS 92 8.523 8.487 -5.767 646 HB2 LYS 92 HB2 LYS 92 9.194 6.753 -7.892 647 HB3 LYS 92 HB3 LYS 92 7.611 7.416 -8.259 648 HG2 LYS 92 HG2 LYS 92 8.390 9.615 -8.238 649 HG3 LYS 92 HG3 LYS 92 9.901 9.145 -7.459 650 HD2 LYS 92 HD2 LYS 92 10.604 7.959 -9.442 651 HD3 LYS 92 HD3 LYS 92 9.039 8.251 -10.206 652 HE2 LYS 92 HE2 LYS 92 10.865 10.483 -9.333 653 HE3 LYS 92 HE3 LYS 92 10.979 9.742 -10.928 654 HZ1 LYS 92 HZ1 LYS 92 9.615 11.757 -10.925 655 HZ2 LYS 92 HZ2 LYS 92 8.546 11.045 -9.827 656 HZ3 LYS 92 HZ3 LYS 92 8.716 10.398 -11.381 657 H ILE 93 H ILE 93 6.624 9.416 -6.594 658 HA ILE 93 HA ILE 93 4.185 7.931 -6.140 659 HB ILE 93 HB ILE 93 5.138 10.363 -4.856 660 HG12 ILE 93 HG12 ILE 93 3.204 9.602 -3.257 661 HG13 ILE 93 HG13 ILE 93 3.339 8.111 -4.179 662 HG21 ILE 93 HG21 ILE 93 2.252 10.294 -5.556 663 HG22 ILE 93 HG22 ILE 93 3.452 11.333 -6.321 664 HG23 ILE 93 HG23 ILE 93 3.090 11.516 -4.604 665 HD11 ILE 93 HD11 ILE 93 4.712 7.865 -2.254 666 HD12 ILE 93 HD12 ILE 93 5.458 9.442 -2.506 667 HD13 ILE 93 HD13 ILE 93 5.798 8.117 -3.619 668 H SER 94 H SER 94 2.450 8.477 -7.355 669 HA SER 94 HA SER 94 2.922 10.096 -9.720 670 HB2 SER 94 HB2 SER 94 2.303 7.557 -9.792 671 HB3 SER 94 HB3 SER 94 0.686 8.154 -9.411 672 HG SER 94 HG SER 94 2.089 8.276 -11.768 673 H VAL 95 H VAL 95 1.415 10.109 -6.781 674 HA VAL 95 HA VAL 95 -0.845 11.562 -7.675 675 HB VAL 95 HB VAL 95 -1.443 11.156 -5.115 676 HG11 VAL 95 HG11 VAL 95 -2.863 10.637 -7.016 677 HG12 VAL 95 HG12 VAL 95 -2.854 9.309 -5.858 678 HG13 VAL 95 HG13 VAL 95 -1.908 9.190 -7.341 679 HG21 VAL 95 HG21 VAL 95 -0.911 8.682 -4.705 680 HG22 VAL 95 HG22 VAL 95 0.351 9.868 -4.375 681 HG23 VAL 95 HG23 VAL 95 0.400 8.921 -5.862 682 H SER 96 H SER 96 -1.593 12.910 -5.513 683 HA SER 96 HA SER 96 0.462 14.511 -4.426 684 HB2 SER 96 HB2 SER 96 -0.004 15.501 -6.761 685 HB3 SER 96 HB3 SER 96 -1.570 15.970 -6.103 686 HG SER 96 HG SER 96 0.193 17.562 -5.957 687 H THR 97 H THR 97 -0.260 15.738 -2.744 688 HA THR 97 HA THR 97 -2.300 14.688 -1.198 689 HB THR 97 HB THR 97 -1.237 17.478 -0.834 690 HG1 THR 97 HG1 THR 97 0.101 15.038 -0.682 691 HG21 THR 97 HG21 THR 97 -2.986 16.719 0.734 692 HG22 THR 97 HG22 THR 97 -1.441 16.976 1.545 693 HG23 THR 97 HG23 THR 97 -1.978 15.339 1.169 694 H ASP 98 H ASP 98 -4.435 15.018 -1.121 695 HA ASP 98 HA ASP 98 -6.464 16.080 -1.093 696 HB2 ASP 98 HB2 ASP 98 -5.068 18.325 -1.073 697 HB3 ASP 98 HB3 ASP 98 -5.587 18.414 -2.752 698 H SER 99 H SER 99 -4.662 15.056 -3.696 699 HA SER 99 HA SER 99 -6.573 15.496 -5.757 700 HB2 SER 99 HB2 SER 99 -4.228 13.599 -5.665 701 HB3 SER 99 HB3 SER 99 -5.119 14.073 -7.111 702 HG SER 99 HG SER 99 -3.133 15.253 -6.747 703 H THR 100 H THR 100 -7.902 13.927 -6.717 704 HA THR 100 HA THR 100 -8.814 11.876 -4.970 705 HB THR 100 HB THR 100 -10.411 11.398 -6.918 706 HG1 THR 100 HG1 THR 100 -10.509 13.791 -7.923 707 HG21 THR 100 HG21 THR 100 -11.063 12.458 -4.838 708 HG22 THR 100 HG22 THR 100 -11.873 13.236 -6.200 709 HG23 THR 100 HG23 THR 100 -10.485 14.016 -5.434 710 H VAL 101 H VAL 101 -8.833 9.699 -5.353 711 HA VAL 101 HA VAL 101 -7.178 8.760 -7.515 712 HB VAL 101 HB VAL 101 -6.805 6.845 -5.675 713 HG11 VAL 101 HG11 VAL 101 -4.559 7.835 -5.341 714 HG12 VAL 101 HG12 VAL 101 -5.136 9.289 -6.157 715 HG13 VAL 101 HG13 VAL 101 -5.066 7.756 -7.029 716 HG21 VAL 101 HG21 VAL 101 -7.833 7.922 -3.833 717 HG22 VAL 101 HG22 VAL 101 -6.965 9.423 -4.150 718 HG23 VAL 101 HG23 VAL 101 -6.092 8.004 -3.580 719 H LYS 102 H LYS 102 -7.393 6.385 -7.855 720 HA LYS 102 HA LYS 102 -9.957 5.279 -7.349 721 HB2 LYS 102 HB2 LYS 102 -9.923 6.528 -9.547 722 HB3 LYS 102 HB3 LYS 102 -8.800 5.291 -10.056 723 HG2 LYS 102 HG2 LYS 102 -10.597 3.606 -9.420 724 HG3 LYS 102 HG3 LYS 102 -11.688 4.985 -9.313 725 HD2 LYS 102 HD2 LYS 102 -11.219 5.540 -11.648 726 HD3 LYS 102 HD3 LYS 102 -10.126 4.159 -11.758 727 HE2 LYS 102 HE2 LYS 102 -13.054 3.950 -11.067 728 HE3 LYS 102 HE3 LYS 102 -12.412 3.756 -12.696 729 HZ1 LYS 102 HZ1 LYS 102 -12.756 1.627 -11.571 730 HZ2 LYS 102 HZ2 LYS 102 -11.669 2.080 -10.357 731 HZ3 LYS 102 HZ3 LYS 102 -11.123 1.871 -11.943 732 H GLN 103 H GLN 103 -10.054 3.115 -7.434 733 HA GLN 103 HA GLN 103 -7.903 1.682 -6.525 734 HB2 GLN 103 HB2 GLN 103 -10.414 1.194 -6.353 735 HB3 GLN 103 HB3 GLN 103 -10.240 0.437 -7.921 736 HG2 GLN 103 HG2 GLN 103 -8.388 -0.462 -5.800 737 HG3 GLN 103 HG3 GLN 103 -10.077 -0.935 -5.651 738 HE21 GLN 103 HE21 GLN 103 -8.767 -0.428 -8.762 739 HE22 GLN 103 HE22 GLN 103 -8.635 -2.063 -9.202 740 H GLY 104 H GLY 104 -6.471 0.364 -7.410 741 HA2 GLY 104 HA2 GLY 104 -5.195 -0.772 -8.930 742 HA3 GLY 104 HA3 GLY 104 -6.454 -0.535 -10.082 743 H GLN 105 H GLN 105 -5.898 2.469 -9.092 744 HA GLN 105 HA GLN 105 -4.412 3.188 -11.409 745 HB2 GLN 105 HB2 GLN 105 -6.262 4.539 -10.456 746 HB3 GLN 105 HB3 GLN 105 -5.272 4.869 -9.054 747 HG2 GLN 105 HG2 GLN 105 -3.766 6.190 -10.360 748 HG3 GLN 105 HG3 GLN 105 -4.568 5.708 -11.858 749 HE21 GLN 105 HE21 GLN 105 -5.042 7.390 -8.808 750 HE22 GLN 105 HE22 GLN 105 -6.300 8.429 -9.359 751 H ILE 106 H ILE 106 -2.399 3.902 -11.588 752 HA ILE 106 HA ILE 106 -0.577 2.957 -9.705 753 HB ILE 106 HB ILE 106 -0.118 4.477 -12.197 754 HG12 ILE 106 HG12 ILE 106 0.632 1.618 -11.683 755 HG13 ILE 106 HG13 ILE 106 -1.004 2.041 -12.168 756 HG21 ILE 106 HG21 ILE 106 1.754 4.964 -10.739 757 HG22 ILE 106 HG22 ILE 106 2.282 3.850 -12.001 758 HG23 ILE 106 HG23 ILE 106 1.946 3.247 -10.378 759 HD11 ILE 106 HD11 ILE 106 -0.014 3.116 -14.205 760 HD12 ILE 106 HD12 ILE 106 0.172 1.365 -14.109 761 HD13 ILE 106 HD13 ILE 106 1.535 2.418 -13.732 762 H ILE 107 H ILE 107 -0.568 3.917 -7.867 763 HA ILE 107 HA ILE 107 -0.624 6.752 -7.613 764 HB ILE 107 HB ILE 107 -0.566 6.087 -5.111 765 HG12 ILE 107 HG12 ILE 107 -1.917 3.581 -5.866 766 HG13 ILE 107 HG13 ILE 107 -0.169 3.572 -6.072 767 HG21 ILE 107 HG21 ILE 107 -2.985 5.869 -5.102 768 HG22 ILE 107 HG22 ILE 107 -2.960 5.471 -6.820 769 HG23 ILE 107 HG23 ILE 107 -2.471 7.078 -6.279 770 HD11 ILE 107 HD11 ILE 107 -0.955 2.704 -3.886 771 HD12 ILE 107 HD12 ILE 107 -1.559 4.319 -3.511 772 HD13 ILE 107 HD13 ILE 107 0.168 4.059 -3.760 773 H GLY 108 H GLY 108 1.820 4.509 -7.945 774 HA2 GLY 108 HA2 GLY 108 3.910 6.246 -7.661 775 HA3 GLY 108 HA3 GLY 108 3.715 5.486 -6.090 776 H TYR 109 H TYR 109 5.812 4.725 -6.485 777 HA TYR 109 HA TYR 109 5.926 2.175 -7.784 778 HB2 TYR 109 HB2 TYR 109 8.182 4.181 -8.008 779 HB3 TYR 109 HB3 TYR 109 8.123 2.583 -8.735 780 HD1 TYR 109 HD1 TYR 109 6.637 5.963 -8.858 781 HD2 TYR 109 HD2 TYR 109 7.159 2.261 -10.881 782 HE1 TYR 109 HE1 TYR 109 5.722 6.967 -10.911 783 HE2 TYR 109 HE2 TYR 109 6.241 3.250 -12.939 784 HH TYR 109 HH TYR 109 5.747 6.619 -13.297 785 H THR 110 H THR 110 7.050 0.697 -6.626 786 HA THR 110 HA THR 110 7.433 1.060 -3.885 787 HB THR 110 HB THR 110 8.833 -1.185 -4.340 788 HG1 THR 110 HG1 THR 110 8.361 -0.693 -6.702 789 HG21 THR 110 HG21 THR 110 6.961 -1.257 -2.928 790 HG22 THR 110 HG22 THR 110 6.566 -2.363 -4.244 791 HG23 THR 110 HG23 THR 110 5.873 -0.743 -4.215 792 H GLY 111 H GLY 111 9.357 1.036 -2.551 793 HA2 GLY 111 HA2 GLY 111 11.928 1.209 -3.874 794 HA3 GLY 111 HA3 GLY 111 11.372 2.726 -3.202 795 H ALA 112 H ALA 112 13.313 2.614 -1.994 796 HA ALA 112 HA ALA 112 12.858 1.439 0.559 797 HB1 ALA 112 HB1 ALA 112 14.561 -0.066 0.623 798 HB2 ALA 112 HB2 ALA 112 15.646 1.000 -0.268 799 HB3 ALA 112 HB3 ALA 112 14.474 0.015 -1.140 800 H THR 113 H THR 113 12.542 3.982 0.049 801 HA THR 113 HA THR 113 14.927 5.574 0.220 802 HB THR 113 HB THR 113 13.294 7.488 0.452 803 HG1 THR 113 HG1 THR 113 11.110 7.002 0.159 804 HG21 THR 113 HG21 THR 113 12.536 7.371 -1.866 805 HG22 THR 113 HG22 THR 113 12.866 5.639 -1.903 806 HG23 THR 113 HG23 THR 113 14.195 6.788 -1.732 807 H GLY 114 H GLY 114 13.623 3.749 2.536 808 HA2 GLY 114 HA2 GLY 114 13.970 5.740 4.688 809 HA3 GLY 114 HA3 GLY 114 13.052 4.250 4.839 810 H GLN 115 H GLN 115 14.346 3.897 6.777 811 HA GLN 115 HA GLN 115 17.149 3.173 6.299 812 HB2 GLN 115 HB2 GLN 115 16.082 4.583 8.326 813 HB3 GLN 115 HB3 GLN 115 15.955 2.974 9.019 814 HG2 GLN 115 HG2 GLN 115 18.288 2.649 8.949 815 HG3 GLN 115 HG3 GLN 115 18.527 4.045 7.899 816 HE21 GLN 115 HE21 GLN 115 18.360 6.128 8.774 817 HE22 GLN 115 HE22 GLN 115 18.510 6.409 10.472 818 H VAL 116 H VAL 116 16.958 1.257 5.206 819 HA VAL 116 HA VAL 116 16.380 -1.090 6.790 820 HB VAL 116 HB VAL 116 15.035 -2.112 4.819 821 HG11 VAL 116 HG11 VAL 116 13.577 -0.064 6.465 822 HG12 VAL 116 HG12 VAL 116 14.226 -1.556 7.146 823 HG13 VAL 116 HG13 VAL 116 12.996 -1.626 5.889 824 HG21 VAL 116 HG21 VAL 116 14.064 0.690 4.373 825 HG22 VAL 116 HG22 VAL 116 13.844 -0.743 3.367 826 HG23 VAL 116 HG23 VAL 116 15.414 0.057 3.431 827 H THR 117 H THR 117 16.833 -3.146 5.412 828 HA THR 117 HA THR 117 19.405 -2.715 4.096 829 HB THR 117 HB THR 117 19.518 -5.269 4.196 830 HG1 THR 117 HG1 THR 117 17.359 -5.748 4.592 831 HG21 THR 117 HG21 THR 117 20.756 -3.810 5.728 832 HG22 THR 117 HG22 THR 117 20.184 -5.263 6.551 833 HG23 THR 117 HG23 THR 117 19.349 -3.727 6.789 834 H GLY 118 H GLY 118 16.161 -3.315 3.196 835 HA2 GLY 118 HA2 GLY 118 16.974 -3.647 0.430 836 HA3 GLY 118 HA3 GLY 118 16.088 -5.002 1.105 837 HA PRO 119 HA PRO 119 13.096 -1.589 -0.402 838 HB2 PRO 119 HB2 PRO 119 12.543 -3.020 -2.852 839 HB3 PRO 119 HB3 PRO 119 13.211 -1.401 -2.658 840 HG2 PRO 119 HG2 PRO 119 14.636 -3.492 -3.664 841 HG3 PRO 119 HG3 PRO 119 15.366 -2.103 -2.834 842 HD2 PRO 119 HD2 PRO 119 14.773 -4.837 -1.778 843 HD3 PRO 119 HD3 PRO 119 16.194 -3.805 -1.515 844 H HIS 120 H HIS 120 10.853 -1.767 -0.113 845 HA HIS 120 HA HIS 120 9.489 -4.200 -0.486 846 HB2 HIS 120 HB2 HIS 120 8.847 -4.617 1.851 847 HB3 HIS 120 HB3 HIS 120 10.595 -4.694 1.673 848 HD1 HIS 120 HD1 HIS 120 11.875 -2.398 2.426 849 HD2 HIS 120 HD2 HIS 120 7.998 -2.934 3.812 850 HE1 HIS 120 HE1 HIS 120 11.621 -0.801 4.350 851 HE2 HIS 120 HE2 HIS 120 9.280 -1.171 5.200 852 H LEU 121 H LEU 121 7.404 -3.795 1.213 853 HA LEU 121 HA LEU 121 6.199 -1.359 0.341 854 HB2 LEU 121 HB2 LEU 121 5.320 -2.853 -1.200 855 HB3 LEU 121 HB3 LEU 121 5.210 -4.147 -0.046 856 HG LEU 121 HG LEU 121 3.289 -2.882 1.020 857 HD11 LEU 121 HD11 LEU 121 2.133 -1.226 -0.375 858 HD12 LEU 121 HD12 LEU 121 3.465 -1.274 -1.531 859 HD13 LEU 121 HD13 LEU 121 3.738 -0.668 0.102 860 HD21 LEU 121 HD21 LEU 121 2.954 -3.758 -1.845 861 HD22 LEU 121 HD22 LEU 121 1.677 -3.640 -0.635 862 HD23 LEU 121 HD23 LEU 121 2.973 -4.818 -0.435 863 H HIS 122 H HIS 122 5.080 -0.353 1.815 864 HA HIS 122 HA HIS 122 4.479 -1.688 4.285 865 HB2 HIS 122 HB2 HIS 122 6.184 -0.131 4.837 866 HB3 HIS 122 HB3 HIS 122 5.470 1.119 3.831 867 HD2 HIS 122 HD2 HIS 122 3.027 2.235 4.971 868 HE1 HIS 122 HE1 HIS 122 3.982 0.936 8.879 869 HE2 HIS 122 HE2 HIS 122 2.462 2.408 7.492 870 H PHE 123 H PHE 123 2.407 -2.010 4.486 871 HA PHE 123 HA PHE 123 0.524 -0.030 3.416 872 HB2 PHE 123 HB2 PHE 123 0.615 -2.304 2.254 873 HB3 PHE 123 HB3 PHE 123 -0.027 -2.987 3.740 874 HD1 PHE 123 HD1 PHE 123 -0.770 -0.724 0.922 875 HD2 PHE 123 HD2 PHE 123 -2.329 -2.847 4.266 876 HE1 PHE 123 HE1 PHE 123 -3.057 -0.275 0.139 877 HE2 PHE 123 HE2 PHE 123 -4.615 -2.407 3.484 878 HZ PHE 123 HZ PHE 123 -4.983 -1.124 1.417 879 H GLU 124 H GLU 124 -0.204 1.072 5.101 880 HA GLU 124 HA GLU 124 -1.030 -0.291 7.500 881 HB2 GLU 124 HB2 GLU 124 0.906 1.445 7.552 882 HB3 GLU 124 HB3 GLU 124 -0.369 2.638 7.360 883 HG2 GLU 124 HG2 GLU 124 -1.416 1.788 9.434 884 HG3 GLU 124 HG3 GLU 124 -0.057 0.688 9.632 885 H MET 125 H MET 125 -3.089 -0.215 7.922 886 HA MET 125 HA MET 125 -4.833 1.642 6.609 887 HB2 MET 125 HB2 MET 125 -5.560 -0.269 5.649 888 HB3 MET 125 HB3 MET 125 -4.891 -1.233 6.924 889 HG2 MET 125 HG2 MET 125 -7.249 -1.563 6.880 890 HG3 MET 125 HG3 MET 125 -6.827 -0.683 8.343 891 HE1 MET 125 HE1 MET 125 -10.363 0.655 7.413 892 HE2 MET 125 HE2 MET 125 -9.331 0.291 8.796 893 HE3 MET 125 HE3 MET 125 -9.636 -0.944 7.576 894 H LEU 126 H LEU 126 -6.307 2.591 7.756 895 HA LEU 126 HA LEU 126 -6.555 2.114 10.594 896 HB2 LEU 126 HB2 LEU 126 -5.368 4.515 9.276 897 HB3 LEU 126 HB3 LEU 126 -6.406 4.811 10.650 898 HG LEU 126 HG LEU 126 -4.782 2.961 11.727 899 HD11 LEU 126 HD11 LEU 126 -3.026 4.456 9.789 900 HD12 LEU 126 HD12 LEU 126 -3.476 2.758 9.639 901 HD13 LEU 126 HD13 LEU 126 -2.508 3.296 11.012 902 HD21 LEU 126 HD21 LEU 126 -3.554 4.831 12.713 903 HD22 LEU 126 HD22 LEU 126 -5.289 5.141 12.650 904 HD23 LEU 126 HD23 LEU 126 -4.213 5.906 11.481 905 HA PRO 127 HA PRO 127 -10.853 3.408 10.005 906 HB2 PRO 127 HB2 PRO 127 -11.195 5.282 11.973 907 HB3 PRO 127 HB3 PRO 127 -11.354 3.559 12.236 908 HG2 PRO 127 HG2 PRO 127 -9.068 5.346 12.826 909 HG3 PRO 127 HG3 PRO 127 -9.667 3.950 13.749 910 HD2 PRO 127 HD2 PRO 127 -7.476 3.777 12.245 911 HD3 PRO 127 HD3 PRO 127 -8.615 2.433 12.365 912 H ALA 128 H ALA 128 -12.288 5.429 9.955 913 HA ALA 128 HA ALA 128 -11.195 7.300 8.178 914 HB1 ALA 128 HB1 ALA 128 -13.787 7.419 9.701 915 HB2 ALA 128 HB2 ALA 128 -13.567 6.652 8.126 916 HB3 ALA 128 HB3 ALA 128 -13.377 8.399 8.291 917 H ASN 129 H ASN 129 -11.566 7.023 11.558 918 HA ASN 129 HA ASN 129 -9.975 9.279 12.172 919 HB2 ASN 129 HB2 ASN 129 -12.876 9.619 12.347 920 HB3 ASN 129 HB3 ASN 129 -12.085 9.865 13.901 921 HD21 ASN 129 HD21 ASN 129 -12.194 10.917 10.557 922 HD22 ASN 129 HD22 ASN 129 -11.514 12.481 10.830 923 HA PRO 130 HA PRO 130 -9.179 5.957 14.798 924 HB2 PRO 130 HB2 PRO 130 -6.622 7.182 15.388 925 HB3 PRO 130 HB3 PRO 130 -6.980 5.673 14.535 926 HG2 PRO 130 HG2 PRO 130 -6.076 7.932 13.267 927 HG3 PRO 130 HG3 PRO 130 -6.981 6.646 12.469 928 HD2 PRO 130 HD2 PRO 130 -7.872 9.320 13.392 929 HD3 PRO 130 HD3 PRO 130 -8.390 8.357 11.993 930 H ASN 131 H ASN 131 -8.492 5.535 16.883 931 HA ASN 131 HA ASN 131 -8.906 7.642 18.825 932 HB2 ASN 131 HB2 ASN 131 -10.480 5.483 18.442 933 HB3 ASN 131 HB3 ASN 131 -9.312 4.866 19.594 934 HD21 ASN 131 HD21 ASN 131 -11.869 7.047 18.989 935 HD22 ASN 131 HD22 ASN 131 -12.144 7.518 20.615 936 H TRP 132 H TRP 132 -6.605 7.897 18.311 937 HA TRP 132 HA TRP 132 -4.653 5.999 18.856 938 HB2 TRP 132 HB2 TRP 132 -4.198 8.954 19.200 939 HB3 TRP 132 HB3 TRP 132 -3.048 7.736 18.668 940 HD1 TRP 132 HD1 TRP 132 -3.502 6.733 16.131 941 HE1 TRP 132 HE1 TRP 132 -4.398 7.949 14.047 942 HE3 TRP 132 HE3 TRP 132 -5.756 10.719 18.406 943 HZ2 TRP 132 HZ2 TRP 132 -5.855 10.236 13.450 944 HZ3 TRP 132 HZ3 TRP 132 -6.889 12.386 16.990 945 HH2 TRP 132 HH2 TRP 132 -6.939 12.150 14.558 946 H GLN 133 H GLN 133 -6.731 6.766 21.009 947 HA GLN 133 HA GLN 133 -5.231 7.637 23.245 948 HB2 GLN 133 HB2 GLN 133 -8.054 6.703 22.869 949 HB3 GLN 133 HB3 GLN 133 -7.393 7.237 24.385 950 HG2 GLN 133 HG2 GLN 133 -8.456 9.148 23.624 951 HG3 GLN 133 HG3 GLN 133 -6.792 9.410 23.106 952 HE21 GLN 133 HE21 GLN 133 -6.278 8.825 20.858 953 HE22 GLN 133 HE22 GLN 133 -7.478 8.978 19.637 954 H ASN 134 H ASN 134 -4.380 5.240 22.083 955 HA ASN 134 HA ASN 134 -3.310 3.354 22.647 956 HB2 ASN 134 HB2 ASN 134 -4.389 3.978 25.395 957 HB3 ASN 134 HB3 ASN 134 -3.431 2.537 25.056 958 HD21 ASN 134 HD21 ASN 134 -3.426 6.043 24.830 959 HD22 ASN 134 HD22 ASN 134 -1.721 6.234 24.982 960 H GLY 135 H GLY 135 -3.851 1.445 22.009 961 HA2 GLY 135 HA2 GLY 135 -5.579 -0.372 22.888 962 HA3 GLY 135 HA3 GLY 135 -6.654 0.750 22.070 963 H PHE 136 H PHE 136 -5.355 1.434 19.797 964 HA PHE 136 HA PHE 136 -4.346 -0.950 18.496 965 HB2 PHE 136 HB2 PHE 136 -6.055 -0.550 16.573 966 HB3 PHE 136 HB3 PHE 136 -6.527 -1.501 17.965 967 HD1 PHE 136 HD1 PHE 136 -8.839 -1.254 17.570 968 HD2 PHE 136 HD2 PHE 136 -6.437 2.232 18.105 969 HE1 PHE 136 HE1 PHE 136 -10.864 0.112 17.818 970 HE2 PHE 136 HE2 PHE 136 -8.455 3.582 18.330 971 HZ PHE 136 HZ PHE 136 -10.676 2.535 18.199 972 H SER 137 H SER 137 -4.759 2.404 18.621 973 HA SER 137 HA SER 137 -3.726 4.180 17.693 974 HB2 SER 137 HB2 SER 137 -1.864 2.045 16.645 975 HB3 SER 137 HB3 SER 137 -1.633 3.756 16.289 976 HG SER 137 HG SER 137 -1.998 3.549 18.891 977 H GLY 138 H GLY 138 -5.743 2.369 16.564 978 HA2 GLY 138 HA2 GLY 138 -7.276 2.589 14.889 979 HA3 GLY 138 HA3 GLY 138 -6.276 3.838 14.180 980 H ARG 139 H ARG 139 -4.068 1.525 14.523 981 HA ARG 139 HA ARG 139 -4.448 0.726 11.775 982 HB2 ARG 139 HB2 ARG 139 -2.240 -0.556 12.138 983 HB3 ARG 139 HB3 ARG 139 -2.216 1.193 12.078 984 HG2 ARG 139 HG2 ARG 139 -0.781 0.659 13.809 985 HG3 ARG 139 HG3 ARG 139 -2.271 1.093 14.639 986 HD2 ARG 139 HD2 ARG 139 -2.797 -1.273 14.923 987 HD3 ARG 139 HD3 ARG 139 -1.338 -1.714 14.042 988 HE ARG 139 HE ARG 139 -0.272 -0.296 15.992 989 HH11 ARG 139 HH11 ARG 139 -2.851 -2.696 16.192 990 HH12 ARG 139 HH12 ARG 139 -2.423 -3.162 17.879 991 HH21 ARG 139 HH21 ARG 139 -0.689 -2.134 18.951 992 HH22 ARG 139 HH22 ARG 139 0.264 -0.851 18.120 993 H ILE 140 H ILE 140 -5.251 -1.083 11.003 994 HA ILE 140 HA ILE 140 -5.411 -3.382 12.775 995 HB ILE 140 HB ILE 140 -7.606 -3.356 10.911 996 HG12 ILE 140 HG12 ILE 140 -8.864 -1.769 12.660 997 HG13 ILE 140 HG13 ILE 140 -7.259 -1.053 12.767 998 HG21 ILE 140 HG21 ILE 140 -8.854 -4.061 12.883 999 HG22 ILE 140 HG22 ILE 140 -7.459 -3.683 13.893 1000 HG23 ILE 140 HG23 ILE 140 -7.358 -4.976 12.698 1001 HD11 ILE 140 HD11 ILE 140 -7.283 -0.380 10.544 1002 HD12 ILE 140 HD12 ILE 140 -8.922 -0.054 11.109 1003 HD13 ILE 140 HD13 ILE 140 -8.594 -1.481 10.125 1004 H ASP 141 H ASP 141 -6.510 -5.268 11.209 1005 HA ASP 141 HA ASP 141 -4.273 -6.176 9.752 1006 HB2 ASP 141 HB2 ASP 141 -6.999 -7.295 10.297 1007 HB3 ASP 141 HB3 ASP 141 -5.855 -8.136 9.256 1008 HA PRO 142 HA PRO 142 -5.656 -4.793 5.630 1009 HB2 PRO 142 HB2 PRO 142 -3.529 -6.205 4.362 1010 HB3 PRO 142 HB3 PRO 142 -3.640 -4.478 4.693 1011 HG2 PRO 142 HG2 PRO 142 -1.854 -6.227 5.884 1012 HG3 PRO 142 HG3 PRO 142 -2.276 -4.614 6.482 1013 HD2 PRO 142 HD2 PRO 142 -3.178 -7.273 7.427 1014 HD3 PRO 142 HD3 PRO 142 -2.964 -5.757 8.320 1015 H THR 143 H THR 143 -5.762 -7.889 6.838 1016 HA THR 143 HA THR 143 -5.898 -9.664 4.768 1017 HB THR 143 HB THR 143 -7.692 -10.750 6.387 1018 HG1 THR 143 HG1 THR 143 -6.746 -8.527 7.727 1019 HG21 THR 143 HG21 THR 143 -5.496 -11.675 5.932 1020 HG22 THR 143 HG22 THR 143 -5.822 -11.715 7.665 1021 HG23 THR 143 HG23 THR 143 -4.757 -10.479 6.996 1022 H GLY 144 H GLY 144 -8.168 -7.241 5.561 1023 HA2 GLY 144 HA2 GLY 144 -10.499 -8.409 4.355 1024 HA3 GLY 144 HA3 GLY 144 -10.300 -6.722 4.812 1025 H TYR 145 H TYR 145 -7.789 -6.598 3.216 1026 HA TYR 145 HA TYR 145 -8.981 -6.156 0.622 1027 HB2 TYR 145 HB2 TYR 145 -6.277 -5.155 1.478 1028 HB3 TYR 145 HB3 TYR 145 -7.275 -4.575 0.157 1029 HD1 TYR 145 HD1 TYR 145 -7.093 -4.743 3.859 1030 HD2 TYR 145 HD2 TYR 145 -8.707 -2.750 0.469 1031 HE1 TYR 145 HE1 TYR 145 -7.958 -2.977 5.322 1032 HE2 TYR 145 HE2 TYR 145 -9.581 -0.972 1.925 1033 HH TYR 145 HH TYR 145 -8.627 -0.638 5.178 1034 H ILE 146 H ILE 146 -6.974 -8.311 2.215 1035 HA ILE 146 HA ILE 146 -5.491 -9.039 -0.149 1036 HB ILE 146 HB ILE 146 -5.102 -10.162 2.618 1037 HG12 ILE 146 HG12 ILE 146 -4.726 -7.768 2.798 1038 HG13 ILE 146 HG13 ILE 146 -3.186 -8.603 2.895 1039 HG21 ILE 146 HG21 ILE 146 -4.051 -11.609 1.108 1040 HG22 ILE 146 HG22 ILE 146 -2.752 -10.599 1.739 1041 HG23 ILE 146 HG23 ILE 146 -3.415 -10.282 0.135 1042 HD11 ILE 146 HD11 ILE 146 -4.245 -7.160 0.464 1043 HD12 ILE 146 HD12 ILE 146 -2.675 -7.952 0.601 1044 HD13 ILE 146 HD13 ILE 146 -3.038 -6.539 1.592 1045 H ALA 147 H ALA 147 -8.246 -9.896 1.505 1046 HA ALA 147 HA ALA 147 -8.319 -12.686 1.024 1047 HB1 ALA 147 HB1 ALA 147 -10.600 -10.823 1.554 1048 HB2 ALA 147 HB2 ALA 147 -9.609 -11.583 2.800 1049 HB3 ALA 147 HB3 ALA 147 -10.608 -12.575 1.739 1050 H ASN 148 H ASN 148 -9.084 -9.902 -0.821 1051 HA ASN 148 HA ASN 148 -10.440 -11.408 -2.846 1052 HB2 ASN 148 HB2 ASN 148 -10.102 -8.464 -3.051 1053 HB3 ASN 148 HB3 ASN 148 -11.483 -9.445 -3.427 1054 HD21 ASN 148 HD21 ASN 148 -9.735 -7.904 -0.923 1055 HD22 ASN 148 HD22 ASN 148 -10.990 -7.885 0.259 1056 H ALA 149 H ALA 149 -7.553 -11.156 -2.045 1057 HA ALA 149 HA ALA 149 -6.372 -10.152 -4.414 1058 HB1 ALA 149 HB1 ALA 149 -4.941 -9.429 -2.849 1059 HB2 ALA 149 HB2 ALA 149 -4.368 -11.096 -2.741 1060 HB3 ALA 149 HB3 ALA 149 -5.637 -10.527 -1.655 1061 HA PRO 150 HA PRO 150 -5.284 -13.908 -6.546 1062 HB2 PRO 150 HB2 PRO 150 -2.526 -13.759 -6.681 1063 HB3 PRO 150 HB3 PRO 150 -3.647 -12.935 -7.771 1064 HG2 PRO 150 HG2 PRO 150 -2.282 -11.879 -5.348 1065 HG3 PRO 150 HG3 PRO 150 -2.518 -11.108 -6.927 1066 HD2 PRO 150 HD2 PRO 150 -4.074 -10.429 -4.882 1067 HD3 PRO 150 HD3 PRO 150 -4.773 -10.653 -6.502 1068 H VAL 151 H VAL 151 -3.628 -15.829 -6.490 1069 HA VAL 151 HA VAL 151 -3.521 -16.828 -3.757 1070 HB VAL 151 HB VAL 151 -3.741 -18.386 -6.274 1071 HG11 VAL 151 HG11 VAL 151 -3.833 -20.373 -4.995 1072 HG12 VAL 151 HG12 VAL 151 -3.960 -19.466 -3.488 1073 HG13 VAL 151 HG13 VAL 151 -2.443 -19.454 -4.397 1074 HG21 VAL 151 HG21 VAL 151 -5.993 -18.926 -5.643 1075 HG22 VAL 151 HG22 VAL 151 -5.812 -17.170 -5.629 1076 HG23 VAL 151 HG23 VAL 151 -5.802 -18.071 -4.112 1077 H PHE 152 H PHE 152 -1.694 -17.241 -2.947 1078 HA PHE 152 HA PHE 152 0.747 -17.419 -4.568 1079 HB2 PHE 152 HB2 PHE 152 0.884 -15.619 -2.972 1080 HB3 PHE 152 HB3 PHE 152 0.266 -16.626 -1.674 1081 HD1 PHE 152 HD1 PHE 152 1.704 -18.208 -0.546 1082 HD2 PHE 152 HD2 PHE 152 3.218 -15.702 -3.619 1083 HE1 PHE 152 HE1 PHE 152 4.005 -18.742 0.153 1084 HE2 PHE 152 HE2 PHE 152 5.515 -16.228 -2.939 1085 HZ PHE 152 HZ PHE 152 5.914 -17.753 -1.048 1086 H ASN 153 H ASN 153 0.832 -19.526 -5.128 1087 HA ASN 153 HA ASN 153 1.359 -21.722 -5.020 1088 HB2 ASN 153 HB2 ASN 153 2.063 -20.923 -2.230 1089 HB3 ASN 153 HB3 ASN 153 2.019 -22.634 -2.643 1090 HD21 ASN 153 HD21 ASN 153 3.423 -19.541 -3.571 1091 HD22 ASN 153 HD22 ASN 153 4.888 -20.191 -4.216 1092 H GLY 154 H GLY 154 -0.856 -20.648 -2.492 1093 HA2 GLY 154 HA2 GLY 154 -3.142 -21.621 -2.690 1094 HA3 GLY 154 HA3 GLY 154 -2.350 -23.186 -2.802 1095 H THR 155 H THR 155 -3.035 -20.472 -0.671 1096 HA THR 155 HA THR 155 -2.156 -21.893 1.678 1097 HB THR 155 HB THR 155 -2.881 -19.703 2.761 1098 HG1 THR 155 HG1 THR 155 -2.586 -18.159 0.643 1099 HG21 THR 155 HG21 THR 155 -0.543 -20.210 2.398 1100 HG22 THR 155 HG22 THR 155 -0.840 -18.514 2.014 1101 HG23 THR 155 HG23 THR 155 -0.675 -19.697 0.716 1102 H THR 156 H THR 156 -3.569 -23.350 2.301 1103 HA THR 156 HA THR 156 -6.437 -22.867 2.264 1104 HB THR 156 HB THR 156 -6.545 -25.225 3.224 1105 HG1 THR 156 HG1 THR 156 -4.138 -25.985 2.313 1106 HG21 THR 156 HG21 THR 156 -5.189 -24.892 0.545 1107 HG22 THR 156 HG22 THR 156 -6.920 -24.728 0.841 1108 HG23 THR 156 HG23 THR 156 -6.130 -26.288 1.072 1109 HA PRO 157 HA PRO 157 -6.272 -21.738 6.601 1110 HB2 PRO 157 HB2 PRO 157 -9.063 -21.434 6.859 1111 HB3 PRO 157 HB3 PRO 157 -7.886 -20.161 6.520 1112 HG2 PRO 157 HG2 PRO 157 -9.848 -21.091 4.761 1113 HG3 PRO 157 HG3 PRO 157 -8.457 -20.076 4.341 1114 HD2 PRO 157 HD2 PRO 157 -8.833 -22.997 3.983 1115 HD3 PRO 157 HD3 PRO 157 -7.907 -21.843 3.012 1116 H THR 158 H THR 158 -8.799 -23.928 5.618 1117 HA THR 158 HA THR 158 -8.169 -25.855 7.598 1118 HB THR 158 HB THR 158 -9.495 -24.473 9.039 1119 HG1 THR 158 HG1 THR 158 -11.247 -25.966 9.508 1120 HG21 THR 158 HG21 THR 158 -10.793 -23.298 7.220 1121 HG22 THR 158 HG22 THR 158 -11.683 -23.684 8.691 1122 HG23 THR 158 HG23 THR 158 -11.888 -24.681 7.252 1123 H GLU 159 H GLU 159 -11.017 -24.900 5.805 1124 HA GLU 159 HA GLU 159 -11.493 -27.522 4.788 1125 HB2 GLU 159 HB2 GLU 159 -12.869 -24.885 4.483 1126 HB3 GLU 159 HB3 GLU 159 -13.308 -26.231 3.440 1127 HG2 GLU 159 HG2 GLU 159 -13.880 -27.574 5.382 1128 HG3 GLU 159 HG3 GLU 159 -13.392 -26.260 6.451 Start of MODEL 4 1 H1 MET 1 H1 MET 1 19.308 -4.250 -15.754 2 H2 MET 1 H2 MET 1 18.609 -3.374 -17.021 3 H3 MET 1 H3 MET 1 18.728 -5.057 -17.123 4 HA MET 1 HA MET 1 17.204 -5.334 -15.304 5 HB2 MET 1 HB2 MET 1 17.336 -2.328 -15.283 6 HB3 MET 1 HB3 MET 1 15.945 -3.179 -14.626 7 HG2 MET 1 HG2 MET 1 17.391 -4.350 -13.053 8 HG3 MET 1 HG3 MET 1 18.797 -3.525 -13.724 9 HE1 MET 1 HE1 MET 1 18.325 -1.914 -10.158 10 HE2 MET 1 HE2 MET 1 19.361 -2.905 -11.184 11 HE3 MET 1 HE3 MET 1 17.848 -3.564 -10.561 12 H ARG 2 H ARG 2 15.253 -5.960 -15.971 13 HA ARG 2 HA ARG 2 14.349 -5.087 -18.606 14 HB2 ARG 2 HB2 ARG 2 13.626 -7.417 -16.837 15 HB3 ARG 2 HB3 ARG 2 12.714 -7.029 -18.288 16 HG2 ARG 2 HG2 ARG 2 14.611 -7.416 -19.677 17 HG3 ARG 2 HG3 ARG 2 15.677 -7.550 -18.278 18 HD2 ARG 2 HD2 ARG 2 14.317 -9.538 -17.560 19 HD3 ARG 2 HD3 ARG 2 13.493 -9.447 -19.117 20 HE ARG 2 HE ARG 2 16.285 -9.509 -19.514 21 HH11 ARG 2 HH11 ARG 2 13.631 -11.628 -18.552 22 HH12 ARG 2 HH12 ARG 2 14.465 -13.109 -19.151 23 HH21 ARG 2 HH21 ARG 2 17.348 -11.365 -20.263 24 HH22 ARG 2 HH22 ARG 2 16.530 -12.961 -20.099 25 H GLY 3 H GLY 3 12.588 -3.893 -18.974 26 HA2 GLY 3 HA2 GLY 3 10.532 -3.600 -16.917 27 HA3 GLY 3 HA3 GLY 3 11.390 -2.145 -17.402 28 H SER 4 H SER 4 11.160 -1.371 -19.547 29 HA SER 4 HA SER 4 8.725 -2.335 -20.902 30 HB2 SER 4 HB2 SER 4 9.879 0.464 -20.841 31 HB3 SER 4 HB3 SER 4 8.434 -0.025 -21.726 32 HG SER 4 HG SER 4 7.375 0.271 -19.949 33 H HIS 5 H HIS 5 8.873 -2.972 -22.957 34 HA HIS 5 HA HIS 5 11.267 -2.258 -24.510 35 HB2 HIS 5 HB2 HIS 5 10.076 -5.008 -24.145 36 HB3 HIS 5 HB3 HIS 5 11.163 -4.615 -25.473 37 HD1 HIS 5 HD1 HIS 5 11.103 -5.388 -21.853 38 HD2 HIS 5 HD2 HIS 5 13.849 -4.082 -24.686 39 HE1 HIS 5 HE1 HIS 5 13.361 -5.669 -20.781 40 HE2 HIS 5 HE2 HIS 5 15.008 -4.873 -22.513 41 H HIS 6 H HIS 6 7.938 -3.490 -24.613 42 HA HIS 6 HA HIS 6 7.652 -2.305 -27.299 43 HB2 HIS 6 HB2 HIS 6 6.496 -4.849 -26.178 44 HB3 HIS 6 HB3 HIS 6 5.777 -4.045 -27.568 45 HD1 HIS 6 HD1 HIS 6 7.036 -4.183 -29.800 46 HD2 HIS 6 HD2 HIS 6 8.993 -6.067 -26.655 47 HE1 HIS 6 HE1 HIS 6 8.869 -5.538 -30.862 48 HE2 HIS 6 HE2 HIS 6 10.041 -6.669 -28.942 49 H HIS 7 H HIS 7 5.985 -3.046 -24.251 50 HA HIS 7 HA HIS 7 3.894 -1.095 -24.922 51 HB2 HIS 7 HB2 HIS 7 4.022 -3.282 -22.845 52 HB3 HIS 7 HB3 HIS 7 2.742 -2.076 -22.883 53 HD1 HIS 7 HD1 HIS 7 4.071 -5.023 -24.799 54 HD2 HIS 7 HD2 HIS 7 0.780 -2.484 -24.801 55 HE1 HIS 7 HE1 HIS 7 2.418 -6.066 -26.383 56 HE2 HIS 7 HE2 HIS 7 0.434 -4.514 -26.367 57 H HIS 8 H HIS 8 3.458 0.664 -23.662 58 HA HIS 8 HA HIS 8 5.576 1.488 -21.824 59 HB2 HIS 8 HB2 HIS 8 3.455 2.961 -23.355 60 HB3 HIS 8 HB3 HIS 8 4.252 3.724 -21.984 61 HD1 HIS 8 HD1 HIS 8 4.687 2.945 -25.545 62 HD2 HIS 8 HD2 HIS 8 7.091 4.096 -22.357 63 HE1 HIS 8 HE1 HIS 8 6.836 3.751 -26.579 64 HE2 HIS 8 HE2 HIS 8 8.274 4.443 -24.630 65 H HIS 9 H HIS 9 2.045 1.150 -21.939 66 HA HIS 9 HA HIS 9 1.988 1.282 -18.994 67 HB2 HIS 9 HB2 HIS 9 -0.073 2.142 -21.026 68 HB3 HIS 9 HB3 HIS 9 -0.466 1.899 -19.327 69 HD1 HIS 9 HD1 HIS 9 0.990 4.328 -21.668 70 HD2 HIS 9 HD2 HIS 9 0.857 3.752 -17.555 71 HE1 HIS 9 HE1 HIS 9 1.698 6.521 -20.659 72 HE2 HIS 9 HE2 HIS 9 1.608 6.149 -18.167 73 H HIS 10 H HIS 10 1.399 -0.496 -17.964 74 HA HIS 10 HA HIS 10 -0.104 -2.588 -19.420 75 HB2 HIS 10 HB2 HIS 10 2.513 -2.834 -18.707 76 HB3 HIS 10 HB3 HIS 10 1.722 -3.478 -17.272 77 HD1 HIS 10 HD1 HIS 10 -0.176 -5.409 -17.907 78 HD2 HIS 10 HD2 HIS 10 2.870 -4.685 -20.638 79 HE1 HIS 10 HE1 HIS 10 -0.117 -7.431 -19.399 80 HE2 HIS 10 HE2 HIS 10 1.734 -6.972 -21.047 81 H GLY 11 H GLY 11 -1.729 -3.594 -18.319 82 HA2 GLY 11 HA2 GLY 11 -2.261 -2.643 -15.569 83 HA3 GLY 11 HA3 GLY 11 -3.522 -2.944 -16.753 84 H SER 12 H SER 12 -0.684 -4.911 -15.953 85 HA SER 12 HA SER 12 -2.476 -7.061 -15.002 86 HB2 SER 12 HB2 SER 12 -0.394 -7.109 -17.098 87 HB3 SER 12 HB3 SER 12 -0.338 -8.438 -15.930 88 HG SER 12 HG SER 12 -1.850 -8.348 -18.008 89 H ALA 13 H ALA 13 -1.271 -8.763 -13.776 90 HA ALA 13 HA ALA 13 1.196 -8.033 -12.609 91 HB1 ALA 13 HB1 ALA 13 0.427 -8.111 -10.261 92 HB2 ALA 13 HB2 ALA 13 -1.235 -8.250 -10.834 93 HB3 ALA 13 HB3 ALA 13 -0.314 -6.782 -11.155 94 H THR 14 H THR 14 2.238 -9.846 -13.035 95 HA THR 14 HA THR 14 0.982 -12.414 -12.778 96 HB THR 14 HB THR 14 2.281 -11.980 -14.786 97 HG1 THR 14 HG1 THR 14 2.287 -14.118 -14.291 98 HG21 THR 14 HG21 THR 14 4.669 -11.713 -12.953 99 HG22 THR 14 HG22 THR 14 3.983 -10.457 -13.984 100 HG23 THR 14 HG23 THR 14 4.759 -11.865 -14.708 101 H TYR 15 H TYR 15 2.242 -10.499 -10.560 102 HA TYR 15 HA TYR 15 3.895 -12.387 -9.196 103 HB2 TYR 15 HB2 TYR 15 3.637 -9.533 -9.242 104 HB3 TYR 15 HB3 TYR 15 3.743 -10.169 -7.607 105 HD1 TYR 15 HD1 TYR 15 5.561 -9.224 -10.518 106 HD2 TYR 15 HD2 TYR 15 5.714 -11.775 -7.118 107 HE1 TYR 15 HE1 TYR 15 7.997 -9.424 -10.784 108 HE2 TYR 15 HE2 TYR 15 8.152 -11.978 -7.370 109 HH TYR 15 HH TYR 15 9.960 -9.961 -9.426 110 H THR 16 H THR 16 3.543 -13.175 -7.254 111 HA THR 16 HA THR 16 0.756 -13.411 -6.573 112 HB THR 16 HB THR 16 1.537 -15.269 -5.060 113 HG1 THR 16 HG1 THR 16 3.660 -15.983 -5.327 114 HG21 THR 16 HG21 THR 16 2.161 -15.457 -8.007 115 HG22 THR 16 HG22 THR 16 0.612 -15.784 -7.229 116 HG23 THR 16 HG23 THR 16 1.993 -16.838 -6.924 117 H ARG 17 H ARG 17 0.488 -13.957 -4.072 118 HA ARG 17 HA ARG 17 0.582 -11.580 -2.651 119 HB2 ARG 17 HB2 ARG 17 -0.713 -14.000 -2.459 120 HB3 ARG 17 HB3 ARG 17 0.315 -14.000 -1.035 121 HG2 ARG 17 HG2 ARG 17 -1.056 -12.613 0.031 122 HG3 ARG 17 HG3 ARG 17 -1.057 -11.472 -1.314 123 HD2 ARG 17 HD2 ARG 17 -3.309 -12.293 -0.827 124 HD3 ARG 17 HD3 ARG 17 -2.785 -12.767 -2.438 125 HE ARG 17 HE ARG 17 -2.392 -15.005 -1.538 126 HH11 ARG 17 HH11 ARG 17 -4.429 -12.857 0.380 127 HH12 ARG 17 HH12 ARG 17 -5.240 -14.218 1.233 128 HH21 ARG 17 HH21 ARG 17 -4.675 -16.372 0.749 129 HH22 ARG 17 HH22 ARG 17 -3.412 -16.730 -0.484 130 HA PRO 18 HA PRO 18 4.878 -11.972 -1.105 131 HB2 PRO 18 HB2 PRO 18 4.253 -9.432 0.245 132 HB3 PRO 18 HB3 PRO 18 5.531 -9.790 -0.924 133 HG2 PRO 18 HG2 PRO 18 3.432 -8.262 -1.578 134 HG3 PRO 18 HG3 PRO 18 4.200 -9.357 -2.744 135 HD2 PRO 18 HD2 PRO 18 1.649 -9.710 -1.227 136 HD3 PRO 18 HD3 PRO 18 2.037 -10.138 -2.908 137 H LEU 19 H LEU 19 1.925 -11.435 0.636 138 HA LEU 19 HA LEU 19 3.005 -12.682 3.021 139 HB2 LEU 19 HB2 LEU 19 2.188 -9.994 2.857 140 HB3 LEU 19 HB3 LEU 19 0.990 -10.838 3.769 141 HG LEU 19 HG LEU 19 2.701 -9.658 5.122 142 HD11 LEU 19 HD11 LEU 19 1.498 -11.340 6.252 143 HD12 LEU 19 HD12 LEU 19 3.196 -11.676 6.610 144 HD13 LEU 19 HD13 LEU 19 2.345 -12.640 5.403 145 HD21 LEU 19 HD21 LEU 19 4.595 -11.844 4.298 146 HD22 LEU 19 HD22 LEU 19 4.928 -10.436 5.305 147 HD23 LEU 19 HD23 LEU 19 4.617 -10.235 3.580 148 H ASP 20 H ASP 20 0.979 -12.716 4.504 149 HA ASP 20 HA ASP 20 -1.282 -13.862 3.125 150 HB2 ASP 20 HB2 ASP 20 0.490 -15.175 4.893 151 HB3 ASP 20 HB3 ASP 20 -1.091 -15.047 5.653 152 H THR 21 H THR 21 0.068 -11.960 5.565 153 HA THR 21 HA THR 21 -2.251 -10.539 6.136 154 HB THR 21 HB THR 21 -2.760 -12.630 7.367 155 HG1 THR 21 HG1 THR 21 -3.377 -11.508 9.322 156 HG21 THR 21 HG21 THR 21 -0.529 -13.245 8.154 157 HG22 THR 21 HG22 THR 21 -1.656 -13.116 9.503 158 HG23 THR 21 HG23 THR 21 -0.494 -11.825 9.199 159 H GLY 22 H GLY 22 -1.723 -9.486 8.526 160 HA2 GLY 22 HA2 GLY 22 0.867 -8.862 9.298 161 HA3 GLY 22 HA3 GLY 22 0.331 -7.621 8.171 162 H ASN 23 H ASN 23 0.418 -8.528 11.394 163 HA ASN 23 HA ASN 23 -1.303 -6.376 12.185 164 HB2 ASN 23 HB2 ASN 23 -2.575 -7.884 13.806 165 HB3 ASN 23 HB3 ASN 23 -3.027 -8.006 12.111 166 HD21 ASN 23 HD21 ASN 23 -1.981 -9.756 10.879 167 HD22 ASN 23 HD22 ASN 23 -1.667 -11.255 11.671 168 H ILE 24 H ILE 24 -0.519 -5.282 13.679 169 HA ILE 24 HA ILE 24 1.512 -6.458 15.406 170 HB ILE 24 HB ILE 24 1.136 -3.587 15.556 171 HG12 ILE 24 HG12 ILE 24 2.657 -3.302 13.452 172 HG13 ILE 24 HG13 ILE 24 2.002 -4.866 12.990 173 HG21 ILE 24 HG21 ILE 24 3.633 -3.605 15.471 174 HG22 ILE 24 HG22 ILE 24 3.532 -5.357 15.332 175 HG23 ILE 24 HG23 ILE 24 2.921 -4.558 16.774 176 HD11 ILE 24 HD11 ILE 24 0.677 -2.230 13.136 177 HD12 ILE 24 HD12 ILE 24 -0.282 -3.664 13.527 178 HD13 ILE 24 HD13 ILE 24 0.504 -3.525 11.949 179 H THR 25 H THR 25 -0.679 -7.289 16.110 180 HA THR 25 HA THR 25 -1.780 -5.666 18.293 181 HB THR 25 HB THR 25 -3.458 -6.477 16.764 182 HG1 THR 25 HG1 THR 25 -3.865 -8.200 18.934 183 HG21 THR 25 HG21 THR 25 -2.694 -9.317 17.427 184 HG22 THR 25 HG22 THR 25 -2.195 -8.485 15.955 185 HG23 THR 25 HG23 THR 25 -3.907 -8.769 16.268 186 H THR 26 H THR 26 -0.008 -8.536 17.587 187 HA THR 26 HA THR 26 0.086 -9.257 20.440 188 HB THR 26 HB THR 26 0.809 -11.188 18.255 189 HG1 THR 26 HG1 THR 26 -1.798 -10.836 19.363 190 HG21 THR 26 HG21 THR 26 0.075 -12.850 19.953 191 HG22 THR 26 HG22 THR 26 -0.199 -11.525 21.085 192 HG23 THR 26 HG23 THR 26 1.429 -11.857 20.494 193 H GLY 27 H GLY 27 2.078 -9.805 17.605 194 HA2 GLY 27 HA2 GLY 27 4.322 -8.315 18.573 195 HA3 GLY 27 HA3 GLY 27 4.555 -10.045 18.784 196 H PHE 28 H PHE 28 5.347 -7.597 16.823 197 HA PHE 28 HA PHE 28 4.852 -8.767 14.281 198 HB2 PHE 28 HB2 PHE 28 5.385 -6.209 15.101 199 HB3 PHE 28 HB3 PHE 28 6.868 -6.680 14.279 200 HD1 PHE 28 HD1 PHE 28 6.982 -6.353 12.016 201 HD2 PHE 28 HD2 PHE 28 3.153 -6.908 13.769 202 HE1 PHE 28 HE1 PHE 28 5.943 -6.014 9.824 203 HE2 PHE 28 HE2 PHE 28 2.102 -6.572 11.573 204 HZ PHE 28 HZ PHE 28 3.498 -6.133 9.603 205 H ASN 29 H ASN 29 6.371 -9.190 12.680 206 HA ASN 29 HA ASN 29 7.971 -11.309 13.282 207 HB2 ASN 29 HB2 ASN 29 7.600 -9.589 10.895 208 HB3 ASN 29 HB3 ASN 29 8.727 -10.925 10.853 209 HD21 ASN 29 HD21 ASN 29 5.523 -9.935 10.686 210 HD22 ASN 29 HD22 ASN 29 4.792 -11.480 10.491 211 H GLY 30 H GLY 30 8.924 -9.011 14.741 212 HA2 GLY 30 HA2 GLY 30 11.186 -8.863 15.578 213 HA3 GLY 30 HA3 GLY 30 11.766 -9.197 13.950 214 H TYR 31 H TYR 31 9.238 -7.242 13.524 215 HA TYR 31 HA TYR 31 10.925 -4.805 13.459 216 HB2 TYR 31 HB2 TYR 31 8.214 -5.046 12.154 217 HB3 TYR 31 HB3 TYR 31 9.492 -3.908 11.798 218 HD1 TYR 31 HD1 TYR 31 11.005 -4.319 10.072 219 HD2 TYR 31 HD2 TYR 31 8.628 -7.542 11.521 220 HE1 TYR 31 HE1 TYR 31 11.782 -5.728 8.215 221 HE2 TYR 31 HE2 TYR 31 9.400 -8.949 9.664 222 HH TYR 31 HH TYR 31 10.314 -8.625 7.364 223 HA PRO 32 HA PRO 32 8.134 -4.045 17.090 224 HB2 PRO 32 HB2 PRO 32 10.334 -2.668 18.367 225 HB3 PRO 32 HB3 PRO 32 9.563 -4.184 18.847 226 HG2 PRO 32 HG2 PRO 32 12.122 -4.036 17.922 227 HG3 PRO 32 HG3 PRO 32 11.096 -5.474 17.760 228 HD2 PRO 32 HD2 PRO 32 11.722 -3.368 15.728 229 HD3 PRO 32 HD3 PRO 32 11.610 -5.131 15.534 230 H GLY 33 H GLY 33 6.897 -2.291 17.419 231 HA2 GLY 33 HA2 GLY 33 6.401 0.002 17.677 232 HA3 GLY 33 HA3 GLY 33 7.948 0.401 16.950 233 H HIS 34 H HIS 34 6.485 -1.895 15.066 234 HA HIS 34 HA HIS 34 5.952 -0.123 12.940 235 HB2 HIS 34 HB2 HIS 34 6.919 -2.545 12.925 236 HB3 HIS 34 HB3 HIS 34 5.235 -3.042 12.967 237 HD1 HIS 34 HD1 HIS 34 4.539 -3.694 10.677 238 HD2 HIS 34 HD2 HIS 34 7.113 -0.454 10.620 239 HE1 HIS 34 HE1 HIS 34 4.763 -2.987 8.262 240 H VAL 35 H VAL 35 4.023 0.558 12.180 241 HA VAL 35 HA VAL 35 1.638 -0.105 13.761 242 HB VAL 35 HB VAL 35 0.905 2.050 12.229 243 HG11 VAL 35 HG11 VAL 35 0.200 2.177 14.411 244 HG12 VAL 35 HG12 VAL 35 1.516 3.349 14.449 245 HG13 VAL 35 HG13 VAL 35 1.781 1.715 15.050 246 HG21 VAL 35 HG21 VAL 35 2.642 3.767 12.516 247 HG22 VAL 35 HG22 VAL 35 3.144 2.476 11.425 248 HG23 VAL 35 HG23 VAL 35 3.757 2.521 13.078 249 H GLY 36 H GLY 36 3.053 -0.508 10.687 250 HA2 GLY 36 HA2 GLY 36 0.452 -1.327 9.557 251 HA3 GLY 36 HA3 GLY 36 1.729 -0.596 8.591 252 H VAL 37 H VAL 37 1.849 -2.318 7.219 253 HA VAL 37 HA VAL 37 3.237 -4.659 8.286 254 HB VAL 37 HB VAL 37 0.912 -5.323 7.895 255 HG11 VAL 37 HG11 VAL 37 0.196 -5.508 5.424 256 HG12 VAL 37 HG12 VAL 37 1.394 -4.244 5.157 257 HG13 VAL 37 HG13 VAL 37 0.042 -3.957 6.249 258 HG21 VAL 37 HG21 VAL 37 1.340 -7.217 6.255 259 HG22 VAL 37 HG22 VAL 37 2.423 -7.109 7.644 260 HG23 VAL 37 HG23 VAL 37 2.959 -6.544 6.063 261 H ASP 38 H ASP 38 4.739 -5.670 6.827 262 HA ASP 38 HA ASP 38 5.478 -4.006 4.509 263 HB2 ASP 38 HB2 ASP 38 7.302 -5.099 6.658 264 HB3 ASP 38 HB3 ASP 38 7.890 -4.468 5.123 265 H TYR 39 H TYR 39 5.990 -4.925 2.711 266 HA TYR 39 HA TYR 39 6.130 -7.871 2.563 267 HB2 TYR 39 HB2 TYR 39 4.926 -6.178 0.391 268 HB3 TYR 39 HB3 TYR 39 4.807 -7.902 0.611 269 HD1 TYR 39 HD1 TYR 39 3.707 -4.669 1.990 270 HD2 TYR 39 HD2 TYR 39 2.923 -8.834 1.741 271 HE1 TYR 39 HE1 TYR 39 1.500 -4.306 2.969 272 HE2 TYR 39 HE2 TYR 39 0.703 -8.477 2.736 273 HH TYR 39 HH TYR 39 -0.700 -5.423 3.033 274 H ALA 40 H ALA 40 8.167 -8.281 2.053 275 HA ALA 40 HA ALA 40 9.997 -6.661 0.764 276 HB1 ALA 40 HB1 ALA 40 10.573 -8.619 2.144 277 HB2 ALA 40 HB2 ALA 40 11.427 -8.587 0.603 278 HB3 ALA 40 HB3 ALA 40 10.049 -9.666 0.825 279 H VAL 41 H VAL 41 9.689 -5.785 -1.165 280 HA VAL 41 HA VAL 41 9.476 -7.494 -3.476 281 HB VAL 41 HB VAL 41 7.122 -6.935 -2.934 282 HG11 VAL 41 HG11 VAL 41 7.974 -4.084 -3.369 283 HG12 VAL 41 HG12 VAL 41 7.243 -4.788 -1.927 284 HG13 VAL 41 HG13 VAL 41 6.295 -4.622 -3.405 285 HG21 VAL 41 HG21 VAL 41 8.171 -5.784 -5.510 286 HG22 VAL 41 HG22 VAL 41 6.472 -6.131 -5.189 287 HG23 VAL 41 HG23 VAL 41 7.651 -7.443 -5.212 288 HA PRO 42 HA PRO 42 12.867 -4.769 -4.707 289 HB2 PRO 42 HB2 PRO 42 11.891 -5.538 -7.425 290 HB3 PRO 42 HB3 PRO 42 13.536 -5.556 -6.770 291 HG2 PRO 42 HG2 PRO 42 12.194 -7.819 -7.039 292 HG3 PRO 42 HG3 PRO 42 13.215 -7.531 -5.616 293 HD2 PRO 42 HD2 PRO 42 10.246 -7.485 -5.845 294 HD3 PRO 42 HD3 PRO 42 11.273 -7.983 -4.486 295 H VAL 43 H VAL 43 13.184 -2.892 -5.218 296 HA VAL 43 HA VAL 43 11.259 -0.922 -5.368 297 HB VAL 43 HB VAL 43 13.355 -0.528 -4.361 298 HG11 VAL 43 HG11 VAL 43 15.489 -0.394 -5.655 299 HG12 VAL 43 HG12 VAL 43 14.638 -1.169 -6.993 300 HG13 VAL 43 HG13 VAL 43 14.814 -2.011 -5.452 301 HG21 VAL 43 HG21 VAL 43 12.245 1.339 -5.890 302 HG22 VAL 43 HG22 VAL 43 13.774 1.195 -6.750 303 HG23 VAL 43 HG23 VAL 43 13.767 1.633 -5.042 304 H GLY 44 H GLY 44 10.413 0.329 -6.955 305 HA2 GLY 44 HA2 GLY 44 10.517 1.378 -9.092 306 HA3 GLY 44 HA3 GLY 44 11.470 0.024 -9.642 307 H THR 45 H THR 45 8.990 -1.276 -7.896 308 HA THR 45 HA THR 45 7.560 -1.990 -10.267 309 HB THR 45 HB THR 45 6.807 -2.918 -7.519 310 HG1 THR 45 HG1 THR 45 8.941 -3.908 -9.132 311 HG21 THR 45 HG21 THR 45 5.362 -3.575 -9.399 312 HG22 THR 45 HG22 THR 45 6.183 -4.974 -8.706 313 HG23 THR 45 HG23 THR 45 6.755 -4.279 -10.222 314 HA PRO 46 HA PRO 46 4.570 1.335 -9.711 315 HB2 PRO 46 HB2 PRO 46 2.755 -0.419 -11.283 316 HB3 PRO 46 HB3 PRO 46 3.232 1.259 -11.578 317 HG2 PRO 46 HG2 PRO 46 4.209 -0.706 -13.073 318 HG3 PRO 46 HG3 PRO 46 5.217 0.675 -12.593 319 HD2 PRO 46 HD2 PRO 46 5.193 -2.108 -11.513 320 HD3 PRO 46 HD3 PRO 46 6.559 -1.012 -11.798 321 H VAL 47 H VAL 47 3.334 1.670 -8.020 322 HA VAL 47 HA VAL 47 1.891 -0.472 -6.767 323 HB VAL 47 HB VAL 47 2.359 2.251 -5.568 324 HG11 VAL 47 HG11 VAL 47 1.749 -0.410 -4.277 325 HG12 VAL 47 HG12 VAL 47 0.608 0.915 -4.508 326 HG13 VAL 47 HG13 VAL 47 1.990 1.121 -3.431 327 HG21 VAL 47 HG21 VAL 47 4.561 1.568 -5.849 328 HG22 VAL 47 HG22 VAL 47 4.165 -0.130 -5.593 329 HG23 VAL 47 HG23 VAL 47 4.172 0.985 -4.230 330 H ARG 48 H ARG 48 -0.069 -0.639 -6.967 331 HA ARG 48 HA ARG 48 -1.616 1.517 -8.024 332 HB2 ARG 48 HB2 ARG 48 -2.166 -1.437 -7.987 333 HB3 ARG 48 HB3 ARG 48 -3.335 -0.252 -8.548 334 HG2 ARG 48 HG2 ARG 48 -2.345 -0.026 -10.531 335 HG3 ARG 48 HG3 ARG 48 -0.721 -0.002 -9.832 336 HD2 ARG 48 HD2 ARG 48 -0.755 -1.937 -11.143 337 HD3 ARG 48 HD3 ARG 48 -1.041 -2.531 -9.510 338 HE ARG 48 HE ARG 48 -3.353 -1.995 -11.222 339 HH11 ARG 48 HH11 ARG 48 -2.447 -5.710 -9.884 340 HH12 ARG 48 HH12 ARG 48 -1.270 -4.369 -9.638 341 HH21 ARG 48 HH21 ARG 48 -4.426 -5.324 -10.946 342 HH22 ARG 48 HH22 ARG 48 -4.832 -3.674 -11.549 343 H ALA 49 H ALA 49 -3.684 2.005 -7.306 344 HA ALA 49 HA ALA 49 -3.817 2.125 -4.488 345 HB1 ALA 49 HB1 ALA 49 -5.774 3.001 -6.607 346 HB2 ALA 49 HB2 ALA 49 -4.601 4.003 -5.751 347 HB3 ALA 49 HB3 ALA 49 -5.976 3.319 -4.884 348 H VAL 50 H VAL 50 -4.614 0.642 -3.179 349 HA VAL 50 HA VAL 50 -5.913 -1.672 -4.055 350 HB VAL 50 HB VAL 50 -5.788 -0.694 -1.254 351 HG11 VAL 50 HG11 VAL 50 -7.323 -2.529 -1.375 352 HG12 VAL 50 HG12 VAL 50 -5.821 -3.122 -0.667 353 HG13 VAL 50 HG13 VAL 50 -6.193 -3.461 -2.357 354 HG21 VAL 50 HG21 VAL 50 -3.782 -2.226 -1.101 355 HG22 VAL 50 HG22 VAL 50 -3.560 -0.726 -1.998 356 HG23 VAL 50 HG23 VAL 50 -3.795 -2.240 -2.865 357 H ALA 51 H ALA 51 -7.244 1.364 -3.397 358 HA ALA 51 HA ALA 51 -9.838 0.649 -4.130 359 HB1 ALA 51 HB1 ALA 51 -10.903 1.431 -1.925 360 HB2 ALA 51 HB2 ALA 51 -9.334 1.050 -1.211 361 HB3 ALA 51 HB3 ALA 51 -10.271 -0.216 -2.003 362 H ASN 52 H ASN 52 -11.038 2.394 -4.673 363 HA ASN 52 HA ASN 52 -9.809 4.793 -5.212 364 HB2 ASN 52 HB2 ASN 52 -12.241 5.554 -5.577 365 HB3 ASN 52 HB3 ASN 52 -11.605 4.292 -6.567 366 HD21 ASN 52 HD21 ASN 52 -12.814 4.133 -3.311 367 HD22 ASN 52 HD22 ASN 52 -14.108 3.042 -3.636 368 H GLY 53 H GLY 53 -10.293 6.939 -4.451 369 HA2 GLY 53 HA2 GLY 53 -11.781 7.646 -2.236 370 HA3 GLY 53 HA3 GLY 53 -10.230 7.125 -1.604 371 H THR 54 H THR 54 -9.076 8.840 -1.062 372 HA THR 54 HA THR 54 -8.632 10.979 -2.891 373 HB THR 54 HB THR 54 -9.488 11.507 -0.114 374 HG1 THR 54 HG1 THR 54 -11.036 11.694 -2.484 375 HG21 THR 54 HG21 THR 54 -9.350 13.426 -2.436 376 HG22 THR 54 HG22 THR 54 -8.080 13.255 -1.226 377 HG23 THR 54 HG23 THR 54 -9.677 13.831 -0.750 378 H VAL 55 H VAL 55 -6.592 11.768 -2.723 379 HA VAL 55 HA VAL 55 -4.730 10.460 -0.993 380 HB VAL 55 HB VAL 55 -4.122 12.671 -2.963 381 HG11 VAL 55 HG11 VAL 55 -2.373 10.397 -2.044 382 HG12 VAL 55 HG12 VAL 55 -2.331 12.031 -1.382 383 HG13 VAL 55 HG13 VAL 55 -1.904 11.754 -3.071 384 HG21 VAL 55 HG21 VAL 55 -3.691 11.030 -4.696 385 HG22 VAL 55 HG22 VAL 55 -5.361 10.916 -4.153 386 HG23 VAL 55 HG23 VAL 55 -4.176 9.727 -3.615 387 H LYS 56 H LYS 56 -4.520 11.258 0.924 388 HA LYS 56 HA LYS 56 -4.905 14.053 1.548 389 HB2 LYS 56 HB2 LYS 56 -4.467 11.842 3.537 390 HB3 LYS 56 HB3 LYS 56 -5.141 13.438 3.838 391 HG2 LYS 56 HG2 LYS 56 -7.191 12.670 3.464 392 HG3 LYS 56 HG3 LYS 56 -6.705 12.175 1.842 393 HD2 LYS 56 HD2 LYS 56 -7.348 10.149 2.664 394 HD3 LYS 56 HD3 LYS 56 -5.662 10.132 3.162 395 HE2 LYS 56 HE2 LYS 56 -7.045 9.401 4.997 396 HE3 LYS 56 HE3 LYS 56 -6.338 10.967 5.386 397 HZ1 LYS 56 HZ1 LYS 56 -9.136 10.373 4.614 398 HZ2 LYS 56 HZ2 LYS 56 -8.510 11.941 4.588 399 HZ3 LYS 56 HZ3 LYS 56 -8.574 11.080 6.042 400 H PHE 57 H PHE 57 -2.479 11.801 1.079 401 HA PHE 57 HA PHE 57 -0.437 13.701 1.720 402 HB2 PHE 57 HB2 PHE 57 -0.844 12.056 3.736 403 HB3 PHE 57 HB3 PHE 57 0.026 10.915 2.714 404 HD1 PHE 57 HD1 PHE 57 0.296 13.818 4.855 405 HD2 PHE 57 HD2 PHE 57 2.358 11.367 2.054 406 HE1 PHE 57 HE1 PHE 57 2.439 14.776 5.596 407 HE2 PHE 57 HE2 PHE 57 4.501 12.318 2.789 408 HZ PHE 57 HZ PHE 57 4.545 14.026 4.564 409 H ALA 58 H ALA 58 1.267 13.534 0.474 410 HA ALA 58 HA ALA 58 1.758 11.326 -1.260 411 HB1 ALA 58 HB1 ALA 58 0.247 12.532 -2.678 412 HB2 ALA 58 HB2 ALA 58 1.876 12.825 -3.284 413 HB3 ALA 58 HB3 ALA 58 1.055 14.061 -2.331 414 H GLY 59 H GLY 59 3.597 11.068 -0.174 415 HA2 GLY 59 HA2 GLY 59 5.545 13.217 0.061 416 HA3 GLY 59 HA3 GLY 59 5.658 11.614 0.776 417 H ASN 60 H ASN 60 6.149 13.533 -2.074 418 HA ASN 60 HA ASN 60 7.134 11.522 -3.794 419 HB2 ASN 60 HB2 ASN 60 7.316 14.526 -3.849 420 HB3 ASN 60 HB3 ASN 60 8.006 13.512 -5.110 421 HD21 ASN 60 HD21 ASN 60 5.018 13.144 -3.294 422 HD22 ASN 60 HD22 ASN 60 3.987 13.208 -4.658 423 H GLY 61 H GLY 61 8.924 10.631 -3.937 424 HA2 GLY 61 HA2 GLY 61 11.135 11.190 -2.165 425 HA3 GLY 61 HA3 GLY 61 11.016 9.856 -3.296 426 H ALA 62 H ALA 62 10.292 12.513 -5.048 427 HA ALA 62 HA ALA 62 12.793 12.526 -6.381 428 HB1 ALA 62 HB1 ALA 62 10.419 14.290 -6.851 429 HB2 ALA 62 HB2 ALA 62 10.636 12.687 -7.557 430 HB3 ALA 62 HB3 ALA 62 11.747 13.992 -7.972 431 H ASN 63 H ASN 63 11.227 14.609 -4.110 432 HA ASN 63 HA ASN 63 13.547 16.321 -4.048 433 HB2 ASN 63 HB2 ASN 63 11.165 17.120 -5.210 434 HB3 ASN 63 HB3 ASN 63 11.205 17.881 -3.632 435 HD21 ASN 63 HD21 ASN 63 12.248 17.960 -6.791 436 HD22 ASN 63 HD22 ASN 63 13.398 19.235 -6.655 437 H HIS 64 H HIS 64 12.373 14.214 -2.254 438 HA HIS 64 HA HIS 64 11.378 15.617 -0.054 439 HB2 HIS 64 HB2 HIS 64 11.268 13.444 1.038 440 HB3 HIS 64 HB3 HIS 64 10.486 13.438 -0.513 441 HD1 HIS 64 HD1 HIS 64 13.830 13.115 -1.490 442 HD2 HIS 64 HD2 HIS 64 11.196 10.564 0.461 443 HE1 HIS 64 HE1 HIS 64 14.791 10.809 -1.774 444 HE2 HIS 64 HE2 HIS 64 13.184 9.280 -0.580 445 HA PRO 65 HA PRO 65 15.479 16.503 1.735 446 HB2 PRO 65 HB2 PRO 65 13.753 17.698 3.840 447 HB3 PRO 65 HB3 PRO 65 15.081 18.446 2.925 448 HG2 PRO 65 HG2 PRO 65 12.621 19.148 2.413 449 HG3 PRO 65 HG3 PRO 65 13.738 18.826 1.063 450 HD2 PRO 65 HD2 PRO 65 11.685 16.981 2.265 451 HD3 PRO 65 HD3 PRO 65 11.955 17.432 0.583 452 H TRP 66 H TRP 66 16.501 15.997 3.723 453 HA TRP 66 HA TRP 66 15.244 13.777 5.101 454 HB2 TRP 66 HB2 TRP 66 18.100 14.734 5.235 455 HB3 TRP 66 HB3 TRP 66 17.433 13.365 6.114 456 HD1 TRP 66 HD1 TRP 66 17.979 14.445 2.423 457 HE1 TRP 66 HE1 TRP 66 18.421 12.327 1.029 458 HE3 TRP 66 HE3 TRP 66 17.364 10.905 6.076 459 HZ2 TRP 66 HZ2 TRP 66 18.501 9.537 1.418 460 HZ3 TRP 66 HZ3 TRP 66 17.643 8.536 5.475 461 HH2 TRP 66 HH2 TRP 66 18.199 7.869 3.194 462 H MET 67 H MET 67 15.050 16.894 5.274 463 HA MET 67 HA MET 67 15.785 17.487 7.948 464 HB2 MET 67 HB2 MET 67 14.344 18.959 5.788 465 HB3 MET 67 HB3 MET 67 14.274 19.568 7.435 466 HG2 MET 67 HG2 MET 67 16.018 20.684 6.204 467 HG3 MET 67 HG3 MET 67 16.719 19.699 7.486 468 HE1 MET 67 HE1 MET 67 18.518 20.851 5.191 469 HE2 MET 67 HE2 MET 67 19.482 19.434 4.774 470 HE3 MET 67 HE3 MET 67 19.110 19.782 6.462 471 H LEU 68 H LEU 68 12.782 16.841 6.247 472 HA LEU 68 HA LEU 68 11.615 16.303 8.878 473 HB2 LEU 68 HB2 LEU 68 9.443 17.033 8.121 474 HB3 LEU 68 HB3 LEU 68 10.608 18.316 7.925 475 HG LEU 68 HG LEU 68 10.662 17.316 5.431 476 HD11 LEU 68 HD11 LEU 68 8.356 16.769 4.755 477 HD12 LEU 68 HD12 LEU 68 7.845 16.811 6.442 478 HD13 LEU 68 HD13 LEU 68 8.989 15.585 5.897 479 HD21 LEU 68 HD21 LEU 68 8.644 19.266 6.555 480 HD22 LEU 68 HD22 LEU 68 9.077 19.111 4.853 481 HD23 LEU 68 HD23 LEU 68 10.283 19.640 6.025 482 H TRP 69 H TRP 69 13.021 14.707 6.526 483 HA TRP 69 HA TRP 69 10.982 12.595 6.577 484 HB2 TRP 69 HB2 TRP 69 12.752 12.894 4.169 485 HB3 TRP 69 HB3 TRP 69 11.228 12.033 4.312 486 HD1 TRP 69 HD1 TRP 69 12.226 15.774 4.753 487 HE1 TRP 69 HE1 TRP 69 10.535 17.218 3.508 488 HE3 TRP 69 HE3 TRP 69 9.251 12.075 2.833 489 HZ2 TRP 69 HZ2 TRP 69 8.277 16.869 1.875 490 HZ3 TRP 69 HZ3 TRP 69 7.352 12.740 1.428 491 HH2 TRP 69 HH2 TRP 69 6.872 15.084 0.959 492 H MET 70 H MET 70 11.657 10.503 6.696 493 HA MET 70 HA MET 70 14.495 9.877 6.839 494 HB2 MET 70 HB2 MET 70 12.628 9.784 9.168 495 HB3 MET 70 HB3 MET 70 13.827 8.506 9.014 496 HG2 MET 70 HG2 MET 70 15.595 10.214 8.923 497 HG3 MET 70 HG3 MET 70 14.375 11.462 9.166 498 HE1 MET 70 HE1 MET 70 16.381 11.264 12.574 499 HE2 MET 70 HE2 MET 70 15.985 12.271 11.183 500 HE3 MET 70 HE3 MET 70 17.059 10.886 10.990 501 H ALA 71 H ALA 71 11.156 8.921 6.632 502 HA ALA 71 HA ALA 71 11.749 6.122 6.157 503 HB1 ALA 71 HB1 ALA 71 9.151 7.635 6.116 504 HB2 ALA 71 HB2 ALA 71 9.767 6.626 7.426 505 HB3 ALA 71 HB3 ALA 71 9.303 5.893 5.890 506 H GLY 72 H GLY 72 11.178 8.980 4.350 507 HA2 GLY 72 HA2 GLY 72 11.872 9.194 2.081 508 HA3 GLY 72 HA3 GLY 72 11.562 7.482 1.864 509 H ASN 73 H ASN 73 9.987 7.140 0.492 510 HA ASN 73 HA ASN 73 7.987 9.083 -0.096 511 HB2 ASN 73 HB2 ASN 73 8.570 6.342 -1.170 512 HB3 ASN 73 HB3 ASN 73 7.175 7.280 -1.689 513 HD21 ASN 73 HD21 ASN 73 10.676 7.184 -1.588 514 HD22 ASN 73 HD22 ASN 73 10.926 8.238 -2.932 515 H ALA 74 H ALA 74 5.850 9.028 0.356 516 HA ALA 74 HA ALA 74 4.634 6.725 1.545 517 HB1 ALA 74 HB1 ALA 74 4.857 9.286 3.113 518 HB2 ALA 74 HB2 ALA 74 5.569 7.726 3.530 519 HB3 ALA 74 HB3 ALA 74 3.816 7.930 3.550 520 H VAL 75 H VAL 75 2.366 6.746 1.535 521 HA VAL 75 HA VAL 75 1.051 9.040 0.304 522 HB VAL 75 HB VAL 75 0.198 6.378 -0.749 523 HG11 VAL 75 HG11 VAL 75 0.437 9.005 -2.192 524 HG12 VAL 75 HG12 VAL 75 -0.949 8.589 -1.185 525 HG13 VAL 75 HG13 VAL 75 -0.566 7.613 -2.603 526 HG21 VAL 75 HG21 VAL 75 2.471 7.850 -2.053 527 HG22 VAL 75 HG22 VAL 75 1.759 6.317 -2.545 528 HG23 VAL 75 HG23 VAL 75 2.688 6.419 -1.050 529 H LEU 76 H LEU 76 -0.666 9.514 1.444 530 HA LEU 76 HA LEU 76 -2.096 7.369 2.823 531 HB2 LEU 76 HB2 LEU 76 -0.882 9.499 4.015 532 HB3 LEU 76 HB3 LEU 76 -2.519 10.065 3.879 533 HG LEU 76 HG LEU 76 -2.176 7.349 5.012 534 HD11 LEU 76 HD11 LEU 76 -1.560 8.202 7.218 535 HD12 LEU 76 HD12 LEU 76 -1.337 9.813 6.534 536 HD13 LEU 76 HD13 LEU 76 -0.285 8.488 6.033 537 HD21 LEU 76 HD21 LEU 76 -4.374 8.234 4.951 538 HD22 LEU 76 HD22 LEU 76 -3.851 9.777 5.627 539 HD23 LEU 76 HD23 LEU 76 -3.847 8.329 6.630 540 H ILE 77 H ILE 77 -4.009 7.161 2.384 541 HA ILE 77 HA ILE 77 -5.564 9.085 0.931 542 HB ILE 77 HB ILE 77 -4.855 6.330 0.017 543 HG12 ILE 77 HG12 ILE 77 -4.972 8.615 -1.846 544 HG13 ILE 77 HG13 ILE 77 -3.697 8.638 -0.633 545 HG21 ILE 77 HG21 ILE 77 -6.522 6.398 -1.750 546 HG22 ILE 77 HG22 ILE 77 -7.107 7.954 -1.159 547 HG23 ILE 77 HG23 ILE 77 -7.306 6.504 -0.174 548 HD11 ILE 77 HD11 ILE 77 -3.031 7.665 -2.823 549 HD12 ILE 77 HD12 ILE 77 -4.170 6.350 -2.528 550 HD13 ILE 77 HD13 ILE 77 -2.795 6.585 -1.448 551 H GLN 78 H GLN 78 -7.731 8.768 1.078 552 HA GLN 78 HA GLN 78 -8.698 7.180 3.262 553 HB2 GLN 78 HB2 GLN 78 -9.221 9.526 3.421 554 HB3 GLN 78 HB3 GLN 78 -9.925 9.529 1.818 555 HG2 GLN 78 HG2 GLN 78 -11.377 7.602 3.084 556 HG3 GLN 78 HG3 GLN 78 -11.100 8.756 4.377 557 HE21 GLN 78 HE21 GLN 78 -12.426 8.179 1.304 558 HE22 GLN 78 HE22 GLN 78 -13.481 9.533 1.230 559 H HIS 79 H HIS 79 -9.546 5.360 2.766 560 HA HIS 79 HA HIS 79 -10.170 4.490 0.174 561 HB2 HIS 79 HB2 HIS 79 -10.337 3.315 2.870 562 HB3 HIS 79 HB3 HIS 79 -11.305 2.566 1.603 563 HD1 HIS 79 HD1 HIS 79 -8.921 3.333 -0.542 564 HD2 HIS 79 HD2 HIS 79 -8.688 0.996 2.887 565 HE1 HIS 79 HE1 HIS 79 -6.898 1.856 -0.865 566 HE2 HIS 79 HE2 HIS 79 -6.789 0.442 1.216 567 H ALA 80 H ALA 80 -12.263 3.019 0.084 568 HA ALA 80 HA ALA 80 -14.268 4.811 -0.566 569 HB1 ALA 80 HB1 ALA 80 -14.606 1.844 -0.388 570 HB2 ALA 80 HB2 ALA 80 -13.800 2.661 -1.726 571 HB3 ALA 80 HB3 ALA 80 -15.507 2.970 -1.405 572 H ASP 81 H ASP 81 -13.681 3.290 2.393 573 HA ASP 81 HA ASP 81 -16.418 3.555 3.285 574 HB2 ASP 81 HB2 ASP 81 -14.489 1.613 3.795 575 HB3 ASP 81 HB3 ASP 81 -14.741 2.479 5.299 576 H GLY 82 H GLY 82 -13.491 5.138 3.309 577 HA2 GLY 82 HA2 GLY 82 -13.417 7.421 4.048 578 HA3 GLY 82 HA3 GLY 82 -14.431 6.968 5.407 579 H MET 83 H MET 83 -12.431 4.461 5.182 580 HA MET 83 HA MET 83 -10.873 5.144 7.365 581 HB2 MET 83 HB2 MET 83 -9.747 2.932 6.767 582 HB3 MET 83 HB3 MET 83 -11.420 2.911 7.229 583 HG2 MET 83 HG2 MET 83 -11.676 3.101 4.565 584 HG3 MET 83 HG3 MET 83 -10.145 2.233 4.671 585 HE1 MET 83 HE1 MET 83 -12.527 0.970 3.160 586 HE2 MET 83 HE2 MET 83 -12.575 -0.668 3.814 587 HE3 MET 83 HE3 MET 83 -11.029 0.097 3.454 588 H HIS 84 H HIS 84 -8.370 4.648 7.295 589 HA HIS 84 HA HIS 84 -7.359 6.261 5.111 590 HB2 HIS 84 HB2 HIS 84 -6.266 5.891 7.898 591 HB3 HIS 84 HB3 HIS 84 -5.407 6.746 6.635 592 HD1 HIS 84 HD1 HIS 84 -5.423 9.090 7.432 593 HD2 HIS 84 HD2 HIS 84 -9.170 7.327 7.771 594 HE1 HIS 84 HE1 HIS 84 -6.954 10.910 8.244 595 HE2 HIS 84 HE2 HIS 84 -9.220 9.827 8.426 596 H THR 85 H THR 85 -5.409 5.639 4.022 597 HA THR 85 HA THR 85 -4.265 3.074 4.756 598 HB THR 85 HB THR 85 -4.395 3.250 1.897 599 HG1 THR 85 HG1 THR 85 -6.536 3.341 1.524 600 HG21 THR 85 HG21 THR 85 -5.374 1.018 2.124 601 HG22 THR 85 HG22 THR 85 -5.614 1.300 3.849 602 HG23 THR 85 HG23 THR 85 -3.982 1.215 3.187 603 H GLY 86 H GLY 86 -2.173 3.209 4.745 604 HA2 GLY 86 HA2 GLY 86 -0.885 5.415 3.294 605 HA3 GLY 86 HA3 GLY 86 -0.243 4.651 4.744 606 H TYR 87 H TYR 87 1.108 5.040 2.266 607 HA TYR 87 HA TYR 87 1.823 2.319 1.652 608 HB2 TYR 87 HB2 TYR 87 1.527 4.484 -0.465 609 HB3 TYR 87 HB3 TYR 87 1.983 2.813 -0.743 610 HD1 TYR 87 HD1 TYR 87 -0.932 4.789 0.648 611 HD2 TYR 87 HD2 TYR 87 0.352 1.360 -1.559 612 HE1 TYR 87 HE1 TYR 87 -3.263 4.230 0.150 613 HE2 TYR 87 HE2 TYR 87 -2.013 0.808 -2.048 614 HH TYR 87 HH TYR 87 -4.542 2.955 -1.543 615 H ALA 88 H ALA 88 3.721 2.399 2.758 616 HA ALA 88 HA ALA 88 5.472 4.705 2.231 617 HB1 ALA 88 HB1 ALA 88 6.465 4.406 4.407 618 HB2 ALA 88 HB2 ALA 88 5.500 2.959 4.689 619 HB3 ALA 88 HB3 ALA 88 4.714 4.531 4.564 620 H HIS 89 H HIS 89 7.818 4.267 2.565 621 HA HIS 89 HA HIS 89 9.762 3.366 1.879 622 HB2 HIS 89 HB2 HIS 89 8.247 0.872 2.567 623 HB3 HIS 89 HB3 HIS 89 9.811 0.738 1.766 624 HD1 HIS 89 HD1 HIS 89 8.232 1.885 4.977 625 HD2 HIS 89 HD2 HIS 89 12.017 1.329 3.350 626 HE1 HIS 89 HE1 HIS 89 9.834 2.119 6.902 627 HE2 HIS 89 HE2 HIS 89 12.118 1.778 5.896 628 H LEU 90 H LEU 90 8.052 4.312 -0.048 629 HA LEU 90 HA LEU 90 8.410 2.616 -2.363 630 HB2 LEU 90 HB2 LEU 90 6.974 5.247 -2.313 631 HB3 LEU 90 HB3 LEU 90 6.805 3.954 -3.472 632 HG LEU 90 HG LEU 90 5.917 3.700 -0.593 633 HD11 LEU 90 HD11 LEU 90 4.724 5.540 -1.693 634 HD12 LEU 90 HD12 LEU 90 3.667 4.171 -1.361 635 HD13 LEU 90 HD13 LEU 90 4.260 4.448 -2.998 636 HD21 LEU 90 HD21 LEU 90 6.114 1.565 -1.453 637 HD22 LEU 90 HD22 LEU 90 5.581 2.051 -3.059 638 HD23 LEU 90 HD23 LEU 90 4.417 1.954 -1.740 639 H SER 91 H SER 91 9.051 3.911 -4.433 640 HA SER 91 HA SER 91 11.371 5.502 -3.756 641 HB2 SER 91 HB2 SER 91 11.764 3.360 -5.008 642 HB3 SER 91 HB3 SER 91 10.865 4.053 -6.352 643 HG SER 91 HG SER 91 12.791 5.743 -5.484 644 H LYS 92 H LYS 92 8.284 5.710 -5.112 645 HA LYS 92 HA LYS 92 8.564 8.406 -5.803 646 HB2 LYS 92 HB2 LYS 92 9.342 6.672 -7.840 647 HB3 LYS 92 HB3 LYS 92 7.711 7.161 -8.266 648 HG2 LYS 92 HG2 LYS 92 8.291 9.440 -8.291 649 HG3 LYS 92 HG3 LYS 92 9.861 9.100 -7.554 650 HD2 LYS 92 HD2 LYS 92 10.712 8.170 -9.508 651 HD3 LYS 92 HD3 LYS 92 9.103 7.816 -10.146 652 HE2 LYS 92 HE2 LYS 92 8.718 10.170 -10.562 653 HE3 LYS 92 HE3 LYS 92 10.266 10.583 -9.827 654 HZ1 LYS 92 HZ1 LYS 92 11.410 9.452 -11.586 655 HZ2 LYS 92 HZ2 LYS 92 10.322 10.546 -12.277 656 HZ3 LYS 92 HZ3 LYS 92 9.957 8.896 -12.251 657 H ILE 93 H ILE 93 6.672 9.365 -6.483 658 HA ILE 93 HA ILE 93 4.240 7.848 -6.068 659 HB ILE 93 HB ILE 93 5.169 10.299 -4.832 660 HG12 ILE 93 HG12 ILE 93 3.128 9.601 -3.307 661 HG13 ILE 93 HG13 ILE 93 3.336 8.082 -4.169 662 HG21 ILE 93 HG21 ILE 93 2.299 10.319 -5.597 663 HG22 ILE 93 HG22 ILE 93 3.548 11.284 -6.380 664 HG23 ILE 93 HG23 ILE 93 3.176 11.536 -4.675 665 HD11 ILE 93 HD11 ILE 93 5.208 9.463 -2.292 666 HD12 ILE 93 HD12 ILE 93 5.827 8.324 -3.487 667 HD13 ILE 93 HD13 ILE 93 4.654 7.789 -2.286 668 H SER 94 H SER 94 2.477 8.358 -7.279 669 HA SER 94 HA SER 94 2.939 9.873 -9.714 670 HB2 SER 94 HB2 SER 94 2.360 7.322 -9.661 671 HB3 SER 94 HB3 SER 94 0.729 7.920 -9.340 672 HG SER 94 HG SER 94 1.459 7.555 -11.641 673 H VAL 95 H VAL 95 1.431 10.010 -6.784 674 HA VAL 95 HA VAL 95 -0.852 11.382 -7.757 675 HB VAL 95 HB VAL 95 -1.451 11.108 -5.184 676 HG11 VAL 95 HG11 VAL 95 -1.868 9.009 -7.297 677 HG12 VAL 95 HG12 VAL 95 -2.851 10.454 -7.062 678 HG13 VAL 95 HG13 VAL 95 -2.828 9.193 -5.830 679 HG21 VAL 95 HG21 VAL 95 0.392 9.897 -4.391 680 HG22 VAL 95 HG22 VAL 95 0.400 8.833 -5.796 681 HG23 VAL 95 HG23 VAL 95 -0.882 8.695 -4.593 682 H SER 96 H SER 96 -1.613 12.836 -5.658 683 HA SER 96 HA SER 96 0.429 14.545 -4.707 684 HB2 SER 96 HB2 SER 96 -1.603 15.624 -6.679 685 HB3 SER 96 HB3 SER 96 -0.515 16.617 -5.711 686 HG SER 96 HG SER 96 0.103 15.998 -7.983 687 H THR 97 H THR 97 -0.235 15.731 -3.001 688 HA THR 97 HA THR 97 -2.264 14.774 -1.407 689 HB THR 97 HB THR 97 -1.206 17.573 -1.154 690 HG1 THR 97 HG1 THR 97 0.716 16.674 -1.200 691 HG21 THR 97 HG21 THR 97 -1.487 17.299 1.173 692 HG22 THR 97 HG22 THR 97 -1.635 15.549 1.032 693 HG23 THR 97 HG23 THR 97 -2.937 16.593 0.461 694 H ASP 98 H ASP 98 -4.395 15.068 -1.373 695 HA ASP 98 HA ASP 98 -6.424 16.140 -1.309 696 HB2 ASP 98 HB2 ASP 98 -5.014 18.390 -1.402 697 HB3 ASP 98 HB3 ASP 98 -5.624 18.431 -3.053 698 H SER 99 H SER 99 -4.671 15.025 -3.898 699 HA SER 99 HA SER 99 -6.633 15.395 -5.935 700 HB2 SER 99 HB2 SER 99 -4.233 13.568 -5.832 701 HB3 SER 99 HB3 SER 99 -5.191 13.919 -7.271 702 HG SER 99 HG SER 99 -3.292 15.465 -5.982 703 H THR 100 H THR 100 -8.035 13.838 -6.740 704 HA THR 100 HA THR 100 -8.811 11.793 -4.926 705 HB THR 100 HB THR 100 -10.501 11.262 -6.784 706 HG1 THR 100 HG1 THR 100 -9.212 13.549 -7.763 707 HG21 THR 100 HG21 THR 100 -11.076 12.347 -4.701 708 HG22 THR 100 HG22 THR 100 -11.940 13.115 -6.036 709 HG23 THR 100 HG23 THR 100 -10.524 13.900 -5.333 710 H VAL 101 H VAL 101 -8.843 9.595 -5.293 711 HA VAL 101 HA VAL 101 -7.208 8.677 -7.478 712 HB VAL 101 HB VAL 101 -6.808 6.751 -5.666 713 HG11 VAL 101 HG11 VAL 101 -4.577 7.722 -5.340 714 HG12 VAL 101 HG12 VAL 101 -5.160 9.227 -6.053 715 HG13 VAL 101 HG13 VAL 101 -5.103 7.755 -7.024 716 HG21 VAL 101 HG21 VAL 101 -6.158 7.808 -3.532 717 HG22 VAL 101 HG22 VAL 101 -7.894 7.846 -3.830 718 HG23 VAL 101 HG23 VAL 101 -6.926 9.297 -4.076 719 H LYS 102 H LYS 102 -7.408 6.308 -7.837 720 HA LYS 102 HA LYS 102 -9.972 5.187 -7.351 721 HB2 LYS 102 HB2 LYS 102 -9.901 6.463 -9.538 722 HB3 LYS 102 HB3 LYS 102 -8.804 5.206 -10.050 723 HG2 LYS 102 HG2 LYS 102 -10.617 3.550 -9.478 724 HG3 LYS 102 HG3 LYS 102 -11.688 4.934 -9.274 725 HD2 LYS 102 HD2 LYS 102 -11.260 5.602 -11.594 726 HD3 LYS 102 HD3 LYS 102 -10.209 4.198 -11.799 727 HE2 LYS 102 HE2 LYS 102 -12.110 2.724 -11.304 728 HE3 LYS 102 HE3 LYS 102 -13.155 4.135 -11.146 729 HZ1 LYS 102 HZ1 LYS 102 -12.757 4.666 -13.453 730 HZ2 LYS 102 HZ2 LYS 102 -13.337 3.083 -13.328 731 HZ3 LYS 102 HZ3 LYS 102 -11.693 3.359 -13.613 732 H GLN 103 H GLN 103 -10.056 3.044 -7.381 733 HA GLN 103 HA GLN 103 -7.902 1.616 -6.489 734 HB2 GLN 103 HB2 GLN 103 -10.418 1.140 -6.299 735 HB3 GLN 103 HB3 GLN 103 -10.246 0.346 -7.850 736 HG2 GLN 103 HG2 GLN 103 -8.387 -0.505 -5.718 737 HG3 GLN 103 HG3 GLN 103 -10.077 -0.967 -5.542 738 HE21 GLN 103 HE21 GLN 103 -8.773 -0.533 -8.667 739 HE22 GLN 103 HE22 GLN 103 -8.662 -2.177 -9.077 740 H GLY 104 H GLY 104 -6.490 0.262 -7.356 741 HA2 GLY 104 HA2 GLY 104 -5.211 -0.888 -8.865 742 HA3 GLY 104 HA3 GLY 104 -6.459 -0.649 -10.024 743 H GLN 105 H GLN 105 -5.945 2.357 -9.106 744 HA GLN 105 HA GLN 105 -4.426 3.057 -11.400 745 HB2 GLN 105 HB2 GLN 105 -6.282 4.412 -10.435 746 HB3 GLN 105 HB3 GLN 105 -5.266 4.767 -9.057 747 HG2 GLN 105 HG2 GLN 105 -3.776 6.055 -10.425 748 HG3 GLN 105 HG3 GLN 105 -4.630 5.560 -11.893 749 HE21 GLN 105 HE21 GLN 105 -5.013 7.266 -8.838 750 HE22 GLN 105 HE22 GLN 105 -6.275 8.312 -9.366 751 H ILE 106 H ILE 106 -2.418 3.751 -11.575 752 HA ILE 106 HA ILE 106 -0.603 2.835 -9.668 753 HB ILE 106 HB ILE 106 -0.127 4.343 -12.171 754 HG12 ILE 106 HG12 ILE 106 0.627 1.485 -11.671 755 HG13 ILE 106 HG13 ILE 106 -1.023 1.895 -12.119 756 HG21 ILE 106 HG21 ILE 106 2.260 3.747 -11.967 757 HG22 ILE 106 HG22 ILE 106 1.929 3.065 -10.375 758 HG23 ILE 106 HG23 ILE 106 1.729 4.795 -10.652 759 HD11 ILE 106 HD11 ILE 106 1.481 2.283 -13.733 760 HD12 ILE 106 HD12 ILE 106 -0.070 3.002 -14.169 761 HD13 ILE 106 HD13 ILE 106 0.100 1.247 -14.096 762 H ILE 107 H ILE 107 -0.620 3.835 -7.840 763 HA ILE 107 HA ILE 107 -0.683 6.675 -7.650 764 HB ILE 107 HB ILE 107 -0.667 6.076 -5.136 765 HG12 ILE 107 HG12 ILE 107 -2.000 3.546 -5.809 766 HG13 ILE 107 HG13 ILE 107 -0.254 3.530 -6.035 767 HG21 ILE 107 HG21 ILE 107 -2.566 7.004 -6.384 768 HG22 ILE 107 HG22 ILE 107 -3.076 5.854 -5.151 769 HG23 ILE 107 HG23 ILE 107 -3.034 5.369 -6.846 770 HD11 ILE 107 HD11 ILE 107 -1.213 2.788 -3.777 771 HD12 ILE 107 HD12 ILE 107 -1.467 4.509 -3.480 772 HD13 ILE 107 HD13 ILE 107 0.160 3.896 -3.777 773 H GLY 108 H GLY 108 1.760 4.418 -7.893 774 HA2 GLY 108 HA2 GLY 108 3.839 6.176 -7.585 775 HA3 GLY 108 HA3 GLY 108 3.632 5.388 -6.029 776 H TYR 109 H TYR 109 5.737 4.644 -6.414 777 HA TYR 109 HA TYR 109 5.888 2.108 -7.738 778 HB2 TYR 109 HB2 TYR 109 8.123 4.139 -7.972 779 HB3 TYR 109 HB3 TYR 109 8.063 2.548 -8.716 780 HD1 TYR 109 HD1 TYR 109 7.121 2.267 -10.872 781 HD2 TYR 109 HD2 TYR 109 6.517 5.908 -8.769 782 HE1 TYR 109 HE1 TYR 109 6.185 3.280 -12.910 783 HE2 TYR 109 HE2 TYR 109 5.578 6.938 -10.798 784 HH TYR 109 HH TYR 109 5.643 6.631 -13.216 785 H THR 110 H THR 110 7.023 0.641 -6.574 786 HA THR 110 HA THR 110 7.411 1.017 -3.840 787 HB THR 110 HB THR 110 8.802 -1.205 -4.215 788 HG1 THR 110 HG1 THR 110 7.179 -1.767 -6.299 789 HG21 THR 110 HG21 THR 110 5.826 -0.899 -4.458 790 HG22 THR 110 HG22 THR 110 6.753 -1.184 -2.989 791 HG23 THR 110 HG23 THR 110 6.627 -2.446 -4.212 792 H GLY 111 H GLY 111 9.337 0.988 -2.511 793 HA2 GLY 111 HA2 GLY 111 11.897 1.264 -3.848 794 HA3 GLY 111 HA3 GLY 111 11.314 2.724 -3.073 795 H ALA 112 H ALA 112 13.281 2.557 -1.891 796 HA ALA 112 HA ALA 112 12.864 1.216 0.588 797 HB1 ALA 112 HB1 ALA 112 14.731 -0.147 0.625 798 HB2 ALA 112 HB2 ALA 112 15.616 0.875 -0.506 799 HB3 ALA 112 HB3 ALA 112 14.357 -0.202 -1.100 800 H THR 113 H THR 113 12.557 3.820 0.146 801 HA THR 113 HA THR 113 14.970 5.345 0.480 802 HB THR 113 HB THR 113 13.388 7.298 0.678 803 HG1 THR 113 HG1 THR 113 11.261 5.937 -0.331 804 HG21 THR 113 HG21 THR 113 12.789 7.299 -1.664 805 HG22 THR 113 HG22 THR 113 12.960 5.546 -1.746 806 HG23 THR 113 HG23 THR 113 14.380 6.560 -1.478 807 H GLY 114 H GLY 114 13.406 3.516 2.673 808 HA2 GLY 114 HA2 GLY 114 13.578 5.412 4.907 809 HA3 GLY 114 HA3 GLY 114 12.894 3.792 4.975 810 H GLN 115 H GLN 115 14.184 2.062 5.435 811 HA GLN 115 HA GLN 115 16.903 2.659 6.374 812 HB2 GLN 115 HB2 GLN 115 14.929 1.258 7.584 813 HB3 GLN 115 HB3 GLN 115 15.740 -0.049 6.734 814 HG2 GLN 115 HG2 GLN 115 17.859 0.604 7.805 815 HG3 GLN 115 HG3 GLN 115 16.996 1.853 8.700 816 HE21 GLN 115 HE21 GLN 115 17.571 -1.549 8.348 817 HE22 GLN 115 HE22 GLN 115 16.830 -2.038 9.830 818 H VAL 116 H VAL 116 18.725 1.564 5.551 819 HA VAL 116 HA VAL 116 18.293 0.400 2.921 820 HB VAL 116 HB VAL 116 20.855 0.470 2.766 821 HG11 VAL 116 HG11 VAL 116 20.823 2.883 2.210 822 HG12 VAL 116 HG12 VAL 116 19.233 3.001 2.964 823 HG13 VAL 116 HG13 VAL 116 19.460 1.987 1.538 824 HG21 VAL 116 HG21 VAL 116 21.412 0.759 5.109 825 HG22 VAL 116 HG22 VAL 116 20.485 2.258 5.175 826 HG23 VAL 116 HG23 VAL 116 21.949 2.170 4.197 827 H THR 117 H THR 117 17.633 -1.586 3.113 828 HA THR 117 HA THR 117 19.536 -3.605 4.002 829 HB THR 117 HB THR 117 17.715 -4.898 5.167 830 HG1 THR 117 HG1 THR 117 15.956 -3.650 4.253 831 HG21 THR 117 HG21 THR 117 18.520 -2.224 6.309 832 HG22 THR 117 HG22 THR 117 19.327 -3.778 6.540 833 HG23 THR 117 HG23 THR 117 17.736 -3.497 7.249 834 H GLY 118 H GLY 118 16.257 -3.063 2.765 835 HA2 GLY 118 HA2 GLY 118 16.754 -4.336 0.273 836 HA3 GLY 118 HA3 GLY 118 15.830 -5.381 1.339 837 HA PRO 119 HA PRO 119 13.138 -1.779 -0.542 838 HB2 PRO 119 HB2 PRO 119 12.584 -3.280 -2.982 839 HB3 PRO 119 HB3 PRO 119 13.140 -1.618 -2.807 840 HG2 PRO 119 HG2 PRO 119 14.718 -3.564 -3.806 841 HG3 PRO 119 HG3 PRO 119 15.352 -2.179 -2.896 842 HD2 PRO 119 HD2 PRO 119 14.896 -4.987 -1.983 843 HD3 PRO 119 HD3 PRO 119 16.233 -3.877 -1.621 844 H HIS 120 H HIS 120 10.928 -1.875 -0.147 845 HA HIS 120 HA HIS 120 9.464 -4.249 -0.514 846 HB2 HIS 120 HB2 HIS 120 8.849 -4.612 1.870 847 HB3 HIS 120 HB3 HIS 120 10.564 -4.865 1.586 848 HD1 HIS 120 HD1 HIS 120 12.190 -2.975 2.475 849 HD2 HIS 120 HD2 HIS 120 8.242 -2.686 3.738 850 HE1 HIS 120 HE1 HIS 120 12.226 -1.386 4.423 851 HE2 HIS 120 HE2 HIS 120 9.825 -1.226 5.176 852 H LEU 121 H LEU 121 7.373 -3.848 1.060 853 HA LEU 121 HA LEU 121 6.298 -1.316 0.292 854 HB2 LEU 121 HB2 LEU 121 5.330 -2.664 -1.292 855 HB3 LEU 121 HB3 LEU 121 5.277 -4.054 -0.249 856 HG LEU 121 HG LEU 121 3.379 -2.852 0.984 857 HD11 LEU 121 HD11 LEU 121 3.412 -1.201 -1.542 858 HD12 LEU 121 HD12 LEU 121 3.722 -0.613 0.092 859 HD13 LEU 121 HD13 LEU 121 2.121 -1.214 -0.341 860 HD21 LEU 121 HD21 LEU 121 2.944 -3.686 -1.878 861 HD22 LEU 121 HD22 LEU 121 1.723 -3.639 -0.606 862 HD23 LEU 121 HD23 LEU 121 3.066 -4.776 -0.497 863 H HIS 122 H HIS 122 5.018 -0.375 1.670 864 HA HIS 122 HA HIS 122 4.461 -1.634 4.184 865 HB2 HIS 122 HB2 HIS 122 6.096 0.094 4.609 866 HB3 HIS 122 HB3 HIS 122 5.204 1.240 3.621 867 HD2 HIS 122 HD2 HIS 122 2.788 2.211 4.839 868 HE1 HIS 122 HE1 HIS 122 3.909 0.981 8.729 869 HE2 HIS 122 HE2 HIS 122 2.295 2.377 7.376 870 H PHE 123 H PHE 123 2.415 -1.775 4.675 871 HA PHE 123 HA PHE 123 0.466 0.009 3.419 872 HB2 PHE 123 HB2 PHE 123 0.579 -2.283 2.325 873 HB3 PHE 123 HB3 PHE 123 0.038 -2.955 3.854 874 HD1 PHE 123 HD1 PHE 123 -0.937 -0.829 1.004 875 HD2 PHE 123 HD2 PHE 123 -2.248 -2.895 4.486 876 HE1 PHE 123 HE1 PHE 123 -3.275 -0.508 0.312 877 HE2 PHE 123 HE2 PHE 123 -4.588 -2.582 3.796 878 HZ PHE 123 HZ PHE 123 -5.102 -1.387 1.706 879 H GLU 124 H GLU 124 -0.356 1.139 5.046 880 HA GLU 124 HA GLU 124 -1.066 -0.151 7.524 881 HB2 GLU 124 HB2 GLU 124 0.832 1.645 7.445 882 HB3 GLU 124 HB3 GLU 124 -0.494 2.788 7.295 883 HG2 GLU 124 HG2 GLU 124 -1.413 1.904 9.428 884 HG3 GLU 124 HG3 GLU 124 0.023 0.898 9.581 885 H MET 125 H MET 125 -3.109 -0.103 7.985 886 HA MET 125 HA MET 125 -4.917 1.694 6.671 887 HB2 MET 125 HB2 MET 125 -5.582 -0.253 5.716 888 HB3 MET 125 HB3 MET 125 -4.947 -1.185 7.029 889 HG2 MET 125 HG2 MET 125 -7.328 -1.475 6.894 890 HG3 MET 125 HG3 MET 125 -6.893 -0.663 8.388 891 HE1 MET 125 HE1 MET 125 -9.848 -0.708 7.497 892 HE2 MET 125 HE2 MET 125 -10.302 0.976 7.751 893 HE3 MET 125 HE3 MET 125 -9.240 0.167 8.900 894 H LEU 126 H LEU 126 -6.345 2.650 7.840 895 HA LEU 126 HA LEU 126 -6.605 2.114 10.662 896 HB2 LEU 126 HB2 LEU 126 -5.415 4.553 9.413 897 HB3 LEU 126 HB3 LEU 126 -6.445 4.803 10.801 898 HG LEU 126 HG LEU 126 -4.805 2.922 11.802 899 HD11 LEU 126 HD11 LEU 126 -3.121 4.480 9.847 900 HD12 LEU 126 HD12 LEU 126 -3.495 2.760 9.743 901 HD13 LEU 126 HD13 LEU 126 -2.524 3.373 11.082 902 HD21 LEU 126 HD21 LEU 126 -3.584 4.766 12.843 903 HD22 LEU 126 HD22 LEU 126 -5.320 5.066 12.801 904 HD23 LEU 126 HD23 LEU 126 -4.259 5.878 11.652 905 HA PRO 127 HA PRO 127 -10.908 3.406 10.072 906 HB2 PRO 127 HB2 PRO 127 -11.251 5.253 12.071 907 HB3 PRO 127 HB3 PRO 127 -11.420 3.528 12.306 908 HG2 PRO 127 HG2 PRO 127 -9.126 5.292 12.929 909 HG3 PRO 127 HG3 PRO 127 -9.734 3.885 13.830 910 HD2 PRO 127 HD2 PRO 127 -7.539 3.724 12.333 911 HD3 PRO 127 HD3 PRO 127 -8.685 2.383 12.420 912 H ALA 128 H ALA 128 -12.338 5.441 10.034 913 HA ALA 128 HA ALA 128 -11.241 7.322 8.284 914 HB1 ALA 128 HB1 ALA 128 -13.636 6.724 8.309 915 HB2 ALA 128 HB2 ALA 128 -13.385 8.465 8.450 916 HB3 ALA 128 HB3 ALA 128 -13.781 7.512 9.881 917 H ASN 129 H ASN 129 -11.534 7.018 11.660 918 HA ASN 129 HA ASN 129 -9.874 9.218 12.304 919 HB2 ASN 129 HB2 ASN 129 -12.777 9.359 13.178 920 HB3 ASN 129 HB3 ASN 129 -11.490 10.276 13.953 921 HD21 ASN 129 HD21 ASN 129 -10.237 11.713 12.513 922 HD22 ASN 129 HD22 ASN 129 -11.082 12.530 11.250 923 HA PRO 130 HA PRO 130 -9.089 5.845 14.842 924 HB2 PRO 130 HB2 PRO 130 -6.630 7.140 15.674 925 HB3 PRO 130 HB3 PRO 130 -6.861 5.669 14.716 926 HG2 PRO 130 HG2 PRO 130 -5.985 8.032 13.636 927 HG3 PRO 130 HG3 PRO 130 -6.791 6.767 12.710 928 HD2 PRO 130 HD2 PRO 130 -7.840 9.340 13.750 929 HD3 PRO 130 HD3 PRO 130 -8.229 8.465 12.255 930 H ASN 131 H ASN 131 -8.528 5.309 16.923 931 HA ASN 131 HA ASN 131 -9.139 7.259 18.976 932 HB2 ASN 131 HB2 ASN 131 -10.615 5.082 18.330 933 HB3 ASN 131 HB3 ASN 131 -9.515 4.428 19.526 934 HD21 ASN 131 HD21 ASN 131 -12.084 6.586 18.861 935 HD22 ASN 131 HD22 ASN 131 -12.506 6.927 20.488 936 H TRP 132 H TRP 132 -6.829 7.617 18.642 937 HA TRP 132 HA TRP 132 -4.847 5.739 19.158 938 HB2 TRP 132 HB2 TRP 132 -4.521 8.676 19.751 939 HB3 TRP 132 HB3 TRP 132 -3.296 7.540 19.206 940 HD1 TRP 132 HD1 TRP 132 -3.536 6.722 16.584 941 HE1 TRP 132 HE1 TRP 132 -4.343 8.056 14.535 942 HE3 TRP 132 HE3 TRP 132 -6.109 10.437 18.978 943 HZ2 TRP 132 HZ2 TRP 132 -5.859 10.321 14.005 944 HZ3 TRP 132 HZ3 TRP 132 -7.219 12.159 17.610 945 HH2 TRP 132 HH2 TRP 132 -7.097 12.104 15.170 946 H GLN 133 H GLN 133 -7.080 6.264 21.219 947 HA GLN 133 HA GLN 133 -5.768 6.995 23.613 948 HB2 GLN 133 HB2 GLN 133 -8.517 5.994 22.962 949 HB3 GLN 133 HB3 GLN 133 -7.984 6.412 24.564 950 HG2 GLN 133 HG2 GLN 133 -9.058 8.353 23.906 951 HG3 GLN 133 HG3 GLN 133 -7.376 8.709 23.516 952 HE21 GLN 133 HE21 GLN 133 -6.708 8.347 21.277 953 HE22 GLN 133 HE22 GLN 133 -7.833 8.561 19.994 954 H ASN 134 H ASN 134 -4.771 4.729 22.291 955 HA ASN 134 HA ASN 134 -3.649 2.847 22.747 956 HB2 ASN 134 HB2 ASN 134 -4.818 3.247 25.499 957 HB3 ASN 134 HB3 ASN 134 -3.806 1.862 25.096 958 HD21 ASN 134 HD21 ASN 134 -3.910 5.374 25.102 959 HD22 ASN 134 HD22 ASN 134 -2.214 5.607 25.306 960 H GLY 135 H GLY 135 -4.078 0.961 21.979 961 HA2 GLY 135 HA2 GLY 135 -5.745 -0.986 22.682 962 HA3 GLY 135 HA3 GLY 135 -6.845 0.138 21.902 963 H PHE 136 H PHE 136 -5.448 1.034 19.738 964 HA PHE 136 HA PHE 136 -4.307 -1.206 18.306 965 HB2 PHE 136 HB2 PHE 136 -5.994 -0.699 16.358 966 HB3 PHE 136 HB3 PHE 136 -6.417 -1.828 17.628 967 HD1 PHE 136 HD1 PHE 136 -6.575 1.900 18.016 968 HD2 PHE 136 HD2 PHE 136 -8.738 -1.725 17.385 969 HE1 PHE 136 HE1 PHE 136 -8.677 3.087 18.357 970 HE2 PHE 136 HE2 PHE 136 -10.847 -0.523 17.757 971 HZ PHE 136 HZ PHE 136 -10.821 1.888 18.246 972 H SER 137 H SER 137 -4.926 2.100 18.648 973 HA SER 137 HA SER 137 -3.974 3.998 17.894 974 HB2 SER 137 HB2 SER 137 -1.782 2.813 18.151 975 HB3 SER 137 HB3 SER 137 -1.929 2.259 16.487 976 HG SER 137 HG SER 137 -2.217 4.985 16.893 977 H GLY 138 H GLY 138 -5.834 2.185 16.576 978 HA2 GLY 138 HA2 GLY 138 -7.355 2.494 14.900 979 HA3 GLY 138 HA3 GLY 138 -6.346 3.768 14.251 980 H ARG 139 H ARG 139 -4.105 1.518 14.539 981 HA ARG 139 HA ARG 139 -4.479 0.729 11.784 982 HB2 ARG 139 HB2 ARG 139 -2.211 -0.445 12.101 983 HB3 ARG 139 HB3 ARG 139 -2.268 1.304 12.072 984 HG2 ARG 139 HG2 ARG 139 -0.819 0.877 13.792 985 HG3 ARG 139 HG3 ARG 139 -2.335 1.107 14.651 986 HD2 ARG 139 HD2 ARG 139 -2.575 -1.220 15.012 987 HD3 ARG 139 HD3 ARG 139 -1.307 -1.604 13.853 988 HE ARG 139 HE ARG 139 0.198 -0.385 15.518 989 HH11 ARG 139 HH11 ARG 139 -2.649 -2.237 16.492 990 HH12 ARG 139 HH12 ARG 139 -1.973 -2.606 18.120 991 HH21 ARG 139 HH21 ARG 139 0.085 -1.829 18.713 992 HH22 ARG 139 HH22 ARG 139 1.056 -0.840 17.563 993 H ILE 140 H ILE 140 -5.278 -1.081 11.031 994 HA ILE 140 HA ILE 140 -5.326 -3.398 12.789 995 HB ILE 140 HB ILE 140 -7.515 -3.433 10.916 996 HG12 ILE 140 HG12 ILE 140 -8.797 -1.907 12.734 997 HG13 ILE 140 HG13 ILE 140 -7.224 -1.119 12.750 998 HG21 ILE 140 HG21 ILE 140 -7.234 -5.070 12.677 999 HG22 ILE 140 HG22 ILE 140 -8.747 -4.188 12.886 1000 HG23 ILE 140 HG23 ILE 140 -7.354 -3.796 13.893 1001 HD11 ILE 140 HD11 ILE 140 -7.405 -0.434 10.557 1002 HD12 ILE 140 HD12 ILE 140 -9.054 -0.261 11.158 1003 HD13 ILE 140 HD13 ILE 140 -8.617 -1.654 10.168 1004 H ASP 141 H ASP 141 -6.357 -5.321 11.202 1005 HA ASP 141 HA ASP 141 -4.080 -6.091 9.708 1006 HB2 ASP 141 HB2 ASP 141 -5.753 -7.484 11.169 1007 HB3 ASP 141 HB3 ASP 141 -6.616 -7.653 9.645 1008 HA PRO 142 HA PRO 142 -5.604 -4.866 5.621 1009 HB2 PRO 142 HB2 PRO 142 -3.559 -6.342 4.294 1010 HB3 PRO 142 HB3 PRO 142 -3.616 -4.608 4.602 1011 HG2 PRO 142 HG2 PRO 142 -1.834 -6.395 5.750 1012 HG3 PRO 142 HG3 PRO 142 -2.175 -4.756 6.329 1013 HD2 PRO 142 HD2 PRO 142 -3.113 -7.361 7.374 1014 HD3 PRO 142 HD3 PRO 142 -2.831 -5.827 8.217 1015 H THR 143 H THR 143 -5.743 -7.939 6.885 1016 HA THR 143 HA THR 143 -5.994 -9.749 4.864 1017 HB THR 143 HB THR 143 -7.797 -10.734 6.548 1018 HG1 THR 143 HG1 THR 143 -7.494 -9.960 8.613 1019 HG21 THR 143 HG21 THR 143 -5.940 -11.759 7.789 1020 HG22 THR 143 HG22 THR 143 -4.842 -10.574 7.084 1021 HG23 THR 143 HG23 THR 143 -5.648 -11.751 6.049 1022 H GLY 144 H GLY 144 -8.173 -7.243 5.648 1023 HA2 GLY 144 HA2 GLY 144 -10.551 -8.361 4.479 1024 HA3 GLY 144 HA3 GLY 144 -10.302 -6.678 4.923 1025 H TYR 145 H TYR 145 -7.842 -6.527 3.326 1026 HA TYR 145 HA TYR 145 -9.038 -6.098 0.734 1027 HB2 TYR 145 HB2 TYR 145 -6.325 -5.118 1.590 1028 HB3 TYR 145 HB3 TYR 145 -7.316 -4.527 0.267 1029 HD1 TYR 145 HD1 TYR 145 -7.081 -4.677 3.956 1030 HD2 TYR 145 HD2 TYR 145 -8.811 -2.739 0.595 1031 HE1 TYR 145 HE1 TYR 145 -7.948 -2.924 5.430 1032 HE2 TYR 145 HE2 TYR 145 -9.686 -0.972 2.059 1033 HH TYR 145 HH TYR 145 -8.652 -0.561 5.255 1034 H ILE 146 H ILE 146 -7.038 -8.266 2.312 1035 HA ILE 146 HA ILE 146 -5.561 -9.003 -0.049 1036 HB ILE 146 HB ILE 146 -5.215 -10.087 2.742 1037 HG12 ILE 146 HG12 ILE 146 -4.706 -7.723 2.833 1038 HG13 ILE 146 HG13 ILE 146 -3.203 -8.624 2.919 1039 HG21 ILE 146 HG21 ILE 146 -3.403 -10.310 0.345 1040 HG22 ILE 146 HG22 ILE 146 -4.301 -11.607 1.128 1041 HG23 ILE 146 HG23 ILE 146 -2.981 -10.815 1.981 1042 HD11 ILE 146 HD11 ILE 146 -4.276 -7.131 0.524 1043 HD12 ILE 146 HD12 ILE 146 -2.806 -8.105 0.526 1044 HD13 ILE 146 HD13 ILE 146 -2.911 -6.668 1.542 1045 H ALA 147 H ALA 147 -8.334 -9.808 1.600 1046 HA ALA 147 HA ALA 147 -8.499 -12.590 1.103 1047 HB1 ALA 147 HB1 ALA 147 -10.697 -10.626 1.630 1048 HB2 ALA 147 HB2 ALA 147 -9.770 -11.471 2.869 1049 HB3 ALA 147 HB3 ALA 147 -10.810 -12.379 1.771 1050 H ASN 148 H ASN 148 -9.108 -9.785 -0.763 1051 HA ASN 148 HA ASN 148 -10.554 -11.219 -2.773 1052 HB2 ASN 148 HB2 ASN 148 -9.993 -8.300 -2.952 1053 HB3 ASN 148 HB3 ASN 148 -11.413 -9.178 -3.422 1054 HD21 ASN 148 HD21 ASN 148 -9.708 -7.787 -0.808 1055 HD22 ASN 148 HD22 ASN 148 -11.020 -7.704 0.309 1056 H ALA 149 H ALA 149 -7.616 -11.098 -1.979 1057 HA ALA 149 HA ALA 149 -6.462 -10.235 -4.413 1058 HB1 ALA 149 HB1 ALA 149 -4.793 -11.269 -2.210 1059 HB2 ALA 149 HB2 ALA 149 -5.713 -9.793 -1.924 1060 HB3 ALA 149 HB3 ALA 149 -4.545 -9.861 -3.246 1061 HA PRO 150 HA PRO 150 -5.600 -14.145 -6.365 1062 HB2 PRO 150 HB2 PRO 150 -2.719 -13.364 -6.348 1063 HB3 PRO 150 HB3 PRO 150 -3.739 -13.882 -7.700 1064 HG2 PRO 150 HG2 PRO 150 -3.133 -11.346 -7.453 1065 HG3 PRO 150 HG3 PRO 150 -4.786 -11.829 -7.884 1066 HD2 PRO 150 HD2 PRO 150 -3.738 -10.893 -5.236 1067 HD3 PRO 150 HD3 PRO 150 -5.268 -10.504 -6.038 1068 H VAL 151 H VAL 151 -3.921 -15.977 -6.382 1069 HA VAL 151 HA VAL 151 -3.552 -16.906 -3.658 1070 HB VAL 151 HB VAL 151 -3.902 -18.453 -6.175 1071 HG11 VAL 151 HG11 VAL 151 -2.339 -19.473 -4.456 1072 HG12 VAL 151 HG12 VAL 151 -3.703 -20.468 -4.987 1073 HG13 VAL 151 HG13 VAL 151 -3.770 -19.644 -3.429 1074 HG21 VAL 151 HG21 VAL 151 -5.713 -18.286 -3.783 1075 HG22 VAL 151 HG22 VAL 151 -6.024 -19.162 -5.282 1076 HG23 VAL 151 HG23 VAL 151 -5.952 -17.398 -5.289 1077 H PHE 152 H PHE 152 -1.682 -17.477 -2.978 1078 HA PHE 152 HA PHE 152 0.688 -17.235 -4.673 1079 HB2 PHE 152 HB2 PHE 152 0.736 -15.750 -2.768 1080 HB3 PHE 152 HB3 PHE 152 0.284 -17.039 -1.669 1081 HD1 PHE 152 HD1 PHE 152 1.918 -18.677 -0.949 1082 HD2 PHE 152 HD2 PHE 152 3.018 -15.455 -3.489 1083 HE1 PHE 152 HE1 PHE 152 4.293 -19.098 -0.446 1084 HE2 PHE 152 HE2 PHE 152 5.392 -15.867 -2.999 1085 HZ PHE 152 HZ PHE 152 6.033 -17.692 -1.475 1086 H ASN 153 H ASN 153 0.865 -19.174 -5.628 1087 HA ASN 153 HA ASN 153 1.527 -21.305 -5.976 1088 HB2 ASN 153 HB2 ASN 153 2.418 -20.952 -3.153 1089 HB3 ASN 153 HB3 ASN 153 2.422 -22.574 -3.840 1090 HD21 ASN 153 HD21 ASN 153 3.598 -19.297 -4.314 1091 HD22 ASN 153 HD22 ASN 153 5.021 -19.735 -5.191 1092 H GLY 154 H GLY 154 -0.644 -20.871 -3.230 1093 HA2 GLY 154 HA2 GLY 154 -2.811 -22.155 -3.723 1094 HA3 GLY 154 HA3 GLY 154 -1.762 -23.564 -3.719 1095 H THR 155 H THR 155 -3.536 -21.341 -1.820 1096 HA THR 155 HA THR 155 -2.391 -22.205 0.685 1097 HB THR 155 HB THR 155 -4.063 -20.503 1.565 1098 HG1 THR 155 HG1 THR 155 -5.140 -19.271 0.171 1099 HG21 THR 155 HG21 THR 155 -1.848 -19.639 -0.271 1100 HG22 THR 155 HG22 THR 155 -1.721 -19.965 1.458 1101 HG23 THR 155 HG23 THR 155 -2.643 -18.572 0.888 1102 H THR 156 H THR 156 -3.135 -24.119 1.251 1103 HA THR 156 HA THR 156 -5.944 -24.831 0.942 1104 HB THR 156 HB THR 156 -5.172 -27.056 1.941 1105 HG1 THR 156 HG1 THR 156 -2.696 -27.109 1.360 1106 HG21 THR 156 HG21 THR 156 -5.578 -26.845 -0.430 1107 HG22 THR 156 HG22 THR 156 -4.111 -27.791 -0.179 1108 HG23 THR 156 HG23 THR 156 -3.998 -26.100 -0.671 1109 HA PRO 157 HA PRO 157 -6.758 -24.042 5.247 1110 HB2 PRO 157 HB2 PRO 157 -9.051 -25.664 5.475 1111 HB3 PRO 157 HB3 PRO 157 -9.008 -23.951 5.045 1112 HG2 PRO 157 HG2 PRO 157 -9.765 -26.040 3.352 1113 HG3 PRO 157 HG3 PRO 157 -9.371 -24.383 2.861 1114 HD2 PRO 157 HD2 PRO 157 -7.692 -26.831 2.744 1115 HD3 PRO 157 HD3 PRO 157 -7.727 -25.426 1.666 1116 H THR 158 H THR 158 -7.152 -27.399 4.403 1117 HA THR 158 HA THR 158 -5.464 -28.333 6.471 1118 HB THR 158 HB THR 158 -7.396 -28.088 7.867 1119 HG1 THR 158 HG1 THR 158 -6.313 -29.931 8.390 1120 HG21 THR 158 HG21 THR 158 -9.033 -29.911 6.146 1121 HG22 THR 158 HG22 THR 158 -9.119 -28.157 6.020 1122 HG23 THR 158 HG23 THR 158 -9.562 -28.954 7.530 1123 H GLU 159 H GLU 159 -8.205 -29.600 4.704 1124 HA GLU 159 HA GLU 159 -6.775 -31.903 3.795 1125 HB2 GLU 159 HB2 GLU 159 -9.592 -30.939 3.461 1126 HB3 GLU 159 HB3 GLU 159 -8.996 -32.303 2.526 1127 HG2 GLU 159 HG2 GLU 159 -8.511 -33.528 4.552 1128 HG3 GLU 159 HG3 GLU 159 -8.992 -32.143 5.532 Start of MODEL 5 1 H1 MET 1 H1 MET 1 -30.256 -19.177 -26.097 2 H2 MET 1 H2 MET 1 -31.369 -18.568 -27.215 3 H3 MET 1 H3 MET 1 -30.391 -17.507 -26.334 4 HA MET 1 HA MET 1 -29.434 -19.482 -28.321 5 HB2 MET 1 HB2 MET 1 -29.974 -16.531 -28.464 6 HB3 MET 1 HB3 MET 1 -28.757 -17.265 -29.498 7 HG2 MET 1 HG2 MET 1 -30.429 -18.738 -30.457 8 HG3 MET 1 HG3 MET 1 -31.656 -18.066 -29.385 9 HE1 MET 1 HE1 MET 1 -32.606 -16.742 -32.980 10 HE2 MET 1 HE2 MET 1 -32.993 -17.894 -31.702 11 HE3 MET 1 HE3 MET 1 -31.635 -18.200 -32.785 12 H ARG 2 H ARG 2 -27.363 -19.978 -28.177 13 HA ARG 2 HA ARG 2 -25.691 -18.636 -26.198 14 HB2 ARG 2 HB2 ARG 2 -25.477 -21.221 -27.714 15 HB3 ARG 2 HB3 ARG 2 -24.082 -20.551 -26.878 16 HG2 ARG 2 HG2 ARG 2 -25.347 -20.581 -24.774 17 HG3 ARG 2 HG3 ARG 2 -26.718 -21.295 -25.623 18 HD2 ARG 2 HD2 ARG 2 -25.565 -23.074 -24.559 19 HD3 ARG 2 HD3 ARG 2 -25.198 -23.185 -26.279 20 HE ARG 2 HE ARG 2 -23.036 -22.086 -25.718 21 HH11 ARG 2 HH11 ARG 2 -24.790 -23.855 -23.214 22 HH12 ARG 2 HH12 ARG 2 -23.297 -24.186 -22.263 23 HH21 ARG 2 HH21 ARG 2 -21.150 -22.494 -24.527 24 HH22 ARG 2 HH22 ARG 2 -21.276 -23.429 -22.993 25 H GLY 3 H GLY 3 -23.749 -17.638 -26.627 26 HA2 GLY 3 HA2 GLY 3 -21.910 -17.278 -28.253 27 HA3 GLY 3 HA3 GLY 3 -23.158 -17.121 -29.479 28 H SER 4 H SER 4 -22.146 -15.690 -26.383 29 HA SER 4 HA SER 4 -22.781 -13.039 -27.492 30 HB2 SER 4 HB2 SER 4 -23.258 -13.956 -24.644 31 HB3 SER 4 HB3 SER 4 -23.512 -12.318 -25.245 32 HG SER 4 HG SER 4 -25.444 -13.580 -25.204 33 H HIS 5 H HIS 5 -20.973 -14.721 -24.908 34 HA HIS 5 HA HIS 5 -18.651 -13.031 -25.471 35 HB2 HIS 5 HB2 HIS 5 -20.000 -13.300 -22.790 36 HB3 HIS 5 HB3 HIS 5 -18.294 -12.884 -22.922 37 HD1 HIS 5 HD1 HIS 5 -21.721 -11.515 -23.498 38 HD2 HIS 5 HD2 HIS 5 -17.764 -10.295 -23.862 39 HE1 HIS 5 HE1 HIS 5 -21.814 -9.026 -23.851 40 HE2 HIS 5 HE2 HIS 5 -19.408 -8.309 -24.068 41 H HIS 6 H HIS 6 -16.893 -14.220 -25.695 42 HA HIS 6 HA HIS 6 -16.564 -16.683 -24.140 43 HB2 HIS 6 HB2 HIS 6 -16.348 -16.469 -27.146 44 HB3 HIS 6 HB3 HIS 6 -15.640 -17.795 -26.230 45 HD1 HIS 6 HD1 HIS 6 -17.373 -19.353 -24.929 46 HD2 HIS 6 HD2 HIS 6 -19.025 -16.727 -27.694 47 HE1 HIS 6 HE1 HIS 6 -19.703 -20.199 -25.352 48 HE2 HIS 6 HE2 HIS 6 -20.685 -18.595 -27.028 49 H HIS 7 H HIS 7 -14.427 -17.308 -23.769 50 HA HIS 7 HA HIS 7 -12.454 -15.170 -24.174 51 HB2 HIS 7 HB2 HIS 7 -12.678 -17.391 -22.151 52 HB3 HIS 7 HB3 HIS 7 -11.186 -16.483 -22.371 53 HD1 HIS 7 HD1 HIS 7 -14.785 -15.977 -21.325 54 HD2 HIS 7 HD2 HIS 7 -11.112 -14.047 -21.121 55 HE1 HIS 7 HE1 HIS 7 -15.145 -14.000 -19.811 56 HE2 HIS 7 HE2 HIS 7 -12.909 -12.844 -19.703 57 H HIS 8 H HIS 8 -10.388 -15.590 -24.970 58 HA HIS 8 HA HIS 8 -9.885 -18.259 -26.079 59 HB2 HIS 8 HB2 HIS 8 -9.885 -15.669 -27.620 60 HB3 HIS 8 HB3 HIS 8 -8.992 -17.082 -28.173 61 HD1 HIS 8 HD1 HIS 8 -10.335 -19.021 -29.160 62 HD2 HIS 8 HD2 HIS 8 -12.696 -15.895 -27.774 63 HE1 HIS 8 HE1 HIS 8 -12.644 -19.479 -30.045 64 HE2 HIS 8 HE2 HIS 8 -14.057 -17.574 -29.194 65 H HIS 9 H HIS 9 -8.538 -15.057 -25.306 66 HA HIS 9 HA HIS 9 -5.902 -16.344 -24.996 67 HB2 HIS 9 HB2 HIS 9 -6.601 -13.604 -26.019 68 HB3 HIS 9 HB3 HIS 9 -4.990 -13.987 -25.423 69 HD1 HIS 9 HD1 HIS 9 -3.536 -15.567 -26.862 70 HD2 HIS 9 HD2 HIS 9 -7.255 -14.711 -28.506 71 HE1 HIS 9 HE1 HIS 9 -3.412 -16.350 -29.249 72 HE2 HIS 9 HE2 HIS 9 -5.675 -15.824 -30.225 73 H HIS 10 H HIS 10 -8.134 -13.950 -23.650 74 HA HIS 10 HA HIS 10 -6.396 -13.204 -21.483 75 HB2 HIS 10 HB2 HIS 10 -8.512 -11.999 -22.652 76 HB3 HIS 10 HB3 HIS 10 -9.298 -12.684 -21.233 77 HD1 HIS 10 HD1 HIS 10 -8.913 -11.531 -19.026 78 HD2 HIS 10 HD2 HIS 10 -6.418 -10.125 -22.037 79 HE1 HIS 10 HE1 HIS 10 -7.765 -9.511 -18.060 80 HE2 HIS 10 HE2 HIS 10 -6.259 -8.677 -19.900 81 H GLY 11 H GLY 11 -6.605 -13.665 -19.289 82 HA2 GLY 11 HA2 GLY 11 -8.164 -14.809 -17.611 83 HA3 GLY 11 HA3 GLY 11 -8.011 -16.189 -18.685 84 H SER 12 H SER 12 -5.547 -13.871 -17.592 85 HA SER 12 HA SER 12 -4.060 -16.111 -16.360 86 HB2 SER 12 HB2 SER 12 -3.216 -14.019 -18.250 87 HB3 SER 12 HB3 SER 12 -2.145 -14.242 -16.856 88 HG SER 12 HG SER 12 -2.462 -15.804 -19.047 89 H ALA 13 H ALA 13 -2.438 -15.406 -14.741 90 HA ALA 13 HA ALA 13 -2.734 -12.892 -13.499 91 HB1 ALA 13 HB1 ALA 13 -3.293 -13.844 -11.227 92 HB2 ALA 13 HB2 ALA 13 -3.682 -15.358 -12.047 93 HB3 ALA 13 HB3 ALA 13 -4.609 -13.900 -12.401 94 H THR 14 H THR 14 -0.618 -12.460 -13.559 95 HA THR 14 HA THR 14 1.313 -14.443 -12.764 96 HB THR 14 HB THR 14 1.662 -13.305 -14.894 97 HG1 THR 14 HG1 THR 14 3.812 -12.254 -13.570 98 HG21 THR 14 HG21 THR 14 2.354 -10.960 -15.007 99 HG22 THR 14 HG22 THR 14 2.066 -10.782 -13.275 100 HG23 THR 14 HG23 THR 14 0.716 -11.101 -14.365 101 H TYR 15 H TYR 15 -0.359 -12.050 -11.194 102 HA TYR 15 HA TYR 15 1.798 -11.146 -9.548 103 HB2 TYR 15 HB2 TYR 15 -0.766 -10.145 -10.250 104 HB3 TYR 15 HB3 TYR 15 -0.541 -10.115 -8.507 105 HD1 TYR 15 HD1 TYR 15 0.107 -8.432 -11.564 106 HD2 TYR 15 HD2 TYR 15 1.677 -9.047 -7.659 107 HE1 TYR 15 HE1 TYR 15 1.467 -6.398 -11.797 108 HE2 TYR 15 HE2 TYR 15 3.039 -7.010 -7.878 109 HH TYR 15 HH TYR 15 2.566 -4.743 -10.366 110 H THR 16 H THR 16 2.452 -12.008 -7.870 111 HA THR 16 HA THR 16 0.823 -14.004 -6.550 112 HB THR 16 HB THR 16 3.016 -14.603 -5.413 113 HG1 THR 16 HG1 THR 16 4.885 -13.750 -6.331 114 HG21 THR 16 HG21 THR 16 2.156 -15.914 -7.271 115 HG22 THR 16 HG22 THR 16 3.908 -15.760 -7.395 116 HG23 THR 16 HG23 THR 16 2.860 -14.773 -8.417 117 H ARG 17 H ARG 17 0.779 -14.154 -4.205 118 HA ARG 17 HA ARG 17 0.532 -11.626 -2.901 119 HB2 ARG 17 HB2 ARG 17 -0.793 -14.054 -2.696 120 HB3 ARG 17 HB3 ARG 17 0.156 -13.978 -1.218 121 HG2 ARG 17 HG2 ARG 17 -1.415 -12.699 -0.318 122 HG3 ARG 17 HG3 ARG 17 -1.094 -11.459 -1.530 123 HD2 ARG 17 HD2 ARG 17 -3.453 -12.090 -1.516 124 HD3 ARG 17 HD3 ARG 17 -2.691 -12.515 -3.046 125 HE ARG 17 HE ARG 17 -2.711 -14.821 -2.345 126 HH11 ARG 17 HH11 ARG 17 -4.628 -12.649 -0.329 127 HH12 ARG 17 HH12 ARG 17 -5.633 -13.989 0.330 128 HH21 ARG 17 HH21 ARG 17 -5.270 -16.135 -0.333 129 HH22 ARG 17 HH22 ARG 17 -3.973 -16.515 -1.524 130 HA PRO 18 HA PRO 18 4.783 -12.098 -1.260 131 HB2 PRO 18 HB2 PRO 18 4.176 -9.571 0.119 132 HB3 PRO 18 HB3 PRO 18 5.472 -9.936 -1.028 133 HG2 PRO 18 HG2 PRO 18 3.413 -8.365 -1.708 134 HG3 PRO 18 HG3 PRO 18 4.185 -9.459 -2.872 135 HD2 PRO 18 HD2 PRO 18 1.596 -9.782 -1.415 136 HD3 PRO 18 HD3 PRO 18 2.019 -10.207 -3.089 137 H LEU 19 H LEU 19 1.845 -11.470 0.513 138 HA LEU 19 HA LEU 19 2.920 -12.792 2.866 139 HB2 LEU 19 HB2 LEU 19 2.137 -10.088 2.735 140 HB3 LEU 19 HB3 LEU 19 0.948 -10.927 3.667 141 HG LEU 19 HG LEU 19 2.701 -9.780 4.990 142 HD11 LEU 19 HD11 LEU 19 3.202 -11.826 6.446 143 HD12 LEU 19 HD12 LEU 19 2.286 -12.752 5.254 144 HD13 LEU 19 HD13 LEU 19 1.505 -11.437 6.144 145 HD21 LEU 19 HD21 LEU 19 4.552 -11.991 4.136 146 HD22 LEU 19 HD22 LEU 19 4.919 -10.575 5.119 147 HD23 LEU 19 HD23 LEU 19 4.577 -10.391 3.398 148 H ASP 20 H ASP 20 0.925 -12.801 4.368 149 HA ASP 20 HA ASP 20 -1.384 -13.897 3.037 150 HB2 ASP 20 HB2 ASP 20 0.411 -15.255 4.747 151 HB3 ASP 20 HB3 ASP 20 -1.146 -15.109 5.550 152 H THR 21 H THR 21 0.056 -12.042 5.466 153 HA THR 21 HA THR 21 -2.233 -10.599 6.102 154 HB THR 21 HB THR 21 -2.730 -12.702 7.330 155 HG1 THR 21 HG1 THR 21 -2.428 -10.784 9.339 156 HG21 THR 21 HG21 THR 21 -1.583 -13.190 9.446 157 HG22 THR 21 HG22 THR 21 -0.425 -11.901 9.117 158 HG23 THR 21 HG23 THR 21 -0.483 -13.322 8.074 159 H GLY 22 H GLY 22 -1.648 -9.590 8.494 160 HA2 GLY 22 HA2 GLY 22 0.907 -8.960 9.280 161 HA3 GLY 22 HA3 GLY 22 0.455 -7.759 8.078 162 H ASN 23 H ASN 23 0.402 -8.494 11.344 163 HA ASN 23 HA ASN 23 -1.285 -6.262 11.941 164 HB2 ASN 23 HB2 ASN 23 -2.620 -7.660 13.634 165 HB3 ASN 23 HB3 ASN 23 -3.064 -7.794 11.940 166 HD21 ASN 23 HD21 ASN 23 -2.168 -9.614 10.745 167 HD22 ASN 23 HD22 ASN 23 -1.900 -11.109 11.562 168 H ILE 24 H ILE 24 -0.580 -5.102 13.393 169 HA ILE 24 HA ILE 24 1.404 -6.150 15.251 170 HB ILE 24 HB ILE 24 0.977 -3.283 15.176 171 HG12 ILE 24 HG12 ILE 24 2.578 -3.158 13.103 172 HG13 ILE 24 HG13 ILE 24 1.936 -4.755 12.752 173 HG21 ILE 24 HG21 ILE 24 2.727 -4.341 16.513 174 HG22 ILE 24 HG22 ILE 24 3.382 -3.176 15.363 175 HG23 ILE 24 HG23 ILE 24 3.490 -4.899 15.029 176 HD11 ILE 24 HD11 ILE 24 0.453 -3.534 11.567 177 HD12 ILE 24 HD12 ILE 24 0.617 -2.119 12.605 178 HD13 ILE 24 HD13 ILE 24 -0.363 -3.496 13.134 179 H THR 25 H THR 25 -0.798 -6.965 15.938 180 HA THR 25 HA THR 25 -2.014 -5.216 17.956 181 HB THR 25 HB THR 25 -3.620 -6.189 16.452 182 HG1 THR 25 HG1 THR 25 -4.814 -7.534 18.096 183 HG21 THR 25 HG21 THR 25 -2.257 -8.200 15.819 184 HG22 THR 25 HG22 THR 25 -3.972 -8.520 16.092 185 HG23 THR 25 HG23 THR 25 -2.788 -8.950 17.327 186 H THR 26 H THR 26 -0.150 -8.086 17.544 187 HA THR 26 HA THR 26 -0.150 -8.570 20.449 188 HB THR 26 HB THR 26 0.676 -10.663 18.458 189 HG1 THR 26 HG1 THR 26 -1.949 -9.950 19.264 190 HG21 THR 26 HG21 THR 26 -0.055 -12.197 20.252 191 HG22 THR 26 HG22 THR 26 -0.458 -10.805 21.258 192 HG23 THR 26 HG23 THR 26 1.218 -11.100 20.789 193 H GLY 27 H GLY 27 1.942 -9.310 17.737 194 HA2 GLY 27 HA2 GLY 27 4.136 -7.719 18.655 195 HA3 GLY 27 HA3 GLY 27 4.379 -9.423 19.018 196 H PHE 28 H PHE 28 5.171 -7.117 16.875 197 HA PHE 28 HA PHE 28 4.806 -8.508 14.429 198 HB2 PHE 28 HB2 PHE 28 5.270 -5.879 15.048 199 HB3 PHE 28 HB3 PHE 28 6.786 -6.389 14.315 200 HD1 PHE 28 HD1 PHE 28 3.092 -6.662 13.716 201 HD2 PHE 28 HD2 PHE 28 6.975 -6.323 12.028 202 HE1 PHE 28 HE1 PHE 28 2.106 -6.546 11.466 203 HE2 PHE 28 HE2 PHE 28 6.001 -6.192 9.784 204 HZ PHE 28 HZ PHE 28 3.562 -6.316 9.503 205 H ASN 29 H ASN 29 6.390 -9.031 12.924 206 HA ASN 29 HA ASN 29 8.013 -11.051 13.743 207 HB2 ASN 29 HB2 ASN 29 7.750 -9.511 11.218 208 HB3 ASN 29 HB3 ASN 29 8.862 -10.853 11.335 209 HD21 ASN 29 HD21 ASN 29 5.678 -9.852 10.954 210 HD22 ASN 29 HD22 ASN 29 4.942 -11.401 10.825 211 H GLY 30 H GLY 30 8.857 -8.641 15.081 212 HA2 GLY 30 HA2 GLY 30 11.081 -8.394 16.002 213 HA3 GLY 30 HA3 GLY 30 11.732 -8.816 14.422 214 H TYR 31 H TYR 31 9.180 -6.945 13.800 215 HA TYR 31 HA TYR 31 10.829 -4.488 13.615 216 HB2 TYR 31 HB2 TYR 31 8.174 -4.916 12.240 217 HB3 TYR 31 HB3 TYR 31 9.412 -3.743 11.854 218 HD1 TYR 31 HD1 TYR 31 10.998 -4.194 10.199 219 HD2 TYR 31 HD2 TYR 31 8.735 -7.424 11.807 220 HE1 TYR 31 HE1 TYR 31 11.900 -5.690 8.471 221 HE2 TYR 31 HE2 TYR 31 9.633 -8.919 10.080 222 HH TYR 31 HH TYR 31 12.272 -8.115 8.139 223 HA PRO 32 HA PRO 32 7.912 -3.556 17.106 224 HB2 PRO 32 HB2 PRO 32 10.053 -2.020 18.313 225 HB3 PRO 32 HB3 PRO 32 9.287 -3.496 18.906 226 HG2 PRO 32 HG2 PRO 32 11.862 -3.416 18.051 227 HG3 PRO 32 HG3 PRO 32 10.844 -4.866 17.952 228 HD2 PRO 32 HD2 PRO 32 11.523 -2.893 15.805 229 HD3 PRO 32 HD3 PRO 32 11.444 -4.667 15.728 230 H GLY 33 H GLY 33 6.664 -1.789 17.404 231 HA2 GLY 33 HA2 GLY 33 6.070 0.481 17.449 232 HA3 GLY 33 HA3 GLY 33 7.616 0.882 16.722 233 H HIS 34 H HIS 34 6.279 -1.589 14.993 234 HA HIS 34 HA HIS 34 5.750 -0.027 12.712 235 HB2 HIS 34 HB2 HIS 34 6.740 -2.427 12.956 236 HB3 HIS 34 HB3 HIS 34 5.060 -2.938 13.007 237 HD1 HIS 34 HD1 HIS 34 4.555 -3.918 10.785 238 HD2 HIS 34 HD2 HIS 34 6.868 -0.501 10.444 239 HE1 HIS 34 HE1 HIS 34 4.800 -3.443 8.316 240 H VAL 35 H VAL 35 3.867 0.790 12.064 241 HA VAL 35 HA VAL 35 1.402 0.068 13.478 242 HB VAL 35 HB VAL 35 0.702 2.225 11.987 243 HG11 VAL 35 HG11 VAL 35 1.526 3.481 14.245 244 HG12 VAL 35 HG12 VAL 35 1.476 1.804 14.782 245 HG13 VAL 35 HG13 VAL 35 0.029 2.559 14.105 246 HG21 VAL 35 HG21 VAL 35 3.583 2.670 12.731 247 HG22 VAL 35 HG22 VAL 35 2.464 3.944 12.249 248 HG23 VAL 35 HG23 VAL 35 2.891 2.669 11.108 249 H GLY 36 H GLY 36 2.886 -0.957 10.799 250 HA2 GLY 36 HA2 GLY 36 0.357 -1.544 9.455 251 HA3 GLY 36 HA3 GLY 36 1.636 -0.784 8.520 252 H VAL 37 H VAL 37 1.811 -2.490 7.143 253 HA VAL 37 HA VAL 37 3.206 -4.833 8.205 254 HB VAL 37 HB VAL 37 0.903 -5.509 7.739 255 HG11 VAL 37 HG11 VAL 37 1.414 -4.228 5.115 256 HG12 VAL 37 HG12 VAL 37 -0.036 -4.220 6.117 257 HG13 VAL 37 HG13 VAL 37 0.369 -5.646 5.159 258 HG21 VAL 37 HG21 VAL 37 2.946 -6.667 5.851 259 HG22 VAL 37 HG22 VAL 37 1.360 -7.383 6.136 260 HG23 VAL 37 HG23 VAL 37 2.517 -7.241 7.461 261 H ASP 38 H ASP 38 4.694 -5.865 6.686 262 HA ASP 38 HA ASP 38 5.480 -4.149 4.427 263 HB2 ASP 38 HB2 ASP 38 7.293 -5.273 6.573 264 HB3 ASP 38 HB3 ASP 38 7.890 -4.611 5.054 265 H TYR 39 H TYR 39 5.865 -5.075 2.605 266 HA TYR 39 HA TYR 39 6.065 -8.015 2.449 267 HB2 TYR 39 HB2 TYR 39 4.886 -6.305 0.273 268 HB3 TYR 39 HB3 TYR 39 4.756 -8.029 0.488 269 HD1 TYR 39 HD1 TYR 39 2.850 -8.950 1.583 270 HD2 TYR 39 HD2 TYR 39 3.664 -4.796 1.883 271 HE1 TYR 39 HE1 TYR 39 0.625 -8.593 2.554 272 HE2 TYR 39 HE2 TYR 39 1.447 -4.428 2.860 273 HH TYR 39 HH TYR 39 -0.757 -5.527 2.895 274 H ALA 40 H ALA 40 8.108 -8.422 1.954 275 HA ALA 40 HA ALA 40 9.965 -6.817 0.694 276 HB1 ALA 40 HB1 ALA 40 11.305 -8.860 0.390 277 HB2 ALA 40 HB2 ALA 40 9.894 -9.821 0.834 278 HB3 ALA 40 HB3 ALA 40 10.620 -8.727 2.011 279 H VAL 41 H VAL 41 9.657 -5.897 -1.220 280 HA VAL 41 HA VAL 41 9.443 -7.557 -3.568 281 HB VAL 41 HB VAL 41 7.086 -7.039 -3.020 282 HG11 VAL 41 HG11 VAL 41 6.210 -4.748 -3.354 283 HG12 VAL 41 HG12 VAL 41 7.872 -4.159 -3.408 284 HG13 VAL 41 HG13 VAL 41 7.251 -4.907 -1.938 285 HG21 VAL 41 HG21 VAL 41 7.756 -7.422 -5.339 286 HG22 VAL 41 HG22 VAL 41 8.018 -5.691 -5.548 287 HG23 VAL 41 HG23 VAL 41 6.396 -6.304 -5.226 288 HA PRO 42 HA PRO 42 12.826 -4.790 -4.711 289 HB2 PRO 42 HB2 PRO 42 11.881 -5.514 -7.452 290 HB3 PRO 42 HB3 PRO 42 13.518 -5.538 -6.781 291 HG2 PRO 42 HG2 PRO 42 12.190 -7.801 -7.105 292 HG3 PRO 42 HG3 PRO 42 13.196 -7.536 -5.667 293 HD2 PRO 42 HD2 PRO 42 10.231 -7.503 -5.921 294 HD3 PRO 42 HD3 PRO 42 11.250 -8.017 -4.562 295 H VAL 43 H VAL 43 13.162 -2.916 -5.209 296 HA VAL 43 HA VAL 43 11.234 -0.940 -5.360 297 HB VAL 43 HB VAL 43 13.303 -0.548 -4.305 298 HG11 VAL 43 HG11 VAL 43 15.471 -0.429 -5.515 299 HG12 VAL 43 HG12 VAL 43 14.666 -1.161 -6.904 300 HG13 VAL 43 HG13 VAL 43 14.774 -2.042 -5.377 301 HG21 VAL 43 HG21 VAL 43 13.707 1.616 -4.950 302 HG22 VAL 43 HG22 VAL 43 12.252 1.321 -5.910 303 HG23 VAL 43 HG23 VAL 43 13.841 1.185 -6.654 304 H GLY 44 H GLY 44 10.441 0.350 -6.952 305 HA2 GLY 44 HA2 GLY 44 10.569 1.402 -9.085 306 HA3 GLY 44 HA3 GLY 44 11.529 0.048 -9.626 307 H THR 45 H THR 45 9.038 -1.258 -7.915 308 HA THR 45 HA THR 45 7.622 -1.974 -10.293 309 HB THR 45 HB THR 45 6.870 -2.900 -7.541 310 HG1 THR 45 HG1 THR 45 9.260 -3.261 -8.735 311 HG21 THR 45 HG21 THR 45 6.256 -4.967 -8.735 312 HG22 THR 45 HG22 THR 45 6.785 -4.242 -10.252 313 HG23 THR 45 HG23 THR 45 5.403 -3.568 -9.389 314 HA PRO 46 HA PRO 46 4.632 1.368 -9.748 315 HB2 PRO 46 HB2 PRO 46 2.846 -0.406 -11.334 316 HB3 PRO 46 HB3 PRO 46 3.283 1.287 -11.609 317 HG2 PRO 46 HG2 PRO 46 4.314 -0.631 -13.126 318 HG3 PRO 46 HG3 PRO 46 5.293 0.759 -12.614 319 HD2 PRO 46 HD2 PRO 46 5.318 -2.043 -11.588 320 HD3 PRO 46 HD3 PRO 46 6.663 -0.910 -11.832 321 H VAL 47 H VAL 47 3.409 1.682 -8.047 322 HA VAL 47 HA VAL 47 1.987 -0.477 -6.797 323 HB VAL 47 HB VAL 47 2.422 2.236 -5.579 324 HG11 VAL 47 HG11 VAL 47 0.739 0.859 -4.494 325 HG12 VAL 47 HG12 VAL 47 2.149 1.041 -3.449 326 HG13 VAL 47 HG13 VAL 47 1.896 -0.463 -4.336 327 HG21 VAL 47 HG21 VAL 47 4.248 0.757 -4.272 328 HG22 VAL 47 HG22 VAL 47 4.639 1.771 -5.660 329 HG23 VAL 47 HG23 VAL 47 4.372 0.042 -5.876 330 H ARG 48 H ARG 48 0.031 -0.663 -7.069 331 HA ARG 48 HA ARG 48 -1.516 1.541 -8.026 332 HB2 ARG 48 HB2 ARG 48 -2.046 -1.413 -8.186 333 HB3 ARG 48 HB3 ARG 48 -3.225 -0.204 -8.679 334 HG2 ARG 48 HG2 ARG 48 -2.332 -0.440 -10.709 335 HG3 ARG 48 HG3 ARG 48 -1.016 0.561 -10.090 336 HD2 ARG 48 HD2 ARG 48 0.250 -1.423 -9.499 337 HD3 ARG 48 HD3 ARG 48 -1.084 -2.454 -10.017 338 HE ARG 48 HE ARG 48 -0.402 -0.851 -12.180 339 HH11 ARG 48 HH11 ARG 48 2.143 -3.952 -11.619 340 HH12 ARG 48 HH12 ARG 48 1.115 -3.390 -10.251 341 HH21 ARG 48 HH21 ARG 48 2.015 -2.926 -13.652 342 HH22 ARG 48 HH22 ARG 48 0.885 -1.547 -13.907 343 H ALA 49 H ALA 49 -3.614 1.957 -7.307 344 HA ALA 49 HA ALA 49 -3.746 1.974 -4.492 345 HB1 ALA 49 HB1 ALA 49 -5.787 2.844 -6.530 346 HB2 ALA 49 HB2 ALA 49 -4.557 3.859 -5.778 347 HB3 ALA 49 HB3 ALA 49 -5.863 3.187 -4.802 348 H VAL 50 H VAL 50 -4.550 0.476 -3.212 349 HA VAL 50 HA VAL 50 -5.843 -1.823 -4.161 350 HB VAL 50 HB VAL 50 -5.663 -0.951 -1.329 351 HG11 VAL 50 HG11 VAL 50 -7.180 -2.768 -1.411 352 HG12 VAL 50 HG12 VAL 50 -5.636 -3.443 -0.890 353 HG13 VAL 50 HG13 VAL 50 -6.165 -3.641 -2.560 354 HG21 VAL 50 HG21 VAL 50 -3.726 -2.610 -2.916 355 HG22 VAL 50 HG22 VAL 50 -3.620 -2.294 -1.185 356 HG23 VAL 50 HG23 VAL 50 -3.456 -0.968 -2.335 357 H ALA 51 H ALA 51 -7.147 1.193 -3.395 358 HA ALA 51 HA ALA 51 -9.762 0.494 -4.093 359 HB1 ALA 51 HB1 ALA 51 -9.188 0.859 -1.182 360 HB2 ALA 51 HB2 ALA 51 -10.158 -0.388 -1.967 361 HB3 ALA 51 HB3 ALA 51 -10.768 1.265 -1.853 362 H ASN 52 H ASN 52 -10.977 2.228 -4.577 363 HA ASN 52 HA ASN 52 -9.767 4.645 -5.122 364 HB2 ASN 52 HB2 ASN 52 -12.201 5.368 -5.514 365 HB3 ASN 52 HB3 ASN 52 -11.548 4.103 -6.489 366 HD21 ASN 52 HD21 ASN 52 -12.757 3.922 -3.236 367 HD22 ASN 52 HD22 ASN 52 -14.049 2.828 -3.565 368 H GLY 53 H GLY 53 -10.301 6.774 -4.384 369 HA2 GLY 53 HA2 GLY 53 -11.810 7.506 -2.201 370 HA3 GLY 53 HA3 GLY 53 -10.276 6.986 -1.530 371 H THR 54 H THR 54 -9.094 8.687 -1.010 372 HA THR 54 HA THR 54 -8.614 10.801 -2.856 373 HB THR 54 HB THR 54 -9.473 11.366 -0.081 374 HG1 THR 54 HG1 THR 54 -11.499 11.722 -0.787 375 HG21 THR 54 HG21 THR 54 -9.221 13.234 -2.439 376 HG22 THR 54 HG22 THR 54 -8.049 13.099 -1.128 377 HG23 THR 54 HG23 THR 54 -9.676 13.693 -0.797 378 H VAL 55 H VAL 55 -6.601 11.669 -2.583 379 HA VAL 55 HA VAL 55 -4.746 10.269 -0.926 380 HB VAL 55 HB VAL 55 -4.144 12.615 -2.726 381 HG11 VAL 55 HG11 VAL 55 -2.348 11.921 -1.203 382 HG12 VAL 55 HG12 VAL 55 -1.919 11.671 -2.896 383 HG13 VAL 55 HG13 VAL 55 -2.404 10.299 -1.896 384 HG21 VAL 55 HG21 VAL 55 -4.211 9.715 -3.556 385 HG22 VAL 55 HG22 VAL 55 -3.665 11.064 -4.549 386 HG23 VAL 55 HG23 VAL 55 -5.352 10.961 -4.060 387 H LYS 56 H LYS 56 -4.551 10.905 1.044 388 HA LYS 56 HA LYS 56 -5.028 13.612 1.918 389 HB2 LYS 56 HB2 LYS 56 -4.295 11.503 3.888 390 HB3 LYS 56 HB3 LYS 56 -5.401 12.848 4.070 391 HG2 LYS 56 HG2 LYS 56 -5.893 10.168 2.816 392 HG3 LYS 56 HG3 LYS 56 -6.736 10.928 4.155 393 HD2 LYS 56 HD2 LYS 56 -6.815 12.239 1.484 394 HD3 LYS 56 HD3 LYS 56 -7.805 10.801 1.741 395 HE2 LYS 56 HE2 LYS 56 -8.833 11.898 3.708 396 HE3 LYS 56 HE3 LYS 56 -7.897 13.352 3.358 397 HZ1 LYS 56 HZ1 LYS 56 -9.946 12.120 1.596 398 HZ2 LYS 56 HZ2 LYS 56 -9.012 13.470 1.196 399 HZ3 LYS 56 HZ3 LYS 56 -10.114 13.555 2.475 400 H PHE 57 H PHE 57 -2.494 11.616 1.120 401 HA PHE 57 HA PHE 57 -0.522 13.540 1.822 402 HB2 PHE 57 HB2 PHE 57 -0.814 11.923 3.868 403 HB3 PHE 57 HB3 PHE 57 0.043 10.775 2.845 404 HD1 PHE 57 HD1 PHE 57 2.359 11.160 2.201 405 HD2 PHE 57 HD2 PHE 57 0.324 13.799 4.847 406 HE1 PHE 57 HE1 PHE 57 4.509 12.142 2.865 407 HE2 PHE 57 HE2 PHE 57 2.475 14.787 5.519 408 HZ PHE 57 HZ PHE 57 4.573 13.960 4.526 409 H ALA 58 H ALA 58 1.237 13.394 0.591 410 HA ALA 58 HA ALA 58 1.751 11.195 -1.150 411 HB1 ALA 58 HB1 ALA 58 0.992 13.912 -2.213 412 HB2 ALA 58 HB2 ALA 58 0.210 12.371 -2.555 413 HB3 ALA 58 HB3 ALA 58 1.828 12.694 -3.173 414 H GLY 59 H GLY 59 3.618 10.974 -0.089 415 HA2 GLY 59 HA2 GLY 59 5.509 13.178 0.068 416 HA3 GLY 59 HA3 GLY 59 5.674 11.609 0.851 417 H ASN 60 H ASN 60 6.146 13.460 -2.019 418 HA ASN 60 HA ASN 60 7.114 11.422 -3.726 419 HB2 ASN 60 HB2 ASN 60 7.282 14.427 -3.835 420 HB3 ASN 60 HB3 ASN 60 7.948 13.389 -5.091 421 HD21 ASN 60 HD21 ASN 60 4.994 13.099 -3.200 422 HD22 ASN 60 HD22 ASN 60 3.939 13.115 -4.546 423 H GLY 61 H GLY 61 8.895 10.516 -3.824 424 HA2 GLY 61 HA2 GLY 61 11.137 11.168 -2.119 425 HA3 GLY 61 HA3 GLY 61 10.997 9.769 -3.165 426 H ALA 62 H ALA 62 10.248 12.327 -5.058 427 HA ALA 62 HA ALA 62 12.714 12.243 -6.442 428 HB1 ALA 62 HB1 ALA 62 10.539 12.372 -7.578 429 HB2 ALA 62 HB2 ALA 62 11.650 13.647 -8.080 430 HB3 ALA 62 HB3 ALA 62 10.347 14.008 -6.945 431 H ASN 63 H ASN 63 11.227 14.464 -4.253 432 HA ASN 63 HA ASN 63 13.576 16.135 -4.323 433 HB2 ASN 63 HB2 ASN 63 11.196 16.910 -5.497 434 HB3 ASN 63 HB3 ASN 63 11.268 17.763 -3.969 435 HD21 ASN 63 HD21 ASN 63 12.360 17.545 -7.126 436 HD22 ASN 63 HD22 ASN 63 13.500 18.834 -7.090 437 H HIS 64 H HIS 64 12.366 14.153 -2.403 438 HA HIS 64 HA HIS 64 11.467 15.706 -0.266 439 HB2 HIS 64 HB2 HIS 64 11.272 13.613 0.942 440 HB3 HIS 64 HB3 HIS 64 10.492 13.537 -0.608 441 HD1 HIS 64 HD1 HIS 64 13.762 13.020 -1.644 442 HD2 HIS 64 HD2 HIS 64 11.172 10.723 0.653 443 HE1 HIS 64 HE1 HIS 64 14.654 10.671 -1.769 444 HE2 HIS 64 HE2 HIS 64 13.073 9.298 -0.369 445 HA PRO 65 HA PRO 65 15.618 16.515 1.426 446 HB2 PRO 65 HB2 PRO 65 13.970 17.824 3.527 447 HB3 PRO 65 HB3 PRO 65 15.304 18.503 2.568 448 HG2 PRO 65 HG2 PRO 65 12.854 19.266 2.082 449 HG3 PRO 65 HG3 PRO 65 13.941 18.886 0.724 450 HD2 PRO 65 HD2 PRO 65 11.835 17.139 1.982 451 HD3 PRO 65 HD3 PRO 65 12.128 17.531 0.287 452 H TRP 66 H TRP 66 16.673 16.010 3.387 453 HA TRP 66 HA TRP 66 15.370 13.882 4.860 454 HB2 TRP 66 HB2 TRP 66 18.269 14.700 4.874 455 HB3 TRP 66 HB3 TRP 66 17.565 13.370 5.788 456 HD1 TRP 66 HD1 TRP 66 18.104 14.410 2.093 457 HE1 TRP 66 HE1 TRP 66 18.296 12.271 0.675 458 HE3 TRP 66 HE3 TRP 66 17.207 10.917 5.736 459 HZ2 TRP 66 HZ2 TRP 66 18.097 9.484 1.043 460 HZ3 TRP 66 HZ3 TRP 66 17.225 8.537 5.110 461 HH2 TRP 66 HH2 TRP 66 17.660 7.839 2.813 462 H MET 67 H MET 67 15.182 16.946 5.003 463 HA MET 67 HA MET 67 15.993 17.528 7.667 464 HB2 MET 67 HB2 MET 67 14.544 19.050 5.543 465 HB3 MET 67 HB3 MET 67 14.596 19.667 7.189 466 HG2 MET 67 HG2 MET 67 17.037 19.697 7.107 467 HG3 MET 67 HG3 MET 67 16.991 19.070 5.460 468 HE1 MET 67 HE1 MET 67 16.867 22.126 7.749 469 HE2 MET 67 HE2 MET 67 15.129 21.964 7.499 470 HE3 MET 67 HE3 MET 67 15.992 23.346 6.822 471 H LEU 68 H LEU 68 13.011 16.922 5.941 472 HA LEU 68 HA LEU 68 11.802 16.351 8.540 473 HB2 LEU 68 HB2 LEU 68 9.671 17.243 7.831 474 HB3 LEU 68 HB3 LEU 68 10.904 18.470 7.690 475 HG LEU 68 HG LEU 68 10.884 17.547 5.149 476 HD11 LEU 68 HD11 LEU 68 8.551 17.204 4.479 477 HD12 LEU 68 HD12 LEU 68 8.036 17.284 6.164 478 HD13 LEU 68 HD13 LEU 68 9.064 15.959 5.618 479 HD21 LEU 68 HD21 LEU 68 9.461 19.489 4.642 480 HD22 LEU 68 HD22 LEU 68 10.717 19.876 5.818 481 HD23 LEU 68 HD23 LEU 68 9.054 19.632 6.352 482 H TRP 69 H TRP 69 13.180 14.753 6.212 483 HA TRP 69 HA TRP 69 11.052 12.721 6.180 484 HB2 TRP 69 HB2 TRP 69 12.662 13.046 3.674 485 HB3 TRP 69 HB3 TRP 69 11.104 12.270 3.890 486 HD1 TRP 69 HD1 TRP 69 12.326 15.938 4.370 487 HE1 TRP 69 HE1 TRP 69 10.650 17.492 3.231 488 HE3 TRP 69 HE3 TRP 69 9.101 12.434 2.530 489 HZ2 TRP 69 HZ2 TRP 69 8.297 17.280 1.703 490 HZ3 TRP 69 HZ3 TRP 69 7.175 13.203 1.234 491 HH2 TRP 69 HH2 TRP 69 6.772 15.573 0.825 492 H MET 70 H MET 70 11.836 11.082 7.282 493 HA MET 70 HA MET 70 14.602 10.212 6.760 494 HB2 MET 70 HB2 MET 70 13.647 10.940 9.155 495 HB3 MET 70 HB3 MET 70 13.175 9.246 9.179 496 HG2 MET 70 HG2 MET 70 15.493 8.590 8.775 497 HG3 MET 70 HG3 MET 70 15.969 10.286 8.745 498 HE1 MET 70 HE1 MET 70 16.545 11.669 10.753 499 HE2 MET 70 HE2 MET 70 15.909 11.406 12.378 500 HE3 MET 70 HE3 MET 70 14.813 11.815 11.057 501 H ALA 71 H ALA 71 11.276 9.313 6.568 502 HA ALA 71 HA ALA 71 11.833 6.458 6.381 503 HB1 ALA 71 HB1 ALA 71 9.423 6.172 6.239 504 HB2 ALA 71 HB2 ALA 71 9.215 7.921 6.163 505 HB3 ALA 71 HB3 ALA 71 9.862 7.173 7.623 506 H GLY 72 H GLY 72 11.213 9.143 4.318 507 HA2 GLY 72 HA2 GLY 72 11.905 9.104 2.024 508 HA3 GLY 72 HA3 GLY 72 11.533 7.392 1.981 509 H ASN 73 H ASN 73 9.970 7.060 0.561 510 HA ASN 73 HA ASN 73 7.966 9.010 -0.026 511 HB2 ASN 73 HB2 ASN 73 8.569 6.284 -1.123 512 HB3 ASN 73 HB3 ASN 73 7.141 7.194 -1.605 513 HD21 ASN 73 HD21 ASN 73 10.641 7.173 -1.591 514 HD22 ASN 73 HD22 ASN 73 10.835 8.233 -2.939 515 H ALA 74 H ALA 74 5.829 8.938 0.430 516 HA ALA 74 HA ALA 74 4.629 6.612 1.582 517 HB1 ALA 74 HB1 ALA 74 3.815 7.770 3.614 518 HB2 ALA 74 HB2 ALA 74 4.848 9.140 3.204 519 HB3 ALA 74 HB3 ALA 74 5.569 7.574 3.584 520 H VAL 75 H VAL 75 2.382 6.590 1.508 521 HA VAL 75 HA VAL 75 1.055 8.917 0.344 522 HB VAL 75 HB VAL 75 0.229 6.267 -0.752 523 HG11 VAL 75 HG11 VAL 75 -0.589 7.518 -2.558 524 HG12 VAL 75 HG12 VAL 75 0.428 8.905 -2.170 525 HG13 VAL 75 HG13 VAL 75 -0.936 8.493 -1.129 526 HG21 VAL 75 HG21 VAL 75 1.779 6.312 -2.584 527 HG22 VAL 75 HG22 VAL 75 2.695 6.306 -1.076 528 HG23 VAL 75 HG23 VAL 75 2.503 7.802 -1.985 529 H LEU 76 H LEU 76 -0.635 9.368 1.527 530 HA LEU 76 HA LEU 76 -2.063 7.206 2.864 531 HB2 LEU 76 HB2 LEU 76 -0.872 9.351 4.062 532 HB3 LEU 76 HB3 LEU 76 -2.512 9.900 3.911 533 HG LEU 76 HG LEU 76 -2.199 7.196 5.048 534 HD11 LEU 76 HD11 LEU 76 -1.520 8.016 7.245 535 HD12 LEU 76 HD12 LEU 76 -1.262 9.624 6.568 536 HD13 LEU 76 HD13 LEU 76 -0.257 8.273 6.041 537 HD21 LEU 76 HD21 LEU 76 -3.804 8.220 6.703 538 HD22 LEU 76 HD22 LEU 76 -4.368 8.134 5.035 539 HD23 LEU 76 HD23 LEU 76 -3.793 9.665 5.696 540 H ILE 77 H ILE 77 -3.996 7.012 2.457 541 HA ILE 77 HA ILE 77 -5.523 8.930 0.974 542 HB ILE 77 HB ILE 77 -4.853 6.157 0.080 543 HG12 ILE 77 HG12 ILE 77 -4.963 8.420 -1.802 544 HG13 ILE 77 HG13 ILE 77 -3.688 8.462 -0.589 545 HG21 ILE 77 HG21 ILE 77 -7.298 6.337 -0.105 546 HG22 ILE 77 HG22 ILE 77 -6.527 6.249 -1.688 547 HG23 ILE 77 HG23 ILE 77 -7.102 7.800 -1.073 548 HD11 ILE 77 HD11 ILE 77 -4.158 6.164 -2.473 549 HD12 ILE 77 HD12 ILE 77 -2.801 6.380 -1.367 550 HD13 ILE 77 HD13 ILE 77 -2.996 7.462 -2.745 551 H GLN 78 H GLN 78 -7.691 8.649 1.130 552 HA GLN 78 HA GLN 78 -8.673 7.098 3.332 553 HB2 GLN 78 HB2 GLN 78 -9.114 9.472 3.474 554 HB3 GLN 78 HB3 GLN 78 -9.863 9.468 1.891 555 HG2 GLN 78 HG2 GLN 78 -11.308 7.582 3.256 556 HG3 GLN 78 HG3 GLN 78 -11.002 8.795 4.482 557 HE21 GLN 78 HE21 GLN 78 -12.360 8.081 1.449 558 HE22 GLN 78 HE22 GLN 78 -13.417 9.430 1.326 559 H HIS 79 H HIS 79 -9.585 5.310 2.853 560 HA HIS 79 HA HIS 79 -10.238 4.445 0.261 561 HB2 HIS 79 HB2 HIS 79 -10.418 3.260 2.961 562 HB3 HIS 79 HB3 HIS 79 -11.340 2.507 1.665 563 HD1 HIS 79 HD1 HIS 79 -9.010 3.202 -0.478 564 HD2 HIS 79 HD2 HIS 79 -8.634 1.085 3.077 565 HE1 HIS 79 HE1 HIS 79 -6.935 1.792 -0.746 566 HE2 HIS 79 HE2 HIS 79 -6.742 0.506 1.411 567 H ALA 80 H ALA 80 -12.344 2.985 0.218 568 HA ALA 80 HA ALA 80 -14.344 4.785 -0.412 569 HB1 ALA 80 HB1 ALA 80 -13.901 2.608 -1.545 570 HB2 ALA 80 HB2 ALA 80 -15.600 2.954 -1.226 571 HB3 ALA 80 HB3 ALA 80 -14.722 1.827 -0.192 572 H ASP 81 H ASP 81 -13.725 3.281 2.551 573 HA ASP 81 HA ASP 81 -16.446 3.602 3.478 574 HB2 ASP 81 HB2 ASP 81 -14.477 1.663 4.015 575 HB3 ASP 81 HB3 ASP 81 -14.873 2.487 5.512 576 H GLY 82 H GLY 82 -13.503 5.136 3.444 577 HA2 GLY 82 HA2 GLY 82 -13.382 7.417 4.194 578 HA3 GLY 82 HA3 GLY 82 -14.361 6.964 5.579 579 H MET 83 H MET 83 -12.430 4.424 5.323 580 HA MET 83 HA MET 83 -10.804 5.080 7.456 581 HB2 MET 83 HB2 MET 83 -9.715 2.856 6.811 582 HB3 MET 83 HB3 MET 83 -11.369 2.849 7.334 583 HG2 MET 83 HG2 MET 83 -11.690 3.074 4.667 584 HG3 MET 83 HG3 MET 83 -10.197 2.139 4.745 585 HE1 MET 83 HE1 MET 83 -13.132 -0.358 3.895 586 HE2 MET 83 HE2 MET 83 -11.407 -0.186 3.589 587 HE3 MET 83 HE3 MET 83 -12.491 1.159 3.262 588 H HIS 84 H HIS 84 -8.308 4.569 7.323 589 HA HIS 84 HA HIS 84 -7.344 6.096 5.055 590 HB2 HIS 84 HB2 HIS 84 -6.396 6.098 7.908 591 HB3 HIS 84 HB3 HIS 84 -5.419 6.747 6.600 592 HD1 HIS 84 HD1 HIS 84 -5.989 9.071 5.762 593 HD2 HIS 84 HD2 HIS 84 -8.784 7.574 8.446 594 HE1 HIS 84 HE1 HIS 84 -7.480 11.016 6.336 595 HE2 HIS 84 HE2 HIS 84 -9.169 10.084 7.954 596 H THR 85 H THR 85 -5.407 5.452 4.025 597 HA THR 85 HA THR 85 -4.158 3.006 4.952 598 HB THR 85 HB THR 85 -4.198 2.783 2.184 599 HG1 THR 85 HG1 THR 85 -6.253 3.093 1.531 600 HG21 THR 85 HG21 THR 85 -5.555 0.780 2.616 601 HG22 THR 85 HG22 THR 85 -5.895 1.374 4.240 602 HG23 THR 85 HG23 THR 85 -4.247 0.943 3.786 603 H GLY 86 H GLY 86 -2.067 3.196 4.899 604 HA2 GLY 86 HA2 GLY 86 -0.858 5.340 3.298 605 HA3 GLY 86 HA3 GLY 86 -0.159 4.652 4.754 606 H TYR 87 H TYR 87 1.131 4.966 2.246 607 HA TYR 87 HA TYR 87 1.842 2.231 1.680 608 HB2 TYR 87 HB2 TYR 87 1.539 4.378 -0.456 609 HB3 TYR 87 HB3 TYR 87 2.018 2.712 -0.726 610 HD1 TYR 87 HD1 TYR 87 -0.919 4.616 0.710 611 HD2 TYR 87 HD2 TYR 87 0.404 1.267 -1.589 612 HE1 TYR 87 HE1 TYR 87 -3.248 4.019 0.234 613 HE2 TYR 87 HE2 TYR 87 -1.955 0.676 -2.065 614 HH TYR 87 HH TYR 87 -4.161 1.031 -1.088 615 H ALA 88 H ALA 88 3.744 2.296 2.776 616 HA ALA 88 HA ALA 88 5.506 4.599 2.262 617 HB1 ALA 88 HB1 ALA 88 4.789 4.440 4.588 618 HB2 ALA 88 HB2 ALA 88 6.530 4.215 4.433 619 HB3 ALA 88 HB3 ALA 88 5.484 2.826 4.700 620 H HIS 89 H HIS 89 7.853 4.144 2.593 621 HA HIS 89 HA HIS 89 9.791 3.255 1.879 622 HB2 HIS 89 HB2 HIS 89 8.307 0.661 2.337 623 HB3 HIS 89 HB3 HIS 89 9.990 0.712 1.821 624 HD1 HIS 89 HD1 HIS 89 11.538 2.291 3.534 625 HD2 HIS 89 HD2 HIS 89 8.056 0.594 5.029 626 HE1 HIS 89 HE1 HIS 89 11.779 2.338 6.037 627 HE2 HIS 89 HE2 HIS 89 9.664 1.307 6.919 628 H LEU 90 H LEU 90 8.077 4.241 -0.032 629 HA LEU 90 HA LEU 90 8.432 2.577 -2.375 630 HB2 LEU 90 HB2 LEU 90 6.975 5.191 -2.309 631 HB3 LEU 90 HB3 LEU 90 6.806 3.889 -3.460 632 HG LEU 90 HG LEU 90 5.944 3.635 -0.574 633 HD11 LEU 90 HD11 LEU 90 4.749 5.480 -1.702 634 HD12 LEU 90 HD12 LEU 90 3.700 4.127 -1.285 635 HD13 LEU 90 HD13 LEU 90 4.233 4.347 -2.951 636 HD21 LEU 90 HD21 LEU 90 4.466 1.865 -1.654 637 HD22 LEU 90 HD22 LEU 90 6.187 1.508 -1.493 638 HD23 LEU 90 HD23 LEU 90 5.532 2.004 -3.052 639 H SER 91 H SER 91 9.088 3.828 -4.421 640 HA SER 91 HA SER 91 11.361 5.486 -3.754 641 HB2 SER 91 HB2 SER 91 11.806 3.369 -5.005 642 HB3 SER 91 HB3 SER 91 10.871 4.025 -6.344 643 HG SER 91 HG SER 91 12.684 4.894 -6.933 644 H LYS 92 H LYS 92 8.264 5.696 -5.086 645 HA LYS 92 HA LYS 92 8.544 8.398 -5.763 646 HB2 LYS 92 HB2 LYS 92 9.159 6.590 -7.861 647 HB3 LYS 92 HB3 LYS 92 7.605 7.319 -8.227 648 HG2 LYS 92 HG2 LYS 92 8.472 9.446 -8.360 649 HG3 LYS 92 HG3 LYS 92 9.904 9.019 -7.421 650 HD2 LYS 92 HD2 LYS 92 10.797 7.746 -9.238 651 HD3 LYS 92 HD3 LYS 92 9.287 7.882 -10.140 652 HE2 LYS 92 HE2 LYS 92 9.627 10.238 -10.457 653 HE3 LYS 92 HE3 LYS 92 11.024 10.230 -9.381 654 HZ1 LYS 92 HZ1 LYS 92 12.177 8.805 -10.963 655 HZ2 LYS 92 HZ2 LYS 92 11.705 10.255 -11.691 656 HZ3 LYS 92 HZ3 LYS 92 10.838 8.836 -11.998 657 H ILE 93 H ILE 93 6.643 9.337 -6.532 658 HA ILE 93 HA ILE 93 4.207 7.844 -6.069 659 HB ILE 93 HB ILE 93 5.161 10.273 -4.798 660 HG12 ILE 93 HG12 ILE 93 3.171 9.540 -3.238 661 HG13 ILE 93 HG13 ILE 93 3.341 8.039 -4.137 662 HG21 ILE 93 HG21 ILE 93 3.490 11.237 -6.318 663 HG22 ILE 93 HG22 ILE 93 3.185 11.504 -4.601 664 HG23 ILE 93 HG23 ILE 93 2.273 10.277 -5.476 665 HD11 ILE 93 HD11 ILE 93 4.681 7.765 -2.228 666 HD12 ILE 93 HD12 ILE 93 5.348 9.390 -2.361 667 HD13 ILE 93 HD13 ILE 93 5.817 8.146 -3.519 668 H SER 94 H SER 94 2.435 8.404 -7.255 669 HA SER 94 HA SER 94 2.890 10.004 -9.637 670 HB2 SER 94 HB2 SER 94 2.295 7.456 -9.688 671 HB3 SER 94 HB3 SER 94 0.671 8.051 -9.328 672 HG SER 94 HG SER 94 1.486 7.795 -11.665 673 H VAL 95 H VAL 95 1.399 10.030 -6.696 674 HA VAL 95 HA VAL 95 -0.892 11.446 -7.594 675 HB VAL 95 HB VAL 95 -1.478 11.060 -5.037 676 HG11 VAL 95 HG11 VAL 95 -2.831 9.155 -5.728 677 HG12 VAL 95 HG12 VAL 95 -1.872 9.010 -7.200 678 HG13 VAL 95 HG13 VAL 95 -2.872 10.438 -6.935 679 HG21 VAL 95 HG21 VAL 95 0.424 8.856 -5.729 680 HG22 VAL 95 HG22 VAL 95 -0.863 8.632 -4.546 681 HG23 VAL 95 HG23 VAL 95 0.375 9.859 -4.279 682 H SER 96 H SER 96 -1.638 12.817 -5.448 683 HA SER 96 HA SER 96 0.409 14.453 -4.392 684 HB2 SER 96 HB2 SER 96 -0.051 15.440 -6.701 685 HB3 SER 96 HB3 SER 96 -1.666 15.822 -6.104 686 HG SER 96 HG SER 96 0.601 17.180 -5.748 687 H THR 97 H THR 97 -0.334 15.737 -2.729 688 HA THR 97 HA THR 97 -2.329 14.644 -1.139 689 HB THR 97 HB THR 97 -1.331 17.461 -0.798 690 HG1 THR 97 HG1 THR 97 0.186 15.289 -1.026 691 HG21 THR 97 HG21 THR 97 -1.908 15.317 1.255 692 HG22 THR 97 HG22 THR 97 -3.050 16.578 0.791 693 HG23 THR 97 HG23 THR 97 -1.528 17.011 1.570 694 H ASP 98 H ASP 98 -4.466 14.923 -1.060 695 HA ASP 98 HA ASP 98 -6.524 15.917 -1.048 696 HB2 ASP 98 HB2 ASP 98 -5.151 18.200 -1.023 697 HB3 ASP 98 HB3 ASP 98 -5.756 18.300 -2.673 698 H SER 99 H SER 99 -4.689 14.941 -3.628 699 HA SER 99 HA SER 99 -6.573 15.366 -5.719 700 HB2 SER 99 HB2 SER 99 -4.062 15.097 -6.018 701 HB3 SER 99 HB3 SER 99 -4.307 13.381 -5.687 702 HG SER 99 HG SER 99 -4.445 14.455 -8.000 703 H THR 100 H THR 100 -7.893 13.784 -6.676 704 HA THR 100 HA THR 100 -8.823 11.753 -4.919 705 HB THR 100 HB THR 100 -10.373 11.229 -6.891 706 HG1 THR 100 HG1 THR 100 -9.137 12.469 -8.430 707 HG21 THR 100 HG21 THR 100 -11.092 12.329 -4.861 708 HG22 THR 100 HG22 THR 100 -11.854 13.089 -6.259 709 HG23 THR 100 HG23 THR 100 -10.490 13.875 -5.460 710 H VAL 101 H VAL 101 -8.836 9.566 -5.266 711 HA VAL 101 HA VAL 101 -7.134 8.588 -7.369 712 HB VAL 101 HB VAL 101 -6.809 6.702 -5.496 713 HG11 VAL 101 HG11 VAL 101 -5.047 7.604 -6.828 714 HG12 VAL 101 HG12 VAL 101 -4.570 7.687 -5.129 715 HG13 VAL 101 HG13 VAL 101 -5.128 9.139 -5.963 716 HG21 VAL 101 HG21 VAL 101 -6.223 7.778 -3.375 717 HG22 VAL 101 HG22 VAL 101 -7.940 7.914 -3.737 718 HG23 VAL 101 HG23 VAL 101 -6.875 9.297 -3.980 719 H LYS 102 H LYS 102 -7.366 6.235 -7.733 720 HA LYS 102 HA LYS 102 -9.932 5.119 -7.236 721 HB2 LYS 102 HB2 LYS 102 -9.879 6.414 -9.417 722 HB3 LYS 102 HB3 LYS 102 -8.794 5.155 -9.947 723 HG2 LYS 102 HG2 LYS 102 -10.618 3.505 -9.352 724 HG3 LYS 102 HG3 LYS 102 -11.678 4.901 -9.166 725 HD2 LYS 102 HD2 LYS 102 -11.199 5.547 -11.495 726 HD3 LYS 102 HD3 LYS 102 -10.202 4.103 -11.672 727 HE2 LYS 102 HE2 LYS 102 -12.283 3.520 -12.594 728 HE3 LYS 102 HE3 LYS 102 -12.271 2.784 -10.993 729 HZ1 LYS 102 HZ1 LYS 102 -14.382 3.850 -11.434 730 HZ2 LYS 102 HZ2 LYS 102 -13.618 5.330 -11.726 731 HZ3 LYS 102 HZ3 LYS 102 -13.585 4.653 -10.176 732 H GLN 103 H GLN 103 -10.018 2.962 -7.318 733 HA GLN 103 HA GLN 103 -7.854 1.530 -6.458 734 HB2 GLN 103 HB2 GLN 103 -10.365 1.034 -6.260 735 HB3 GLN 103 HB3 GLN 103 -10.199 0.274 -7.829 736 HG2 GLN 103 HG2 GLN 103 -8.320 -0.615 -5.733 737 HG3 GLN 103 HG3 GLN 103 -10.006 -1.084 -5.544 738 HE21 GLN 103 HE21 GLN 103 -8.717 -0.584 -8.669 739 HE22 GLN 103 HE22 GLN 103 -8.616 -2.222 -9.117 740 H GLY 104 H GLY 104 -6.427 0.222 -7.354 741 HA2 GLY 104 HA2 GLY 104 -5.155 -0.906 -8.884 742 HA3 GLY 104 HA3 GLY 104 -6.418 -0.669 -10.030 743 H GLN 105 H GLN 105 -5.894 2.333 -9.059 744 HA GLN 105 HA GLN 105 -4.410 3.070 -11.366 745 HB2 GLN 105 HB2 GLN 105 -6.257 4.409 -10.413 746 HB3 GLN 105 HB3 GLN 105 -5.285 4.714 -8.993 747 HG2 GLN 105 HG2 GLN 105 -3.760 6.055 -10.263 748 HG3 GLN 105 HG3 GLN 105 -4.565 5.616 -11.773 749 HE21 GLN 105 HE21 GLN 105 -5.055 7.192 -8.667 750 HE22 GLN 105 HE22 GLN 105 -6.298 8.262 -9.193 751 H ILE 106 H ILE 106 -2.395 3.778 -11.550 752 HA ILE 106 HA ILE 106 -0.564 2.865 -9.666 753 HB ILE 106 HB ILE 106 -0.147 4.370 -12.170 754 HG12 ILE 106 HG12 ILE 106 0.763 1.573 -11.587 755 HG13 ILE 106 HG13 ILE 106 -0.901 1.886 -12.063 756 HG21 ILE 106 HG21 ILE 106 1.982 3.287 -10.337 757 HG22 ILE 106 HG22 ILE 106 1.688 4.986 -10.705 758 HG23 ILE 106 HG23 ILE 106 2.277 3.900 -11.964 759 HD11 ILE 106 HD11 ILE 106 0.686 1.175 -13.887 760 HD12 ILE 106 HD12 ILE 106 1.447 2.758 -13.721 761 HD13 ILE 106 HD13 ILE 106 -0.247 2.639 -14.199 762 H ILE 107 H ILE 107 -0.566 3.825 -7.825 763 HA ILE 107 HA ILE 107 -0.657 6.659 -7.576 764 HB ILE 107 HB ILE 107 -0.600 6.007 -5.076 765 HG12 ILE 107 HG12 ILE 107 -1.875 3.461 -5.860 766 HG13 ILE 107 HG13 ILE 107 -0.119 3.508 -5.980 767 HG21 ILE 107 HG21 ILE 107 -2.526 6.946 -6.258 768 HG22 ILE 107 HG22 ILE 107 -3.013 5.742 -5.068 769 HG23 ILE 107 HG23 ILE 107 -2.979 5.324 -6.780 770 HD11 ILE 107 HD11 ILE 107 0.028 4.137 -3.632 771 HD12 ILE 107 HD12 ILE 107 -0.847 2.619 -3.840 772 HD13 ILE 107 HD13 ILE 107 -1.732 4.109 -3.511 773 H GLY 108 H GLY 108 1.808 4.445 -7.912 774 HA2 GLY 108 HA2 GLY 108 3.885 6.196 -7.651 775 HA3 GLY 108 HA3 GLY 108 3.706 5.447 -6.072 776 H TYR 109 H TYR 109 5.795 4.659 -6.443 777 HA TYR 109 HA TYR 109 5.905 2.107 -7.741 778 HB2 TYR 109 HB2 TYR 109 8.179 4.091 -7.983 779 HB3 TYR 109 HB3 TYR 109 8.091 2.495 -8.713 780 HD1 TYR 109 HD1 TYR 109 7.091 2.195 -10.852 781 HD2 TYR 109 HD2 TYR 109 6.665 5.893 -8.807 782 HE1 TYR 109 HE1 TYR 109 6.165 3.208 -12.895 783 HE2 TYR 109 HE2 TYR 109 5.737 6.925 -10.841 784 HH TYR 109 HH TYR 109 5.747 6.579 -13.246 785 H THR 110 H THR 110 7.053 0.634 -6.593 786 HA THR 110 HA THR 110 7.411 0.983 -3.852 787 HB THR 110 HB THR 110 8.836 -1.227 -4.260 788 HG1 THR 110 HG1 THR 110 8.163 -2.269 -6.132 789 HG21 THR 110 HG21 THR 110 5.862 -0.867 -4.364 790 HG22 THR 110 HG22 THR 110 6.860 -1.323 -2.984 791 HG23 THR 110 HG23 THR 110 6.611 -2.461 -4.309 792 H GLY 111 H GLY 111 9.338 0.944 -2.509 793 HA2 GLY 111 HA2 GLY 111 11.897 1.266 -3.832 794 HA3 GLY 111 HA3 GLY 111 11.297 2.711 -3.045 795 H ALA 112 H ALA 112 13.302 2.511 -1.901 796 HA ALA 112 HA ALA 112 12.879 1.202 0.591 797 HB1 ALA 112 HB1 ALA 112 14.415 -0.181 -1.168 798 HB2 ALA 112 HB2 ALA 112 14.617 -0.279 0.581 799 HB3 ALA 112 HB3 ALA 112 15.644 0.795 -0.367 800 H THR 113 H THR 113 12.595 3.785 0.194 801 HA THR 113 HA THR 113 15.023 5.308 0.432 802 HB THR 113 HB THR 113 13.427 7.252 0.715 803 HG1 THR 113 HG1 THR 113 11.610 5.098 0.474 804 HG21 THR 113 HG21 THR 113 14.392 6.606 -1.462 805 HG22 THR 113 HG22 THR 113 12.758 7.250 -1.628 806 HG23 THR 113 HG23 THR 113 13.035 5.510 -1.725 807 H GLY 114 H GLY 114 13.486 3.505 2.692 808 HA2 GLY 114 HA2 GLY 114 13.883 5.427 4.889 809 HA3 GLY 114 HA3 GLY 114 12.969 3.930 4.995 810 H GLN 115 H GLN 115 14.252 3.543 6.953 811 HA GLN 115 HA GLN 115 17.072 2.898 6.519 812 HB2 GLN 115 HB2 GLN 115 15.348 3.182 8.963 813 HB3 GLN 115 HB3 GLN 115 16.889 2.344 9.058 814 HG2 GLN 115 HG2 GLN 115 17.980 4.379 8.138 815 HG3 GLN 115 HG3 GLN 115 16.424 5.202 8.244 816 HE21 GLN 115 HE21 GLN 115 15.590 5.733 10.257 817 HE22 GLN 115 HE22 GLN 115 16.552 5.714 11.692 818 H VAL 116 H VAL 116 16.995 1.086 5.262 819 HA VAL 116 HA VAL 116 16.599 -1.421 6.597 820 HB VAL 116 HB VAL 116 15.171 -2.299 4.577 821 HG11 VAL 116 HG11 VAL 116 13.674 -0.684 6.615 822 HG12 VAL 116 HG12 VAL 116 14.572 -2.136 7.055 823 HG13 VAL 116 HG13 VAL 116 13.247 -2.239 5.900 824 HG21 VAL 116 HG21 VAL 116 14.175 0.552 4.668 825 HG22 VAL 116 HG22 VAL 116 13.571 -0.761 3.657 826 HG23 VAL 116 HG23 VAL 116 15.183 -0.103 3.378 827 H THR 117 H THR 117 17.199 -3.287 5.156 828 HA THR 117 HA THR 117 19.482 -2.498 3.501 829 HB THR 117 HB THR 117 19.996 -5.001 3.591 830 HG1 THR 117 HG1 THR 117 18.951 -6.153 5.225 831 HG21 THR 117 HG21 THR 117 19.995 -3.319 6.096 832 HG22 THR 117 HG22 THR 117 21.281 -3.450 4.894 833 HG23 THR 117 HG23 THR 117 20.887 -4.830 5.920 834 H GLY 118 H GLY 118 16.281 -3.651 3.116 835 HA2 GLY 118 HA2 GLY 118 16.837 -4.181 0.280 836 HA3 GLY 118 HA3 GLY 118 15.913 -5.352 1.200 837 HA PRO 119 HA PRO 119 13.094 -1.797 -0.374 838 HB2 PRO 119 HB2 PRO 119 12.498 -3.092 -2.888 839 HB3 PRO 119 HB3 PRO 119 13.228 -1.511 -2.623 840 HG2 PRO 119 HG2 PRO 119 14.570 -3.609 -3.722 841 HG3 PRO 119 HG3 PRO 119 15.354 -2.287 -2.834 842 HD2 PRO 119 HD2 PRO 119 14.654 -5.039 -1.895 843 HD3 PRO 119 HD3 PRO 119 16.115 -4.075 -1.593 844 H HIS 120 H HIS 120 10.836 -1.933 -0.133 845 HA HIS 120 HA HIS 120 9.434 -4.321 -0.616 846 HB2 HIS 120 HB2 HIS 120 8.765 -4.837 1.687 847 HB3 HIS 120 HB3 HIS 120 10.515 -4.915 1.535 848 HD1 HIS 120 HD1 HIS 120 11.888 -3.003 2.692 849 HD2 HIS 120 HD2 HIS 120 7.807 -2.941 3.461 850 HE1 HIS 120 HE1 HIS 120 11.593 -1.440 4.640 851 HE2 HIS 120 HE2 HIS 120 9.119 -1.432 5.100 852 H LEU 121 H LEU 121 7.301 -3.949 1.002 853 HA LEU 121 HA LEU 121 6.200 -1.438 0.203 854 HB2 LEU 121 HB2 LEU 121 5.255 -2.820 -1.375 855 HB3 LEU 121 HB3 LEU 121 5.177 -4.184 -0.303 856 HG LEU 121 HG LEU 121 3.276 -2.955 0.883 857 HD11 LEU 121 HD11 LEU 121 3.407 -1.298 -1.636 858 HD12 LEU 121 HD12 LEU 121 3.616 -0.724 0.019 859 HD13 LEU 121 HD13 LEU 121 2.047 -1.324 -0.515 860 HD21 LEU 121 HD21 LEU 121 2.877 -3.804 -1.981 861 HD22 LEU 121 HD22 LEU 121 1.628 -3.711 -0.740 862 HD23 LEU 121 HD23 LEU 121 2.940 -4.879 -0.584 863 H HIS 122 H HIS 122 4.980 -0.470 1.611 864 HA HIS 122 HA HIS 122 4.401 -1.757 4.108 865 HB2 HIS 122 HB2 HIS 122 6.051 -0.040 4.513 866 HB3 HIS 122 HB3 HIS 122 5.128 1.124 3.575 867 HD2 HIS 122 HD2 HIS 122 2.716 2.029 4.896 868 HE1 HIS 122 HE1 HIS 122 4.034 0.780 8.702 869 HE2 HIS 122 HE2 HIS 122 2.351 2.178 7.448 870 H PHE 123 H PHE 123 2.355 -1.950 4.550 871 HA PHE 123 HA PHE 123 0.441 -0.077 3.376 872 HB2 PHE 123 HB2 PHE 123 0.545 -2.367 2.237 873 HB3 PHE 123 HB3 PHE 123 -0.102 -3.026 3.733 874 HD1 PHE 123 HD1 PHE 123 -2.410 -2.727 4.319 875 HD2 PHE 123 HD2 PHE 123 -0.810 -0.910 0.820 876 HE1 PHE 123 HE1 PHE 123 -4.691 -2.252 3.527 877 HE2 PHE 123 HE2 PHE 123 -3.085 -0.425 0.027 878 HZ PHE 123 HZ PHE 123 -5.029 -1.101 1.377 879 H GLU 124 H GLU 124 -0.271 1.034 5.069 880 HA GLU 124 HA GLU 124 -1.030 -0.310 7.486 881 HB2 GLU 124 HB2 GLU 124 -0.487 1.714 8.698 882 HB3 GLU 124 HB3 GLU 124 0.882 1.249 7.703 883 HG2 GLU 124 HG2 GLU 124 0.374 2.963 6.102 884 HG3 GLU 124 HG3 GLU 124 -1.094 3.396 6.976 885 H MET 125 H MET 125 -3.060 -0.211 8.013 886 HA MET 125 HA MET 125 -4.864 1.593 6.706 887 HB2 MET 125 HB2 MET 125 -5.502 -0.360 5.733 888 HB3 MET 125 HB3 MET 125 -4.899 -1.289 7.063 889 HG2 MET 125 HG2 MET 125 -7.291 -1.555 6.824 890 HG3 MET 125 HG3 MET 125 -6.882 -0.812 8.363 891 HE1 MET 125 HE1 MET 125 -9.303 0.243 8.858 892 HE2 MET 125 HE2 MET 125 -9.672 -0.873 7.545 893 HE3 MET 125 HE3 MET 125 -10.313 0.770 7.511 894 H LEU 126 H LEU 126 -6.261 2.577 7.886 895 HA LEU 126 HA LEU 126 -6.523 2.046 10.715 896 HB2 LEU 126 HB2 LEU 126 -5.292 4.456 9.449 897 HB3 LEU 126 HB3 LEU 126 -6.334 4.740 10.823 898 HG LEU 126 HG LEU 126 -4.742 2.839 11.865 899 HD11 LEU 126 HD11 LEU 126 -2.437 3.253 11.190 900 HD12 LEU 126 HD12 LEU 126 -2.997 4.345 9.923 901 HD13 LEU 126 HD13 LEU 126 -3.390 2.628 9.844 902 HD21 LEU 126 HD21 LEU 126 -5.239 5.001 12.844 903 HD22 LEU 126 HD22 LEU 126 -4.137 5.784 11.712 904 HD23 LEU 126 HD23 LEU 126 -3.510 4.664 12.922 905 HA PRO 127 HA PRO 127 -10.812 3.433 10.120 906 HB2 PRO 127 HB2 PRO 127 -11.121 5.291 12.115 907 HB3 PRO 127 HB3 PRO 127 -11.334 3.569 12.345 908 HG2 PRO 127 HG2 PRO 127 -9.004 5.280 12.993 909 HG3 PRO 127 HG3 PRO 127 -9.645 3.877 13.877 910 HD2 PRO 127 HD2 PRO 127 -7.444 3.687 12.385 911 HD3 PRO 127 HD3 PRO 127 -8.615 2.368 12.467 912 H ALA 128 H ALA 128 -12.203 5.482 10.105 913 HA ALA 128 HA ALA 128 -11.068 7.365 8.368 914 HB1 ALA 128 HB1 ALA 128 -13.666 7.475 9.880 915 HB2 ALA 128 HB2 ALA 128 -13.445 6.780 8.273 916 HB3 ALA 128 HB3 ALA 128 -13.231 8.513 8.522 917 H ASN 129 H ASN 129 -11.484 7.038 11.745 918 HA ASN 129 HA ASN 129 -9.850 9.245 12.429 919 HB2 ASN 129 HB2 ASN 129 -12.778 9.383 13.217 920 HB3 ASN 129 HB3 ASN 129 -11.517 10.307 14.024 921 HD21 ASN 129 HD21 ASN 129 -10.238 11.757 12.633 922 HD22 ASN 129 HD22 ASN 129 -11.042 12.555 11.333 923 HA PRO 130 HA PRO 130 -9.195 5.864 15.018 924 HB2 PRO 130 HB2 PRO 130 -6.597 6.979 15.643 925 HB3 PRO 130 HB3 PRO 130 -7.006 5.501 14.760 926 HG2 PRO 130 HG2 PRO 130 -6.000 7.740 13.537 927 HG3 PRO 130 HG3 PRO 130 -6.972 6.520 12.709 928 HD2 PRO 130 HD2 PRO 130 -7.736 9.202 13.740 929 HD3 PRO 130 HD3 PRO 130 -8.272 8.340 12.283 930 H ASN 131 H ASN 131 -8.556 5.397 17.100 931 HA ASN 131 HA ASN 131 -8.853 7.502 19.066 932 HB2 ASN 131 HB2 ASN 131 -10.571 5.465 18.647 933 HB3 ASN 131 HB3 ASN 131 -9.452 4.744 19.785 934 HD21 ASN 131 HD21 ASN 131 -11.809 7.161 19.218 935 HD22 ASN 131 HD22 ASN 131 -12.071 7.593 20.856 936 H TRP 132 H TRP 132 -6.552 7.629 18.583 937 HA TRP 132 HA TRP 132 -4.718 5.601 19.077 938 HB2 TRP 132 HB2 TRP 132 -4.076 8.511 19.497 939 HB3 TRP 132 HB3 TRP 132 -3.009 7.237 18.927 940 HD1 TRP 132 HD1 TRP 132 -3.500 6.348 16.371 941 HE1 TRP 132 HE1 TRP 132 -4.333 7.663 14.320 942 HE3 TRP 132 HE3 TRP 132 -5.558 10.382 18.751 943 HZ2 TRP 132 HZ2 TRP 132 -5.680 10.029 13.784 944 HZ3 TRP 132 HZ3 TRP 132 -6.610 12.137 17.377 945 HH2 TRP 132 HH2 TRP 132 -6.668 11.965 14.940 946 H GLN 133 H GLN 133 -6.749 6.417 21.238 947 HA GLN 133 HA GLN 133 -5.205 7.130 23.497 948 HB2 GLN 133 HB2 GLN 133 -8.079 6.388 23.083 949 HB3 GLN 133 HB3 GLN 133 -7.393 6.821 24.621 950 HG2 GLN 133 HG2 GLN 133 -8.310 8.832 23.938 951 HG3 GLN 133 HG3 GLN 133 -6.638 8.992 23.406 952 HE21 GLN 133 HE21 GLN 133 -6.184 8.467 21.149 953 HE22 GLN 133 HE22 GLN 133 -7.380 8.722 19.941 954 H ASN 134 H ASN 134 -4.445 4.737 22.294 955 HA ASN 134 HA ASN 134 -3.472 2.788 22.841 956 HB2 ASN 134 HB2 ASN 134 -4.614 3.394 25.564 957 HB3 ASN 134 HB3 ASN 134 -3.724 1.911 25.221 958 HD21 ASN 134 HD21 ASN 134 -3.519 5.418 25.077 959 HD22 ASN 134 HD22 ASN 134 -1.813 5.511 25.291 960 H GLY 135 H GLY 135 -4.098 0.923 22.103 961 HA2 GLY 135 HA2 GLY 135 -5.938 -0.836 22.880 962 HA3 GLY 135 HA3 GLY 135 -6.934 0.364 22.075 963 H PHE 136 H PHE 136 -5.549 1.053 19.851 964 HA PHE 136 HA PHE 136 -4.579 -1.319 18.505 965 HB2 PHE 136 HB2 PHE 136 -6.205 -1.294 16.690 966 HB3 PHE 136 HB3 PHE 136 -7.009 -1.569 18.221 967 HD1 PHE 136 HD1 PHE 136 -8.081 -0.631 15.467 968 HD2 PHE 136 HD2 PHE 136 -7.094 1.470 19.045 969 HE1 PHE 136 HE1 PHE 136 -9.701 1.124 14.889 970 HE2 PHE 136 HE2 PHE 136 -8.712 3.212 18.462 971 HZ PHE 136 HZ PHE 136 -10.019 3.047 16.388 972 H SER 137 H SER 137 -4.988 2.021 18.731 973 HA SER 137 HA SER 137 -3.939 3.827 17.931 974 HB2 SER 137 HB2 SER 137 -1.993 1.757 16.916 975 HB3 SER 137 HB3 SER 137 -1.782 3.473 16.573 976 HG SER 137 HG SER 137 -1.453 3.866 18.692 977 H GLY 138 H GLY 138 -5.884 2.075 16.636 978 HA2 GLY 138 HA2 GLY 138 -7.340 2.367 14.907 979 HA3 GLY 138 HA3 GLY 138 -6.312 3.644 14.296 980 H ARG 139 H ARG 139 -4.116 1.384 14.626 981 HA ARG 139 HA ARG 139 -4.312 0.647 11.845 982 HB2 ARG 139 HB2 ARG 139 -2.081 -0.570 12.356 983 HB3 ARG 139 HB3 ARG 139 -2.115 1.183 12.361 984 HG2 ARG 139 HG2 ARG 139 -0.939 0.844 14.271 985 HG3 ARG 139 HG3 ARG 139 -2.558 0.784 14.953 986 HD2 ARG 139 HD2 ARG 139 -2.443 -1.727 14.608 987 HD3 ARG 139 HD3 ARG 139 -0.727 -1.502 14.282 988 HE ARG 139 HE ARG 139 -2.076 -1.197 16.847 989 HH11 ARG 139 HH11 ARG 139 0.928 -0.878 15.012 990 HH12 ARG 139 HH12 ARG 139 1.944 -0.817 16.497 991 HH21 ARG 139 HH21 ARG 139 0.980 -0.948 18.556 992 HH22 ARG 139 HH22 ARG 139 -0.806 -1.113 18.721 993 H ILE 140 H ILE 140 -5.202 -1.127 11.043 994 HA ILE 140 HA ILE 140 -5.333 -3.498 12.724 995 HB ILE 140 HB ILE 140 -7.471 -3.448 10.796 996 HG12 ILE 140 HG12 ILE 140 -8.820 -1.955 12.542 997 HG13 ILE 140 HG13 ILE 140 -7.237 -1.220 12.765 998 HG21 ILE 140 HG21 ILE 140 -7.244 -5.127 12.531 999 HG22 ILE 140 HG22 ILE 140 -8.761 -4.245 12.704 1000 HG23 ILE 140 HG23 ILE 140 -7.403 -3.880 13.768 1001 HD11 ILE 140 HD11 ILE 140 -8.824 -0.165 11.080 1002 HD12 ILE 140 HD12 ILE 140 -8.437 -1.541 10.045 1003 HD13 ILE 140 HD13 ILE 140 -7.159 -0.448 10.576 1004 H ASP 141 H ASP 141 -6.351 -5.359 11.039 1005 HA ASP 141 HA ASP 141 -4.046 -6.038 9.518 1006 HB2 ASP 141 HB2 ASP 141 -5.268 -8.198 9.115 1007 HB3 ASP 141 HB3 ASP 141 -4.977 -7.789 10.798 1008 HA PRO 142 HA PRO 142 -5.695 -4.802 5.493 1009 HB2 PRO 142 HB2 PRO 142 -3.539 -6.066 4.125 1010 HB3 PRO 142 HB3 PRO 142 -3.751 -4.351 4.472 1011 HG2 PRO 142 HG2 PRO 142 -1.805 -5.971 5.577 1012 HG3 PRO 142 HG3 PRO 142 -2.328 -4.407 6.220 1013 HD2 PRO 142 HD2 PRO 142 -3.008 -7.147 7.129 1014 HD3 PRO 142 HD3 PRO 142 -2.841 -5.645 8.056 1015 H THR 143 H THR 143 -5.573 -7.945 6.622 1016 HA THR 143 HA THR 143 -5.703 -9.637 4.478 1017 HB THR 143 HB THR 143 -7.379 -10.885 6.119 1018 HG1 THR 143 HG1 THR 143 -7.728 -9.404 7.666 1019 HG21 THR 143 HG21 THR 143 -5.450 -11.865 7.227 1020 HG22 THR 143 HG22 THR 143 -4.454 -10.503 6.714 1021 HG23 THR 143 HG23 THR 143 -5.110 -11.617 5.514 1022 H GLY 144 H GLY 144 -8.072 -7.384 5.479 1023 HA2 GLY 144 HA2 GLY 144 -10.350 -8.630 4.226 1024 HA3 GLY 144 HA3 GLY 144 -10.269 -6.980 4.830 1025 H TYR 145 H TYR 145 -7.775 -6.603 3.203 1026 HA TYR 145 HA TYR 145 -9.044 -5.923 0.699 1027 HB2 TYR 145 HB2 TYR 145 -6.366 -4.962 1.700 1028 HB3 TYR 145 HB3 TYR 145 -7.301 -4.300 0.370 1029 HD1 TYR 145 HD1 TYR 145 -8.768 -2.513 0.735 1030 HD2 TYR 145 HD2 TYR 145 -7.355 -4.757 4.056 1031 HE1 TYR 145 HE1 TYR 145 -9.764 -0.871 2.265 1032 HE2 TYR 145 HE2 TYR 145 -8.351 -3.129 5.596 1033 HH TYR 145 HH TYR 145 -10.624 -0.990 4.801 1034 H ILE 146 H ILE 146 -6.948 -8.181 2.013 1035 HA ILE 146 HA ILE 146 -5.554 -8.661 -0.463 1036 HB ILE 146 HB ILE 146 -4.975 -9.937 2.203 1037 HG12 ILE 146 HG12 ILE 146 -4.621 -7.537 2.442 1038 HG13 ILE 146 HG13 ILE 146 -3.075 -8.367 2.441 1039 HG21 ILE 146 HG21 ILE 146 -3.475 -9.945 -0.398 1040 HG22 ILE 146 HG22 ILE 146 -3.989 -11.310 0.593 1041 HG23 ILE 146 HG23 ILE 146 -2.670 -10.275 1.136 1042 HD11 ILE 146 HD11 ILE 146 -2.971 -6.273 1.199 1043 HD12 ILE 146 HD12 ILE 146 -4.254 -6.829 0.124 1044 HD13 ILE 146 HD13 ILE 146 -2.693 -7.649 0.130 1045 H ALA 147 H ALA 147 -8.177 -9.739 1.281 1046 HA ALA 147 HA ALA 147 -8.200 -12.482 0.601 1047 HB1 ALA 147 HB1 ALA 147 -10.476 -12.481 1.378 1048 HB2 ALA 147 HB2 ALA 147 -10.504 -10.720 1.332 1049 HB3 ALA 147 HB3 ALA 147 -9.463 -11.554 2.484 1050 H ASN 148 H ASN 148 -9.100 -9.618 -1.052 1051 HA ASN 148 HA ASN 148 -10.519 -11.037 -3.091 1052 HB2 ASN 148 HB2 ASN 148 -10.232 -8.080 -3.133 1053 HB3 ASN 148 HB3 ASN 148 -11.609 -9.061 -3.527 1054 HD21 ASN 148 HD21 ASN 148 -9.800 -7.660 -0.982 1055 HD22 ASN 148 HD22 ASN 148 -11.021 -7.733 0.235 1056 H ALA 149 H ALA 149 -7.585 -10.767 -2.429 1057 HA ALA 149 HA ALA 149 -6.573 -9.632 -4.819 1058 HB1 ALA 149 HB1 ALA 149 -5.715 -9.966 -2.127 1059 HB2 ALA 149 HB2 ALA 149 -4.998 -8.955 -3.385 1060 HB3 ALA 149 HB3 ALA 149 -4.494 -10.640 -3.207 1061 HA PRO 150 HA PRO 150 -5.427 -13.266 -7.141 1062 HB2 PRO 150 HB2 PRO 150 -2.655 -13.183 -7.205 1063 HB3 PRO 150 HB3 PRO 150 -3.733 -12.308 -8.302 1064 HG2 PRO 150 HG2 PRO 150 -2.389 -11.347 -5.829 1065 HG3 PRO 150 HG3 PRO 150 -2.620 -10.516 -7.378 1066 HD2 PRO 150 HD2 PRO 150 -4.165 -9.910 -5.297 1067 HD3 PRO 150 HD3 PRO 150 -4.861 -10.039 -6.928 1068 H VAL 151 H VAL 151 -3.793 -15.222 -7.157 1069 HA VAL 151 HA VAL 151 -3.815 -16.383 -4.491 1070 HB VAL 151 HB VAL 151 -4.091 -17.762 -7.110 1071 HG11 VAL 151 HG11 VAL 151 -2.843 -19.016 -5.311 1072 HG12 VAL 151 HG12 VAL 151 -4.268 -19.827 -5.977 1073 HG13 VAL 151 HG13 VAL 151 -4.363 -19.028 -4.408 1074 HG21 VAL 151 HG21 VAL 151 -6.114 -16.536 -6.432 1075 HG22 VAL 151 HG22 VAL 151 -6.124 -17.441 -4.918 1076 HG23 VAL 151 HG23 VAL 151 -6.363 -18.282 -6.449 1077 H PHE 152 H PHE 152 -2.063 -17.123 -3.701 1078 HA PHE 152 HA PHE 152 0.438 -17.136 -5.223 1079 HB2 PHE 152 HB2 PHE 152 0.467 -15.692 -3.270 1080 HB3 PHE 152 HB3 PHE 152 -0.147 -16.976 -2.240 1081 HD1 PHE 152 HD1 PHE 152 1.320 -18.784 -1.529 1082 HD2 PHE 152 HD2 PHE 152 2.764 -15.547 -3.846 1083 HE1 PHE 152 HE1 PHE 152 3.635 -19.416 -0.958 1084 HE2 PHE 152 HE2 PHE 152 5.082 -16.161 -3.300 1085 HZ PHE 152 HZ PHE 152 5.521 -18.104 -1.851 1086 H ASN 153 H ASN 153 0.447 -19.104 -6.196 1087 HA ASN 153 HA ASN 153 0.852 -21.307 -6.510 1088 HB2 ASN 153 HB2 ASN 153 1.581 -21.060 -3.630 1089 HB3 ASN 153 HB3 ASN 153 1.430 -22.672 -4.324 1090 HD21 ASN 153 HD21 ASN 153 3.038 -19.571 -4.693 1091 HD22 ASN 153 HD22 ASN 153 4.452 -20.186 -5.470 1092 H GLY 154 H GLY 154 -1.401 -20.595 -3.899 1093 HA2 GLY 154 HA2 GLY 154 -3.700 -21.439 -4.265 1094 HA3 GLY 154 HA3 GLY 154 -2.967 -22.985 -4.674 1095 H THR 155 H THR 155 -3.284 -20.640 -2.034 1096 HA THR 155 HA THR 155 -2.609 -22.597 -0.041 1097 HB THR 155 HB THR 155 -3.035 -20.576 1.469 1098 HG1 THR 155 HG1 THR 155 -2.854 -18.555 0.314 1099 HG21 THR 155 HG21 THR 155 -0.842 -20.429 -0.588 1100 HG22 THR 155 HG22 THR 155 -0.792 -21.361 0.910 1101 HG23 THR 155 HG23 THR 155 -0.842 -19.600 0.969 1102 H THR 156 H THR 156 -4.192 -23.953 0.339 1103 HA THR 156 HA THR 156 -6.960 -23.073 0.564 1104 HB THR 156 HB THR 156 -7.403 -25.560 0.943 1105 HG1 THR 156 HG1 THR 156 -4.650 -25.538 0.699 1106 HG21 THR 156 HG21 THR 156 -7.072 -26.117 -1.467 1107 HG22 THR 156 HG22 THR 156 -6.169 -24.613 -1.645 1108 HG23 THR 156 HG23 THR 156 -7.874 -24.570 -1.197 1109 HA PRO 157 HA PRO 157 -6.783 -23.161 5.020 1110 HB2 PRO 157 HB2 PRO 157 -9.572 -23.449 5.422 1111 HB3 PRO 157 HB3 PRO 157 -8.651 -21.941 5.391 1112 HG2 PRO 157 HG2 PRO 157 -10.541 -22.707 3.505 1113 HG3 PRO 157 HG3 PRO 157 -9.309 -21.449 3.284 1114 HD2 PRO 157 HD2 PRO 157 -9.323 -24.266 2.326 1115 HD3 PRO 157 HD3 PRO 157 -8.669 -22.810 1.559 1116 H THR 158 H THR 158 -8.773 -25.562 3.525 1117 HA THR 158 HA THR 158 -7.787 -27.696 5.087 1118 HB THR 158 HB THR 158 -9.379 -26.903 6.725 1119 HG1 THR 158 HG1 THR 158 -10.638 -28.828 6.935 1120 HG21 THR 158 HG21 THR 158 -11.747 -26.728 6.428 1121 HG22 THR 158 HG22 THR 158 -11.618 -27.289 4.763 1122 HG23 THR 158 HG23 THR 158 -10.952 -25.721 5.217 1123 H GLU 159 H GLU 159 -10.696 -26.837 3.359 1124 HA GLU 159 HA GLU 159 -10.707 -29.223 1.780 1125 HB2 GLU 159 HB2 GLU 159 -12.502 -26.846 2.006 1126 HB3 GLU 159 HB3 GLU 159 -12.670 -27.927 0.631 1127 HG2 GLU 159 HG2 GLU 159 -13.127 -29.786 2.082 1128 HG3 GLU 159 HG3 GLU 159 -12.804 -28.802 3.507 Start of MODEL 6 1 H1 MET 1 H1 MET 1 -13.947 -46.500 -11.623 2 H2 MET 1 H2 MET 1 -15.360 -45.674 -11.200 3 H3 MET 1 H3 MET 1 -13.876 -44.862 -11.202 4 HA MET 1 HA MET 1 -15.229 -45.992 -13.582 5 HB2 MET 1 HB2 MET 1 -15.883 -43.693 -12.245 6 HB3 MET 1 HB3 MET 1 -14.718 -43.098 -13.419 7 HG2 MET 1 HG2 MET 1 -17.179 -44.701 -14.076 8 HG3 MET 1 HG3 MET 1 -17.038 -42.950 -14.208 9 HE1 MET 1 HE1 MET 1 -18.004 -44.814 -16.580 10 HE2 MET 1 HE2 MET 1 -17.108 -44.154 -17.948 11 HE3 MET 1 HE3 MET 1 -17.835 -43.069 -16.764 12 H ARG 2 H ARG 2 -14.122 -45.851 -15.496 13 HA ARG 2 HA ARG 2 -11.234 -45.550 -15.268 14 HB2 ARG 2 HB2 ARG 2 -12.847 -47.337 -16.610 15 HB3 ARG 2 HB3 ARG 2 -12.324 -46.259 -17.895 16 HG2 ARG 2 HG2 ARG 2 -10.082 -46.824 -17.626 17 HG3 ARG 2 HG3 ARG 2 -10.336 -47.456 -15.998 18 HD2 ARG 2 HD2 ARG 2 -11.575 -48.722 -18.427 19 HD3 ARG 2 HD3 ARG 2 -9.966 -49.158 -17.854 20 HE ARG 2 HE ARG 2 -11.480 -49.441 -15.640 21 HH11 ARG 2 HH11 ARG 2 -11.849 -50.684 -18.922 22 HH12 ARG 2 HH12 ARG 2 -12.712 -52.165 -18.370 23 HH21 ARG 2 HH21 ARG 2 -12.568 -51.295 -14.932 24 HH22 ARG 2 HH22 ARG 2 -13.111 -52.504 -16.152 25 H GLY 3 H GLY 3 -10.159 -43.816 -15.907 26 HA2 GLY 3 HA2 GLY 3 -9.947 -42.313 -17.985 27 HA3 GLY 3 HA3 GLY 3 -11.557 -41.782 -17.518 28 H SER 4 H SER 4 -8.589 -40.700 -17.554 29 HA SER 4 HA SER 4 -8.555 -39.609 -14.829 30 HB2 SER 4 HB2 SER 4 -6.390 -39.652 -16.944 31 HB3 SER 4 HB3 SER 4 -6.218 -38.952 -15.334 32 HG SER 4 HG SER 4 -7.037 -41.273 -14.777 33 H HIS 5 H HIS 5 -8.336 -38.577 -18.233 34 HA HIS 5 HA HIS 5 -8.936 -35.824 -17.377 35 HB2 HIS 5 HB2 HIS 5 -7.333 -36.939 -19.635 36 HB3 HIS 5 HB3 HIS 5 -8.142 -35.393 -19.865 37 HD1 HIS 5 HD1 HIS 5 -5.434 -37.028 -17.835 38 HD2 HIS 5 HD2 HIS 5 -7.003 -33.244 -18.532 39 HE1 HIS 5 HE1 HIS 5 -3.807 -35.422 -16.788 40 HE2 HIS 5 HE2 HIS 5 -4.776 -33.136 -17.223 41 H HIS 6 H HIS 6 -10.804 -34.934 -17.913 42 HA HIS 6 HA HIS 6 -12.349 -35.998 -20.168 43 HB2 HIS 6 HB2 HIS 6 -13.015 -36.429 -17.448 44 HB3 HIS 6 HB3 HIS 6 -14.157 -35.243 -18.069 45 HD1 HIS 6 HD1 HIS 6 -15.730 -36.018 -20.007 46 HD2 HIS 6 HD2 HIS 6 -13.318 -39.009 -18.425 47 HE1 HIS 6 HE1 HIS 6 -16.694 -38.179 -20.856 48 HE2 HIS 6 HE2 HIS 6 -15.218 -39.978 -19.888 49 H HIS 7 H HIS 7 -12.090 -33.419 -17.726 50 HA HIS 7 HA HIS 7 -12.807 -31.455 -19.792 51 HB2 HIS 7 HB2 HIS 7 -13.936 -31.636 -16.997 52 HB3 HIS 7 HB3 HIS 7 -14.009 -30.161 -17.955 53 HD1 HIS 7 HD1 HIS 7 -15.555 -30.200 -20.066 54 HD2 HIS 7 HD2 HIS 7 -15.770 -33.600 -17.686 55 HE1 HIS 7 HE1 HIS 7 -17.623 -31.417 -20.818 56 HE2 HIS 7 HE2 HIS 7 -17.734 -33.473 -19.366 57 H HIS 8 H HIS 8 -11.855 -29.413 -19.574 58 HA HIS 8 HA HIS 8 -9.701 -29.216 -17.570 59 HB2 HIS 8 HB2 HIS 8 -9.158 -29.637 -20.142 60 HB3 HIS 8 HB3 HIS 8 -9.389 -27.894 -20.229 61 HD1 HIS 8 HD1 HIS 8 -7.017 -30.494 -19.087 62 HD2 HIS 8 HD2 HIS 8 -7.464 -26.374 -18.769 63 HE1 HIS 8 HE1 HIS 8 -4.797 -29.638 -18.273 64 HE2 HIS 8 HE2 HIS 8 -5.089 -27.142 -18.088 65 H HIS 9 H HIS 9 -9.587 -27.368 -16.440 66 HA HIS 9 HA HIS 9 -11.336 -25.133 -17.243 67 HB2 HIS 9 HB2 HIS 9 -10.719 -26.234 -14.505 68 HB3 HIS 9 HB3 HIS 9 -11.388 -24.622 -14.737 69 HD1 HIS 9 HD1 HIS 9 -12.313 -28.183 -14.619 70 HD2 HIS 9 HD2 HIS 9 -14.043 -24.606 -15.835 71 HE1 HIS 9 HE1 HIS 9 -14.770 -28.669 -14.846 72 HE2 HIS 9 HE2 HIS 9 -15.799 -26.490 -15.583 73 H HIS 10 H HIS 10 -10.607 -23.030 -16.918 74 HA HIS 10 HA HIS 10 -7.684 -22.761 -16.660 75 HB2 HIS 10 HB2 HIS 10 -9.774 -21.094 -18.056 76 HB3 HIS 10 HB3 HIS 10 -8.160 -20.472 -17.727 77 HD1 HIS 10 HD1 HIS 10 -6.176 -21.598 -19.007 78 HD2 HIS 10 HD2 HIS 10 -9.951 -22.902 -20.155 79 HE1 HIS 10 HE1 HIS 10 -5.832 -22.836 -21.168 80 HE2 HIS 10 HE2 HIS 10 -8.129 -23.617 -21.846 81 H GLY 11 H GLY 11 -6.805 -20.974 -15.489 82 HA2 GLY 11 HA2 GLY 11 -8.142 -19.084 -13.976 83 HA3 GLY 11 HA3 GLY 11 -8.054 -20.523 -12.968 84 H SER 12 H SER 12 -6.016 -18.421 -14.983 85 HA SER 12 HA SER 12 -3.633 -19.134 -13.462 86 HB2 SER 12 HB2 SER 12 -4.181 -17.762 -16.028 87 HB3 SER 12 HB3 SER 12 -2.762 -17.214 -15.121 88 HG SER 12 HG SER 12 -3.019 -19.394 -16.636 89 H ALA 13 H ALA 13 -2.171 -17.502 -12.696 90 HA ALA 13 HA ALA 13 -3.007 -14.844 -12.329 91 HB1 ALA 13 HB1 ALA 13 -2.922 -16.674 -9.938 92 HB2 ALA 13 HB2 ALA 13 -4.268 -15.672 -10.478 93 HB3 ALA 13 HB3 ALA 13 -2.825 -14.918 -9.797 94 H THR 14 H THR 14 -1.214 -13.695 -12.624 95 HA THR 14 HA THR 14 1.358 -14.927 -12.303 96 HB THR 14 HB THR 14 0.896 -13.792 -14.399 97 HG1 THR 14 HG1 THR 14 2.853 -12.751 -14.517 98 HG21 THR 14 HG21 THR 14 0.800 -11.314 -14.510 99 HG22 THR 14 HG22 THR 14 0.670 -11.268 -12.753 100 HG23 THR 14 HG23 THR 14 -0.603 -12.023 -13.709 101 H TYR 15 H TYR 15 -0.605 -12.883 -10.474 102 HA TYR 15 HA TYR 15 1.570 -11.619 -9.090 103 HB2 TYR 15 HB2 TYR 15 -1.168 -10.972 -9.603 104 HB3 TYR 15 HB3 TYR 15 -0.745 -10.763 -7.911 105 HD1 TYR 15 HD1 TYR 15 -0.653 -9.306 -11.156 106 HD2 TYR 15 HD2 TYR 15 1.357 -9.349 -7.408 107 HE1 TYR 15 HE1 TYR 15 0.381 -7.140 -11.692 108 HE2 TYR 15 HE2 TYR 15 2.393 -7.180 -7.930 109 HH TYR 15 HH TYR 15 2.965 -5.847 -9.918 110 H THR 16 H THR 16 2.414 -12.372 -7.401 111 HA THR 16 HA THR 16 1.020 -14.448 -5.945 112 HB THR 16 HB THR 16 3.293 -14.880 -4.912 113 HG1 THR 16 HG1 THR 16 3.841 -12.619 -6.280 114 HG21 THR 16 HG21 THR 16 4.202 -15.963 -6.938 115 HG22 THR 16 HG22 THR 16 3.014 -15.089 -7.907 116 HG23 THR 16 HG23 THR 16 2.480 -16.276 -6.715 117 H ARG 17 H ARG 17 0.694 -14.408 -3.718 118 HA ARG 17 HA ARG 17 0.517 -11.869 -2.471 119 HB2 ARG 17 HB2 ARG 17 -0.842 -14.249 -2.264 120 HB3 ARG 17 HB3 ARG 17 0.102 -14.223 -0.782 121 HG2 ARG 17 HG2 ARG 17 -1.272 -12.752 0.155 122 HG3 ARG 17 HG3 ARG 17 -1.211 -11.685 -1.247 123 HD2 ARG 17 HD2 ARG 17 -3.485 -12.511 -0.745 124 HD3 ARG 17 HD3 ARG 17 -2.926 -12.948 -2.356 125 HE ARG 17 HE ARG 17 -2.341 -15.175 -1.181 126 HH11 ARG 17 HH11 ARG 17 -5.151 -13.165 -0.460 127 HH12 ARG 17 HH12 ARG 17 -6.145 -14.568 0.079 128 HH21 ARG 17 HH21 ARG 17 -5.271 -16.673 0.056 129 HH22 ARG 17 HH22 ARG 17 -3.580 -16.953 -0.503 130 HA PRO 18 HA PRO 18 4.710 -12.331 -0.666 131 HB2 PRO 18 HB2 PRO 18 4.084 -9.725 0.552 132 HB3 PRO 18 HB3 PRO 18 5.432 -10.169 -0.501 133 HG2 PRO 18 HG2 PRO 18 3.453 -8.601 -1.378 134 HG3 PRO 18 HG3 PRO 18 4.246 -9.784 -2.435 135 HD2 PRO 18 HD2 PRO 18 1.588 -9.957 -1.079 136 HD3 PRO 18 HD3 PRO 18 2.067 -10.481 -2.709 137 H LEU 19 H LEU 19 1.708 -11.537 0.912 138 HA LEU 19 HA LEU 19 2.569 -12.825 3.361 139 HB2 LEU 19 HB2 LEU 19 2.023 -10.071 3.123 140 HB3 LEU 19 HB3 LEU 19 0.722 -10.781 4.013 141 HG LEU 19 HG LEU 19 2.492 -9.746 5.394 142 HD11 LEU 19 HD11 LEU 19 1.825 -12.669 5.698 143 HD12 LEU 19 HD12 LEU 19 1.128 -11.275 6.536 144 HD13 LEU 19 HD13 LEU 19 2.772 -11.803 6.910 145 HD21 LEU 19 HD21 LEU 19 4.375 -10.573 3.888 146 HD22 LEU 19 HD22 LEU 19 4.202 -12.122 4.714 147 HD23 LEU 19 HD23 LEU 19 4.638 -10.680 5.630 148 H ASP 20 H ASP 20 0.502 -12.626 4.758 149 HA ASP 20 HA ASP 20 -1.824 -13.554 3.332 150 HB2 ASP 20 HB2 ASP 20 -0.236 -15.031 5.141 151 HB3 ASP 20 HB3 ASP 20 -1.807 -14.736 5.872 152 H THR 21 H THR 21 -0.347 -11.777 5.789 153 HA THR 21 HA THR 21 -2.523 -10.143 6.318 154 HB THR 21 HB THR 21 -3.263 -12.174 7.544 155 HG1 THR 21 HG1 THR 21 -4.295 -10.720 8.663 156 HG21 THR 21 HG21 THR 21 -0.937 -11.571 9.377 157 HG22 THR 21 HG22 THR 21 -1.167 -13.028 8.409 158 HG23 THR 21 HG23 THR 21 -2.256 -12.680 9.753 159 H GLY 22 H GLY 22 -1.949 -9.162 8.730 160 HA2 GLY 22 HA2 GLY 22 0.719 -8.752 9.467 161 HA3 GLY 22 HA3 GLY 22 0.209 -7.435 8.420 162 H ASN 23 H ASN 23 0.391 -8.457 11.597 163 HA ASN 23 HA ASN 23 -1.281 -6.317 12.515 164 HB2 ASN 23 HB2 ASN 23 -2.479 -7.861 14.158 165 HB3 ASN 23 HB3 ASN 23 -3.013 -7.928 12.484 166 HD21 ASN 23 HD21 ASN 23 -2.038 -9.647 11.148 167 HD22 ASN 23 HD22 ASN 23 -1.709 -11.172 11.881 168 H ILE 24 H ILE 24 -0.466 -5.270 13.978 169 HA ILE 24 HA ILE 24 1.651 -6.443 15.608 170 HB ILE 24 HB ILE 24 1.220 -3.578 15.792 171 HG12 ILE 24 HG12 ILE 24 2.716 -3.291 13.653 172 HG13 ILE 24 HG13 ILE 24 2.030 -4.848 13.211 173 HG21 ILE 24 HG21 ILE 24 3.770 -3.628 15.534 174 HG22 ILE 24 HG22 ILE 24 3.593 -5.375 15.668 175 HG23 ILE 24 HG23 ILE 24 3.058 -4.336 16.984 176 HD11 ILE 24 HD11 ILE 24 -0.238 -3.733 13.708 177 HD12 ILE 24 HD12 ILE 24 0.594 -3.365 12.191 178 HD13 ILE 24 HD13 ILE 24 0.661 -2.221 13.533 179 H THR 25 H THR 25 -0.469 -7.332 16.378 180 HA THR 25 HA THR 25 -1.604 -5.758 18.570 181 HB THR 25 HB THR 25 -3.269 -6.729 17.141 182 HG1 THR 25 HG1 THR 25 -4.273 -8.231 18.767 183 HG21 THR 25 HG21 THR 25 -1.873 -8.606 16.258 184 HG22 THR 25 HG22 THR 25 -3.528 -9.064 16.668 185 HG23 THR 25 HG23 THR 25 -2.202 -9.483 17.754 186 H THR 26 H THR 26 0.333 -8.528 17.882 187 HA THR 26 HA THR 26 0.584 -9.133 20.752 188 HB THR 26 HB THR 26 1.384 -11.077 18.607 189 HG1 THR 26 HG1 THR 26 -0.881 -11.941 19.265 190 HG21 THR 26 HG21 THR 26 2.103 -11.593 20.872 191 HG22 THR 26 HG22 THR 26 0.859 -12.736 20.364 192 HG23 THR 26 HG23 THR 26 0.450 -11.418 21.464 193 H GLY 27 H GLY 27 2.507 -9.637 17.867 194 HA2 GLY 27 HA2 GLY 27 4.669 -7.956 18.680 195 HA3 GLY 27 HA3 GLY 27 5.035 -9.648 18.983 196 H PHE 28 H PHE 28 5.621 -7.287 16.857 197 HA PHE 28 HA PHE 28 5.123 -8.648 14.411 198 HB2 PHE 28 HB2 PHE 28 5.587 -6.000 15.063 199 HB3 PHE 28 HB3 PHE 28 7.009 -6.475 14.142 200 HD1 PHE 28 HD1 PHE 28 6.920 -6.319 11.851 201 HD2 PHE 28 HD2 PHE 28 3.265 -6.816 13.973 202 HE1 PHE 28 HE1 PHE 28 5.677 -6.135 9.746 203 HE2 PHE 28 HE2 PHE 28 2.020 -6.636 11.867 204 HZ PHE 28 HZ PHE 28 3.223 -6.301 9.756 205 H ASN 29 H ASN 29 6.633 -9.100 12.805 206 HA ASN 29 HA ASN 29 8.333 -11.098 13.493 207 HB2 ASN 29 HB2 ASN 29 7.884 -9.512 11.032 208 HB3 ASN 29 HB3 ASN 29 9.067 -10.799 11.045 209 HD21 ASN 29 HD21 ASN 29 5.824 -9.947 10.866 210 HD22 ASN 29 HD22 ASN 29 5.155 -11.529 10.738 211 H GLY 30 H GLY 30 9.211 -8.710 14.843 212 HA2 GLY 30 HA2 GLY 30 11.474 -8.461 15.665 213 HA3 GLY 30 HA3 GLY 30 12.055 -8.837 14.046 214 H TYR 31 H TYR 31 9.441 -6.988 13.626 215 HA TYR 31 HA TYR 31 11.037 -4.504 13.385 216 HB2 TYR 31 HB2 TYR 31 8.290 -4.958 12.209 217 HB3 TYR 31 HB3 TYR 31 9.462 -3.737 11.764 218 HD1 TYR 31 HD1 TYR 31 8.864 -7.422 11.657 219 HD2 TYR 31 HD2 TYR 31 10.936 -4.101 9.988 220 HE1 TYR 31 HE1 TYR 31 9.667 -8.851 9.823 221 HE2 TYR 31 HE2 TYR 31 11.744 -5.523 8.154 222 HH TYR 31 HH TYR 31 12.141 -7.915 7.710 223 HA PRO 32 HA PRO 32 8.360 -3.700 17.094 224 HB2 PRO 32 HB2 PRO 32 10.553 -2.176 18.214 225 HB3 PRO 32 HB3 PRO 32 9.856 -3.691 18.798 226 HG2 PRO 32 HG2 PRO 32 12.369 -3.513 17.769 227 HG3 PRO 32 HG3 PRO 32 11.382 -4.986 17.703 228 HD2 PRO 32 HD2 PRO 32 11.863 -2.945 15.568 229 HD3 PRO 32 HD3 PRO 32 11.809 -4.719 15.450 230 H GLY 33 H GLY 33 7.086 -1.964 17.450 231 HA2 GLY 33 HA2 GLY 33 6.489 0.307 17.597 232 HA3 GLY 33 HA3 GLY 33 7.994 0.735 16.799 233 H HIS 34 H HIS 34 6.569 -1.705 15.084 234 HA HIS 34 HA HIS 34 5.910 -0.079 12.882 235 HB2 HIS 34 HB2 HIS 34 6.946 -2.476 12.995 236 HB3 HIS 34 HB3 HIS 34 5.275 -3.007 13.097 237 HD1 HIS 34 HD1 HIS 34 4.651 -3.881 10.860 238 HD2 HIS 34 HD2 HIS 34 6.973 -0.463 10.567 239 HE1 HIS 34 HE1 HIS 34 4.789 -3.300 8.404 240 H VAL 35 H VAL 35 3.960 0.610 12.246 241 HA VAL 35 HA VAL 35 1.618 -0.160 13.842 242 HB VAL 35 HB VAL 35 0.842 2.052 12.377 243 HG11 VAL 35 HG11 VAL 35 1.582 1.536 15.199 244 HG12 VAL 35 HG12 VAL 35 0.059 2.119 14.517 245 HG13 VAL 35 HG13 VAL 35 1.422 3.219 14.707 246 HG21 VAL 35 HG21 VAL 35 3.626 2.584 13.398 247 HG22 VAL 35 HG22 VAL 35 2.514 3.779 12.732 248 HG23 VAL 35 HG23 VAL 35 3.152 2.498 11.701 249 H GLY 36 H GLY 36 2.990 -0.864 10.934 250 HA2 GLY 36 HA2 GLY 36 0.384 -1.550 9.765 251 HA3 GLY 36 HA3 GLY 36 1.609 -0.758 8.781 252 H VAL 37 H VAL 37 1.737 -2.451 7.366 253 HA VAL 37 HA VAL 37 3.208 -4.777 8.353 254 HB VAL 37 HB VAL 37 0.885 -5.464 8.054 255 HG11 VAL 37 HG11 VAL 37 1.161 -4.113 5.476 256 HG12 VAL 37 HG12 VAL 37 -0.272 -4.400 6.461 257 HG13 VAL 37 HG13 VAL 37 0.344 -5.672 5.405 258 HG21 VAL 37 HG21 VAL 37 2.854 -6.660 6.118 259 HG22 VAL 37 HG22 VAL 37 1.276 -7.373 6.442 260 HG23 VAL 37 HG23 VAL 37 2.453 -7.208 7.746 261 H ASP 38 H ASP 38 4.691 -5.720 6.880 262 HA ASP 38 HA ASP 38 5.292 -4.083 4.510 263 HB2 ASP 38 HB2 ASP 38 7.237 -5.091 6.594 264 HB3 ASP 38 HB3 ASP 38 7.733 -4.431 5.038 265 H TYR 39 H TYR 39 5.764 -5.024 2.709 266 HA TYR 39 HA TYR 39 6.017 -7.963 2.624 267 HB2 TYR 39 HB2 TYR 39 4.688 -6.379 0.437 268 HB3 TYR 39 HB3 TYR 39 4.615 -8.095 0.731 269 HD1 TYR 39 HD1 TYR 39 3.578 -4.862 2.220 270 HD2 TYR 39 HD2 TYR 39 2.661 -8.986 1.745 271 HE1 TYR 39 HE1 TYR 39 1.395 -4.497 3.248 272 HE2 TYR 39 HE2 TYR 39 0.470 -8.619 2.780 273 HH TYR 39 HH TYR 39 -0.828 -5.540 3.283 274 H ALA 40 H ALA 40 8.044 -8.315 2.042 275 HA ALA 40 HA ALA 40 9.811 -6.684 0.709 276 HB1 ALA 40 HB1 ALA 40 11.199 -8.653 0.363 277 HB2 ALA 40 HB2 ALA 40 9.823 -9.694 0.730 278 HB3 ALA 40 HB3 ALA 40 10.495 -8.648 1.981 279 H VAL 41 H VAL 41 9.518 -5.777 -1.189 280 HA VAL 41 HA VAL 41 9.129 -7.395 -3.532 281 HB VAL 41 HB VAL 41 6.821 -6.780 -2.900 282 HG11 VAL 41 HG11 VAL 41 7.038 -4.731 -1.745 283 HG12 VAL 41 HG12 VAL 41 6.076 -4.401 -3.186 284 HG13 VAL 41 HG13 VAL 41 7.777 -3.941 -3.136 285 HG21 VAL 41 HG21 VAL 41 7.780 -5.442 -5.423 286 HG22 VAL 41 HG22 VAL 41 6.101 -5.830 -5.053 287 HG23 VAL 41 HG23 VAL 41 7.283 -7.124 -5.239 288 HA PRO 42 HA PRO 42 12.525 -4.733 -4.735 289 HB2 PRO 42 HB2 PRO 42 12.286 -5.108 -7.477 290 HB3 PRO 42 HB3 PRO 42 13.184 -6.158 -6.374 291 HG2 PRO 42 HG2 PRO 42 10.461 -6.516 -7.512 292 HG3 PRO 42 HG3 PRO 42 11.709 -7.728 -7.165 293 HD2 PRO 42 HD2 PRO 42 9.572 -7.409 -5.576 294 HD3 PRO 42 HD3 PRO 42 11.161 -7.848 -4.922 295 H VAL 43 H VAL 43 12.961 -2.894 -5.299 296 HA VAL 43 HA VAL 43 11.118 -0.840 -5.489 297 HB VAL 43 HB VAL 43 13.209 -0.519 -4.443 298 HG11 VAL 43 HG11 VAL 43 14.656 -2.043 -5.462 299 HG12 VAL 43 HG12 VAL 43 15.366 -0.454 -5.735 300 HG13 VAL 43 HG13 VAL 43 14.501 -1.269 -7.038 301 HG21 VAL 43 HG21 VAL 43 13.738 1.156 -6.845 302 HG22 VAL 43 HG22 VAL 43 13.729 1.614 -5.143 303 HG23 VAL 43 HG23 VAL 43 12.207 1.374 -6.006 304 H GLY 44 H GLY 44 10.344 0.409 -7.102 305 HA2 GLY 44 HA2 GLY 44 10.502 1.431 -9.252 306 HA3 GLY 44 HA3 GLY 44 11.427 0.044 -9.772 307 H THR 45 H THR 45 8.911 -1.165 -8.038 308 HA THR 45 HA THR 45 7.464 -1.886 -10.399 309 HB THR 45 HB THR 45 6.725 -2.761 -7.627 310 HG1 THR 45 HG1 THR 45 8.637 -3.653 -7.489 311 HG21 THR 45 HG21 THR 45 6.598 -4.180 -10.295 312 HG22 THR 45 HG22 THR 45 5.237 -3.394 -9.496 313 HG23 THR 45 HG23 THR 45 6.000 -4.802 -8.757 314 HA PRO 46 HA PRO 46 4.592 1.572 -9.834 315 HB2 PRO 46 HB2 PRO 46 2.804 -0.117 -11.512 316 HB3 PRO 46 HB3 PRO 46 3.276 1.575 -11.721 317 HG2 PRO 46 HG2 PRO 46 4.314 -0.305 -13.278 318 HG3 PRO 46 HG3 PRO 46 5.305 1.045 -12.690 319 HD2 PRO 46 HD2 PRO 46 5.246 -1.793 -11.766 320 HD3 PRO 46 HD3 PRO 46 6.621 -0.681 -11.932 321 H VAL 47 H VAL 47 3.351 1.869 -8.145 322 HA VAL 47 HA VAL 47 1.866 -0.288 -6.971 323 HB VAL 47 HB VAL 47 2.317 2.392 -5.688 324 HG11 VAL 47 HG11 VAL 47 1.798 -0.326 -4.481 325 HG12 VAL 47 HG12 VAL 47 0.608 0.961 -4.675 326 HG13 VAL 47 HG13 VAL 47 1.981 1.188 -3.593 327 HG21 VAL 47 HG21 VAL 47 4.116 0.753 -4.433 328 HG22 VAL 47 HG22 VAL 47 4.521 1.956 -5.658 329 HG23 VAL 47 HG23 VAL 47 4.280 0.272 -6.121 330 H ARG 48 H ARG 48 -0.087 -0.434 -7.281 331 HA ARG 48 HA ARG 48 -1.583 1.819 -8.201 332 HB2 ARG 48 HB2 ARG 48 -2.182 -1.119 -8.452 333 HB3 ARG 48 HB3 ARG 48 -3.290 0.144 -8.971 334 HG2 ARG 48 HG2 ARG 48 -2.305 -0.199 -10.962 335 HG3 ARG 48 HG3 ARG 48 -1.087 0.898 -10.308 336 HD2 ARG 48 HD2 ARG 48 0.190 -1.072 -9.511 337 HD3 ARG 48 HD3 ARG 48 -0.994 -2.115 -10.298 338 HE ARG 48 HE ARG 48 0.883 -0.308 -11.663 339 HH11 ARG 48 HH11 ARG 48 -0.919 -3.459 -13.463 340 HH12 ARG 48 HH12 ARG 48 -1.380 -3.017 -11.778 341 HH21 ARG 48 HH21 ARG 48 0.662 -2.254 -14.577 342 HH22 ARG 48 HH22 ARG 48 1.465 -0.848 -13.786 343 H ALA 49 H ALA 49 -3.696 2.231 -7.508 344 HA ALA 49 HA ALA 49 -3.864 2.159 -4.693 345 HB1 ALA 49 HB1 ALA 49 -4.617 4.103 -5.933 346 HB2 ALA 49 HB2 ALA 49 -5.938 3.435 -4.977 347 HB3 ALA 49 HB3 ALA 49 -5.871 3.138 -6.714 348 H VAL 50 H VAL 50 -4.735 0.664 -3.467 349 HA VAL 50 HA VAL 50 -6.009 -1.614 -4.448 350 HB VAL 50 HB VAL 50 -5.948 -0.657 -1.638 351 HG11 VAL 50 HG11 VAL 50 -6.327 -3.493 -2.553 352 HG12 VAL 50 HG12 VAL 50 -7.659 -2.433 -2.099 353 HG13 VAL 50 HG13 VAL 50 -6.439 -2.871 -0.905 354 HG21 VAL 50 HG21 VAL 50 -4.095 -2.526 -3.083 355 HG22 VAL 50 HG22 VAL 50 -4.042 -2.181 -1.354 356 HG23 VAL 50 HG23 VAL 50 -3.714 -0.900 -2.521 357 H ALA 51 H ALA 51 -7.349 1.407 -3.616 358 HA ALA 51 HA ALA 51 -9.918 0.741 -4.514 359 HB1 ALA 51 HB1 ALA 51 -10.336 -0.242 -2.404 360 HB2 ALA 51 HB2 ALA 51 -11.088 1.354 -2.345 361 HB3 ALA 51 HB3 ALA 51 -9.533 1.079 -1.558 362 H ASN 52 H ASN 52 -11.107 2.499 -4.995 363 HA ASN 52 HA ASN 52 -9.880 4.923 -5.403 364 HB2 ASN 52 HB2 ASN 52 -12.303 5.694 -5.785 365 HB3 ASN 52 HB3 ASN 52 -11.654 4.465 -6.810 366 HD21 ASN 52 HD21 ASN 52 -12.855 4.106 -3.572 367 HD22 ASN 52 HD22 ASN 52 -14.171 3.065 -3.963 368 H GLY 53 H GLY 53 -10.386 7.024 -4.569 369 HA2 GLY 53 HA2 GLY 53 -11.914 7.671 -2.373 370 HA3 GLY 53 HA3 GLY 53 -10.402 7.085 -1.706 371 H THR 54 H THR 54 -9.159 8.710 -1.096 372 HA THR 54 HA THR 54 -8.653 10.938 -2.793 373 HB THR 54 HB THR 54 -9.500 11.327 0.015 374 HG1 THR 54 HG1 THR 54 -11.042 11.763 -2.331 375 HG21 THR 54 HG21 THR 54 -9.213 13.345 -2.213 376 HG22 THR 54 HG22 THR 54 -8.056 13.110 -0.902 377 HG23 THR 54 HG23 THR 54 -9.679 13.701 -0.550 378 H VAL 55 H VAL 55 -6.633 11.775 -2.465 379 HA VAL 55 HA VAL 55 -4.786 10.272 -0.881 380 HB VAL 55 HB VAL 55 -4.163 12.671 -2.604 381 HG11 VAL 55 HG11 VAL 55 -2.371 11.903 -1.096 382 HG12 VAL 55 HG12 VAL 55 -1.944 11.747 -2.800 383 HG13 VAL 55 HG13 VAL 55 -2.424 10.322 -1.876 384 HG21 VAL 55 HG21 VAL 55 -5.386 11.048 -3.974 385 HG22 VAL 55 HG22 VAL 55 -4.222 9.802 -3.527 386 HG23 VAL 55 HG23 VAL 55 -3.706 11.192 -4.478 387 H LYS 56 H LYS 56 -4.581 10.847 1.121 388 HA LYS 56 HA LYS 56 -5.007 13.538 2.065 389 HB2 LYS 56 HB2 LYS 56 -4.274 11.523 4.083 390 HB3 LYS 56 HB3 LYS 56 -5.536 12.735 4.128 391 HG2 LYS 56 HG2 LYS 56 -5.648 10.026 2.834 392 HG3 LYS 56 HG3 LYS 56 -6.539 10.574 4.245 393 HD2 LYS 56 HD2 LYS 56 -6.874 12.007 1.654 394 HD3 LYS 56 HD3 LYS 56 -7.682 10.456 1.878 395 HE2 LYS 56 HE2 LYS 56 -8.706 11.380 3.972 396 HE3 LYS 56 HE3 LYS 56 -8.020 12.949 3.550 397 HZ1 LYS 56 HZ1 LYS 56 -9.300 12.912 1.498 398 HZ2 LYS 56 HZ2 LYS 56 -10.319 12.775 2.842 399 HZ3 LYS 56 HZ3 LYS 56 -9.961 11.410 1.909 400 H PHE 57 H PHE 57 -2.519 11.502 1.221 401 HA PHE 57 HA PHE 57 -0.517 13.376 2.002 402 HB2 PHE 57 HB2 PHE 57 -0.838 11.609 3.928 403 HB3 PHE 57 HB3 PHE 57 0.048 10.553 2.833 404 HD1 PHE 57 HD1 PHE 57 2.363 11.048 2.222 405 HD2 PHE 57 HD2 PHE 57 0.257 13.405 5.072 406 HE1 PHE 57 HE1 PHE 57 4.490 12.021 2.980 407 HE2 PHE 57 HE2 PHE 57 2.382 14.379 5.839 408 HZ PHE 57 HZ PHE 57 4.501 13.690 4.793 409 H ALA 58 H ALA 58 1.212 13.306 0.760 410 HA ALA 58 HA ALA 58 1.709 11.238 -1.139 411 HB1 ALA 58 HB1 ALA 58 0.178 12.581 -2.426 412 HB2 ALA 58 HB2 ALA 58 1.804 12.860 -3.045 413 HB3 ALA 58 HB3 ALA 58 1.044 14.055 -1.995 414 H GLY 59 H GLY 59 3.554 10.897 -0.096 415 HA2 GLY 59 HA2 GLY 59 5.494 13.024 0.310 416 HA3 GLY 59 HA3 GLY 59 5.601 11.379 0.911 417 H ASN 60 H ASN 60 6.122 13.487 -1.800 418 HA ASN 60 HA ASN 60 7.133 11.609 -3.643 419 HB2 ASN 60 HB2 ASN 60 7.340 14.605 -3.451 420 HB3 ASN 60 HB3 ASN 60 8.064 13.694 -4.769 421 HD21 ASN 60 HD21 ASN 60 5.026 13.146 -3.087 422 HD22 ASN 60 HD22 ASN 60 4.034 13.349 -4.467 423 H GLY 61 H GLY 61 8.903 10.677 -3.784 424 HA2 GLY 61 HA2 GLY 61 11.083 11.080 -1.934 425 HA3 GLY 61 HA3 GLY 61 10.955 9.810 -3.135 426 H ALA 62 H ALA 62 10.351 12.585 -4.759 427 HA ALA 62 HA ALA 62 12.892 12.582 -6.022 428 HB1 ALA 62 HB1 ALA 62 10.800 12.833 -7.275 429 HB2 ALA 62 HB2 ALA 62 11.933 14.150 -7.578 430 HB3 ALA 62 HB3 ALA 62 10.561 14.399 -6.498 431 H ASN 63 H ASN 63 11.300 14.617 -3.726 432 HA ASN 63 HA ASN 63 13.661 16.264 -3.525 433 HB2 ASN 63 HB2 ASN 63 11.354 17.167 -4.748 434 HB3 ASN 63 HB3 ASN 63 11.345 17.872 -3.145 435 HD21 ASN 63 HD21 ASN 63 12.652 17.900 -6.237 436 HD22 ASN 63 HD22 ASN 63 13.776 19.187 -6.021 437 H HIS 64 H HIS 64 12.423 14.134 -1.864 438 HA HIS 64 HA HIS 64 11.340 15.408 0.370 439 HB2 HIS 64 HB2 HIS 64 11.304 13.152 1.350 440 HB3 HIS 64 HB3 HIS 64 10.494 13.254 -0.185 441 HD1 HIS 64 HD1 HIS 64 11.136 10.521 0.630 442 HD2 HIS 64 HD2 HIS 64 13.968 12.856 -1.322 443 HE1 HIS 64 HE1 HIS 64 12.775 8.902 -0.368 444 HE2 HIS 64 HE2 HIS 64 14.482 10.333 -1.541 445 HA PRO 65 HA PRO 65 15.344 16.212 2.381 446 HB2 PRO 65 HB2 PRO 65 13.564 17.235 4.517 447 HB3 PRO 65 HB3 PRO 65 14.877 18.073 3.663 448 HG2 PRO 65 HG2 PRO 65 12.386 18.731 3.190 449 HG3 PRO 65 HG3 PRO 65 13.534 18.575 1.838 450 HD2 PRO 65 HD2 PRO 65 11.523 16.565 2.829 451 HD3 PRO 65 HD3 PRO 65 11.826 17.161 1.198 452 H TRP 66 H TRP 66 16.302 15.559 4.358 453 HA TRP 66 HA TRP 66 14.984 13.259 5.530 454 HB2 TRP 66 HB2 TRP 66 17.869 14.104 5.731 455 HB3 TRP 66 HB3 TRP 66 17.155 12.702 6.519 456 HD1 TRP 66 HD1 TRP 66 17.769 14.020 2.923 457 HE1 TRP 66 HE1 TRP 66 18.068 11.996 1.365 458 HE3 TRP 66 HE3 TRP 66 16.903 10.252 6.285 459 HZ2 TRP 66 HZ2 TRP 66 17.954 9.186 1.529 460 HZ3 TRP 66 HZ3 TRP 66 17.019 7.925 5.496 461 HH2 TRP 66 HH2 TRP 66 17.533 7.405 3.167 462 H MET 67 H MET 67 14.764 16.306 5.941 463 HA MET 67 HA MET 67 15.469 16.692 8.669 464 HB2 MET 67 HB2 MET 67 14.223 18.335 6.542 465 HB3 MET 67 HB3 MET 67 13.868 18.784 8.204 466 HG2 MET 67 HG2 MET 67 16.317 18.893 8.628 467 HG3 MET 67 HG3 MET 67 16.575 18.622 6.905 468 HE1 MET 67 HE1 MET 67 18.084 20.960 7.181 469 HE2 MET 67 HE2 MET 67 17.527 21.116 8.847 470 HE3 MET 67 HE3 MET 67 17.362 22.471 7.731 471 H LEU 68 H LEU 68 12.515 16.201 6.831 472 HA LEU 68 HA LEU 68 11.260 15.469 9.375 473 HB2 LEU 68 HB2 LEU 68 9.106 16.234 8.571 474 HB3 LEU 68 HB3 LEU 68 10.267 17.535 8.541 475 HG LEU 68 HG LEU 68 10.445 16.725 5.975 476 HD11 LEU 68 HD11 LEU 68 8.723 14.983 6.287 477 HD12 LEU 68 HD12 LEU 68 8.207 16.220 5.142 478 HD13 LEU 68 HD13 LEU 68 7.567 16.219 6.785 479 HD21 LEU 68 HD21 LEU 68 10.063 19.002 6.721 480 HD22 LEU 68 HD22 LEU 68 8.399 18.611 7.154 481 HD23 LEU 68 HD23 LEU 68 8.902 18.577 5.464 482 H TRP 69 H TRP 69 12.756 14.041 6.964 483 HA TRP 69 HA TRP 69 10.725 11.920 6.802 484 HB2 TRP 69 HB2 TRP 69 12.597 12.401 4.501 485 HB3 TRP 69 HB3 TRP 69 11.087 11.504 4.518 486 HD1 TRP 69 HD1 TRP 69 12.005 15.219 5.243 487 HE1 TRP 69 HE1 TRP 69 10.325 16.719 4.045 488 HE3 TRP 69 HE3 TRP 69 9.152 11.615 2.996 489 HZ2 TRP 69 HZ2 TRP 69 8.118 16.444 2.331 490 HZ3 TRP 69 HZ3 TRP 69 7.285 12.340 1.585 491 HH2 TRP 69 HH2 TRP 69 6.773 14.701 1.258 492 H MET 70 H MET 70 11.409 9.815 6.805 493 HA MET 70 HA MET 70 14.265 9.257 7.116 494 HB2 MET 70 HB2 MET 70 12.121 8.649 9.131 495 HB3 MET 70 HB3 MET 70 13.535 7.611 8.998 496 HG2 MET 70 HG2 MET 70 14.978 9.559 9.396 497 HG3 MET 70 HG3 MET 70 13.543 10.564 9.585 498 HE1 MET 70 HE1 MET 70 16.016 10.137 11.714 499 HE2 MET 70 HE2 MET 70 15.094 10.179 13.217 500 HE3 MET 70 HE3 MET 70 14.718 11.313 11.918 501 H ALA 71 H ALA 71 10.989 8.091 6.560 502 HA ALA 71 HA ALA 71 11.908 5.506 5.595 503 HB1 ALA 71 HB1 ALA 71 9.851 5.678 6.945 504 HB2 ALA 71 HB2 ALA 71 9.573 4.943 5.366 505 HB3 ALA 71 HB3 ALA 71 9.112 6.621 5.651 506 H GLY 72 H GLY 72 11.120 8.583 4.356 507 HA2 GLY 72 HA2 GLY 72 11.719 9.317 2.193 508 HA3 GLY 72 HA3 GLY 72 11.645 7.660 1.639 509 H ASN 73 H ASN 73 9.973 7.117 0.416 510 HA ASN 73 HA ASN 73 7.898 8.990 -0.125 511 HB2 ASN 73 HB2 ASN 73 8.522 6.268 -1.229 512 HB3 ASN 73 HB3 ASN 73 7.137 7.220 -1.750 513 HD21 ASN 73 HD21 ASN 73 10.640 7.167 -1.558 514 HD22 ASN 73 HD22 ASN 73 10.911 8.210 -2.906 515 H ALA 74 H ALA 74 5.798 8.911 0.401 516 HA ALA 74 HA ALA 74 4.631 6.564 1.551 517 HB1 ALA 74 HB1 ALA 74 5.595 7.635 3.521 518 HB2 ALA 74 HB2 ALA 74 3.833 7.671 3.583 519 HB3 ALA 74 HB3 ALA 74 4.728 9.122 3.133 520 H VAL 75 H VAL 75 2.379 6.506 1.487 521 HA VAL 75 HA VAL 75 1.010 8.804 0.320 522 HB VAL 75 HB VAL 75 0.241 6.138 -0.789 523 HG11 VAL 75 HG11 VAL 75 0.321 8.833 -2.125 524 HG12 VAL 75 HG12 VAL 75 -1.041 8.262 -1.161 525 HG13 VAL 75 HG13 VAL 75 -0.574 7.396 -2.625 526 HG21 VAL 75 HG21 VAL 75 2.730 6.333 -1.113 527 HG22 VAL 75 HG22 VAL 75 2.399 7.747 -2.110 528 HG23 VAL 75 HG23 VAL 75 1.777 6.170 -2.588 529 H LEU 76 H LEU 76 -0.710 9.211 1.470 530 HA LEU 76 HA LEU 76 -2.111 6.994 2.742 531 HB2 LEU 76 HB2 LEU 76 -0.944 9.106 4.041 532 HB3 LEU 76 HB3 LEU 76 -2.611 9.598 3.947 533 HG LEU 76 HG LEU 76 -2.444 6.867 4.846 534 HD11 LEU 76 HD11 LEU 76 -0.199 7.470 5.599 535 HD12 LEU 76 HD12 LEU 76 -1.294 7.219 6.959 536 HD13 LEU 76 HD13 LEU 76 -0.861 8.856 6.465 537 HD21 LEU 76 HD21 LEU 76 -3.347 9.428 6.159 538 HD22 LEU 76 HD22 LEU 76 -3.666 7.806 6.769 539 HD23 LEU 76 HD23 LEU 76 -4.346 8.315 5.224 540 H ILE 77 H ILE 77 -4.060 6.825 2.340 541 HA ILE 77 HA ILE 77 -5.591 8.806 0.954 542 HB ILE 77 HB ILE 77 -4.866 6.109 -0.111 543 HG12 ILE 77 HG12 ILE 77 -5.035 8.496 -1.840 544 HG13 ILE 77 HG13 ILE 77 -3.747 8.467 -0.638 545 HG21 ILE 77 HG21 ILE 77 -7.346 6.328 -0.241 546 HG22 ILE 77 HG22 ILE 77 -6.559 6.187 -1.812 547 HG23 ILE 77 HG23 ILE 77 -7.114 7.761 -1.244 548 HD11 ILE 77 HD11 ILE 77 -2.857 6.440 -1.573 549 HD12 ILE 77 HD12 ILE 77 -3.048 7.637 -2.854 550 HD13 ILE 77 HD13 ILE 77 -4.211 6.321 -2.697 551 H GLN 78 H GLN 78 -7.758 8.496 1.074 552 HA GLN 78 HA GLN 78 -8.751 6.796 3.158 553 HB2 GLN 78 HB2 GLN 78 -9.236 9.161 3.420 554 HB3 GLN 78 HB3 GLN 78 -9.967 9.219 1.827 555 HG2 GLN 78 HG2 GLN 78 -11.419 7.256 3.025 556 HG3 GLN 78 HG3 GLN 78 -11.103 8.333 4.372 557 HE21 GLN 78 HE21 GLN 78 -12.475 7.952 1.285 558 HE22 GLN 78 HE22 GLN 78 -13.518 9.317 1.306 559 H HIS 79 H HIS 79 -9.588 5.008 2.537 560 HA HIS 79 HA HIS 79 -10.186 4.307 -0.116 561 HB2 HIS 79 HB2 HIS 79 -10.355 2.932 2.494 562 HB3 HIS 79 HB3 HIS 79 -11.267 2.258 1.149 563 HD1 HIS 79 HD1 HIS 79 -8.908 3.183 -0.918 564 HD2 HIS 79 HD2 HIS 79 -8.584 0.720 2.414 565 HE1 HIS 79 HE1 HIS 79 -6.843 1.789 -1.306 566 HE2 HIS 79 HE2 HIS 79 -6.674 0.301 0.719 567 H ALA 80 H ALA 80 -12.230 2.827 -0.354 568 HA ALA 80 HA ALA 80 -14.298 4.599 -0.807 569 HB1 ALA 80 HB1 ALA 80 -14.426 1.608 -0.912 570 HB2 ALA 80 HB2 ALA 80 -13.859 2.652 -2.216 571 HB3 ALA 80 HB3 ALA 80 -15.542 2.727 -1.694 572 H ASP 81 H ASP 81 -13.588 2.858 1.992 573 HA ASP 81 HA ASP 81 -16.303 2.898 2.965 574 HB2 ASP 81 HB2 ASP 81 -14.136 1.139 3.356 575 HB3 ASP 81 HB3 ASP 81 -14.605 1.814 4.908 576 H GLY 82 H GLY 82 -13.442 4.622 3.061 577 HA2 GLY 82 HA2 GLY 82 -13.477 6.869 3.913 578 HA3 GLY 82 HA3 GLY 82 -14.470 6.297 5.245 579 H MET 83 H MET 83 -12.384 3.880 4.926 580 HA MET 83 HA MET 83 -10.853 4.601 7.127 581 HB2 MET 83 HB2 MET 83 -9.709 2.406 6.590 582 HB3 MET 83 HB3 MET 83 -11.386 2.363 7.013 583 HG2 MET 83 HG2 MET 83 -11.859 2.259 4.532 584 HG3 MET 83 HG3 MET 83 -10.131 1.983 4.329 585 HE1 MET 83 HE1 MET 83 -11.242 -1.597 3.676 586 HE2 MET 83 HE2 MET 83 -10.711 -0.053 3.008 587 HE3 MET 83 HE3 MET 83 -12.420 -0.333 3.334 588 H HIS 84 H HIS 84 -8.407 4.324 7.157 589 HA HIS 84 HA HIS 84 -7.396 5.795 4.881 590 HB2 HIS 84 HB2 HIS 84 -6.486 5.727 7.743 591 HB3 HIS 84 HB3 HIS 84 -5.473 6.393 6.470 592 HD1 HIS 84 HD1 HIS 84 -5.888 8.781 5.839 593 HD2 HIS 84 HD2 HIS 84 -8.977 7.185 8.111 594 HE1 HIS 84 HE1 HIS 84 -7.387 10.722 6.391 595 HE2 HIS 84 HE2 HIS 84 -9.255 9.733 7.760 596 H THR 85 H THR 85 -5.497 5.152 3.799 597 HA THR 85 HA THR 85 -4.272 2.662 4.661 598 HB THR 85 HB THR 85 -4.262 2.585 1.878 599 HG1 THR 85 HG1 THR 85 -6.188 3.157 1.181 600 HG21 THR 85 HG21 THR 85 -4.371 0.655 3.370 601 HG22 THR 85 HG22 THR 85 -5.655 0.586 2.163 602 HG23 THR 85 HG23 THR 85 -6.023 1.086 3.814 603 H GLY 86 H GLY 86 -2.174 2.838 4.660 604 HA2 GLY 86 HA2 GLY 86 -0.920 5.052 3.198 605 HA3 GLY 86 HA3 GLY 86 -0.253 4.272 4.626 606 H TYR 87 H TYR 87 1.056 4.723 2.143 607 HA TYR 87 HA TYR 87 1.842 2.034 1.443 608 HB2 TYR 87 HB2 TYR 87 1.525 4.246 -0.617 609 HB3 TYR 87 HB3 TYR 87 1.927 2.568 -0.928 610 HD1 TYR 87 HD1 TYR 87 -0.905 4.595 0.547 611 HD2 TYR 87 HD2 TYR 87 0.235 1.205 -1.790 612 HE1 TYR 87 HE1 TYR 87 -3.261 4.134 0.060 613 HE2 TYR 87 HE2 TYR 87 -2.153 0.751 -2.275 614 HH TYR 87 HH TYR 87 -4.612 2.977 -1.615 615 H ALA 88 H ALA 88 3.758 2.189 2.573 616 HA ALA 88 HA ALA 88 5.413 4.558 1.998 617 HB1 ALA 88 HB1 ALA 88 4.859 4.709 4.265 618 HB2 ALA 88 HB2 ALA 88 6.508 4.084 4.238 619 HB3 ALA 88 HB3 ALA 88 5.156 2.998 4.545 620 H HIS 89 H HIS 89 7.793 4.192 2.457 621 HA HIS 89 HA HIS 89 9.772 3.341 1.817 622 HB2 HIS 89 HB2 HIS 89 8.305 0.778 2.391 623 HB3 HIS 89 HB3 HIS 89 9.934 0.742 1.721 624 HD1 HIS 89 HD1 HIS 89 8.058 1.943 4.774 625 HD2 HIS 89 HD2 HIS 89 11.951 1.196 3.530 626 HE1 HIS 89 HE1 HIS 89 9.479 2.168 6.838 627 HE2 HIS 89 HE2 HIS 89 11.832 1.709 6.062 628 H LEU 90 H LEU 90 7.999 4.226 -0.125 629 HA LEU 90 HA LEU 90 8.422 2.570 -2.449 630 HB2 LEU 90 HB2 LEU 90 6.949 5.179 -2.386 631 HB3 LEU 90 HB3 LEU 90 6.804 3.889 -3.552 632 HG LEU 90 HG LEU 90 5.921 3.572 -0.678 633 HD11 LEU 90 HD11 LEU 90 4.726 5.443 -1.748 634 HD12 LEU 90 HD12 LEU 90 3.679 4.070 -1.388 635 HD13 LEU 90 HD13 LEU 90 4.224 4.352 -3.041 636 HD21 LEU 90 HD21 LEU 90 4.488 1.804 -1.733 637 HD22 LEU 90 HD22 LEU 90 6.223 1.482 -1.731 638 HD23 LEU 90 HD23 LEU 90 5.430 2.029 -3.208 639 H SER 91 H SER 91 9.048 3.886 -4.512 640 HA SER 91 HA SER 91 11.366 5.465 -3.823 641 HB2 SER 91 HB2 SER 91 11.747 3.377 -5.143 642 HB3 SER 91 HB3 SER 91 10.806 4.092 -6.447 643 HG SER 91 HG SER 91 13.108 4.368 -6.657 644 H LYS 92 H LYS 92 8.258 5.747 -5.120 645 HA LYS 92 HA LYS 92 8.553 8.468 -5.688 646 HB2 LYS 92 HB2 LYS 92 9.290 6.832 -7.823 647 HB3 LYS 92 HB3 LYS 92 7.662 7.371 -8.203 648 HG2 LYS 92 HG2 LYS 92 8.287 9.649 -8.058 649 HG3 LYS 92 HG3 LYS 92 9.874 9.211 -7.417 650 HD2 LYS 92 HD2 LYS 92 10.580 8.330 -9.480 651 HD3 LYS 92 HD3 LYS 92 8.926 8.236 -10.095 652 HE2 LYS 92 HE2 LYS 92 8.810 10.654 -10.221 653 HE3 LYS 92 HE3 LYS 92 10.412 10.797 -9.500 654 HZ1 LYS 92 HZ1 LYS 92 10.415 11.051 -11.933 655 HZ2 LYS 92 HZ2 LYS 92 9.848 9.465 -12.092 656 HZ3 LYS 92 HZ3 LYS 92 11.372 9.753 -11.418 657 H ILE 93 H ILE 93 6.671 9.460 -6.403 658 HA ILE 93 HA ILE 93 4.213 7.980 -6.021 659 HB ILE 93 HB ILE 93 5.194 10.334 -4.657 660 HG12 ILE 93 HG12 ILE 93 3.133 9.597 -3.173 661 HG13 ILE 93 HG13 ILE 93 3.317 8.126 -4.120 662 HG21 ILE 93 HG21 ILE 93 3.691 11.557 -6.037 663 HG22 ILE 93 HG22 ILE 93 3.102 11.505 -4.375 664 HG23 ILE 93 HG23 ILE 93 2.378 10.466 -5.596 665 HD11 ILE 93 HD11 ILE 93 5.683 8.007 -3.404 666 HD12 ILE 93 HD12 ILE 93 4.552 7.918 -2.056 667 HD13 ILE 93 HD13 ILE 93 5.413 9.419 -2.384 668 H SER 94 H SER 94 2.458 8.590 -7.201 669 HA SER 94 HA SER 94 2.943 10.264 -9.526 670 HB2 SER 94 HB2 SER 94 2.363 7.716 -9.662 671 HB3 SER 94 HB3 SER 94 0.733 8.291 -9.309 672 HG SER 94 HG SER 94 2.350 9.171 -11.475 673 H VAL 95 H VAL 95 1.428 10.206 -6.605 674 HA VAL 95 HA VAL 95 -0.864 11.630 -7.491 675 HB VAL 95 HB VAL 95 -1.465 11.191 -4.946 676 HG11 VAL 95 HG11 VAL 95 -1.827 9.166 -7.139 677 HG12 VAL 95 HG12 VAL 95 -2.825 10.598 -6.888 678 HG13 VAL 95 HG13 VAL 95 -2.813 9.311 -5.684 679 HG21 VAL 95 HG21 VAL 95 -0.837 8.827 -4.397 680 HG22 VAL 95 HG22 VAL 95 0.475 9.998 -4.280 681 HG23 VAL 95 HG23 VAL 95 0.369 8.928 -5.679 682 H SER 96 H SER 96 -1.627 12.960 -5.318 683 HA SER 96 HA SER 96 0.418 14.590 -4.245 684 HB2 SER 96 HB2 SER 96 -0.087 15.609 -6.534 685 HB3 SER 96 HB3 SER 96 -1.689 15.974 -5.900 686 HG SER 96 HG SER 96 0.606 16.773 -4.490 687 H THR 97 H THR 97 -0.308 15.811 -2.539 688 HA THR 97 HA THR 97 -2.281 14.668 -0.960 689 HB THR 97 HB THR 97 -1.294 17.473 -0.541 690 HG1 THR 97 HG1 THR 97 0.216 15.476 0.600 691 HG21 THR 97 HG21 THR 97 -2.979 16.491 1.034 692 HG22 THR 97 HG22 THR 97 -1.460 16.948 1.804 693 HG23 THR 97 HG23 THR 97 -1.791 15.253 1.447 694 H ASP 98 H ASP 98 -4.419 14.932 -0.862 695 HA ASP 98 HA ASP 98 -6.477 15.920 -0.790 696 HB2 ASP 98 HB2 ASP 98 -5.113 18.200 -0.664 697 HB3 ASP 98 HB3 ASP 98 -5.712 18.375 -2.310 698 H SER 99 H SER 99 -4.669 15.047 -3.424 699 HA SER 99 HA SER 99 -6.568 15.566 -5.479 700 HB2 SER 99 HB2 SER 99 -4.213 13.679 -5.437 701 HB3 SER 99 HB3 SER 99 -5.103 14.184 -6.874 702 HG SER 99 HG SER 99 -4.026 15.993 -6.893 703 H THR 100 H THR 100 -7.905 14.031 -6.488 704 HA THR 100 HA THR 100 -8.825 11.931 -4.809 705 HB THR 100 HB THR 100 -10.384 11.486 -6.795 706 HG1 THR 100 HG1 THR 100 -9.741 12.646 -8.474 707 HG21 THR 100 HG21 THR 100 -10.492 14.074 -5.263 708 HG22 THR 100 HG22 THR 100 -11.097 12.506 -4.721 709 HG23 THR 100 HG23 THR 100 -11.860 13.323 -6.088 710 H VAL 101 H VAL 101 -8.838 9.755 -5.246 711 HA VAL 101 HA VAL 101 -7.120 8.881 -7.383 712 HB VAL 101 HB VAL 101 -6.844 6.887 -5.617 713 HG11 VAL 101 HG11 VAL 101 -5.046 7.864 -6.856 714 HG12 VAL 101 HG12 VAL 101 -4.607 7.825 -5.147 715 HG13 VAL 101 HG13 VAL 101 -5.132 9.337 -5.889 716 HG21 VAL 101 HG21 VAL 101 -6.908 9.385 -3.948 717 HG22 VAL 101 HG22 VAL 101 -6.313 7.812 -3.423 718 HG23 VAL 101 HG23 VAL 101 -8.015 8.019 -3.825 719 H LYS 102 H LYS 102 -7.352 6.527 -7.844 720 HA LYS 102 HA LYS 102 -9.952 5.432 -7.506 721 HB2 LYS 102 HB2 LYS 102 -9.758 6.821 -9.627 722 HB3 LYS 102 HB3 LYS 102 -8.694 5.547 -10.159 723 HG2 LYS 102 HG2 LYS 102 -10.584 3.938 -9.740 724 HG3 LYS 102 HG3 LYS 102 -11.613 5.348 -9.493 725 HD2 LYS 102 HD2 LYS 102 -11.052 6.134 -11.757 726 HD3 LYS 102 HD3 LYS 102 -10.077 4.684 -12.005 727 HE2 LYS 102 HE2 LYS 102 -12.997 4.573 -11.291 728 HE3 LYS 102 HE3 LYS 102 -12.434 4.657 -12.959 729 HZ1 LYS 102 HZ1 LYS 102 -12.836 2.378 -12.286 730 HZ2 LYS 102 HZ2 LYS 102 -11.747 2.529 -11.001 731 HZ3 LYS 102 HZ3 LYS 102 -11.189 2.610 -12.595 732 H GLN 103 H GLN 103 -10.065 3.288 -7.660 733 HA GLN 103 HA GLN 103 -7.952 1.784 -6.786 734 HB2 GLN 103 HB2 GLN 103 -10.486 1.340 -6.694 735 HB3 GLN 103 HB3 GLN 103 -10.268 0.615 -8.274 736 HG2 GLN 103 HG2 GLN 103 -8.482 -0.358 -6.136 737 HG3 GLN 103 HG3 GLN 103 -10.183 -0.793 -6.013 738 HE21 GLN 103 HE21 GLN 103 -8.774 -0.246 -9.079 739 HE22 GLN 103 HE22 GLN 103 -8.700 -1.875 -9.566 740 H GLY 104 H GLY 104 -6.513 0.501 -7.700 741 HA2 GLY 104 HA2 GLY 104 -5.208 -0.568 -9.244 742 HA3 GLY 104 HA3 GLY 104 -6.441 -0.274 -10.410 743 H GLN 105 H GLN 105 -5.923 2.683 -9.302 744 HA GLN 105 HA GLN 105 -4.392 3.510 -11.544 745 HB2 GLN 105 HB2 GLN 105 -6.244 4.829 -10.566 746 HB3 GLN 105 HB3 GLN 105 -5.292 5.065 -9.118 747 HG2 GLN 105 HG2 GLN 105 -3.736 6.445 -10.303 748 HG3 GLN 105 HG3 GLN 105 -4.509 6.068 -11.847 749 HE21 GLN 105 HE21 GLN 105 -5.053 7.545 -8.701 750 HE22 GLN 105 HE22 GLN 105 -6.274 8.644 -9.219 751 H ILE 106 H ILE 106 -2.378 4.191 -11.675 752 HA ILE 106 HA ILE 106 -0.572 3.181 -9.816 753 HB ILE 106 HB ILE 106 -0.099 4.838 -12.220 754 HG12 ILE 106 HG12 ILE 106 0.657 1.958 -11.836 755 HG13 ILE 106 HG13 ILE 106 -0.962 2.408 -12.349 756 HG21 ILE 106 HG21 ILE 106 2.310 4.191 -12.022 757 HG22 ILE 106 HG22 ILE 106 1.947 3.566 -10.414 758 HG23 ILE 106 HG23 ILE 106 1.757 5.285 -10.755 759 HD11 ILE 106 HD11 ILE 106 1.624 2.868 -13.809 760 HD12 ILE 106 HD12 ILE 106 0.087 3.584 -14.296 761 HD13 ILE 106 HD13 ILE 106 0.279 1.831 -14.286 762 H ILE 107 H ILE 107 -0.599 4.059 -7.930 763 HA ILE 107 HA ILE 107 -0.651 6.881 -7.550 764 HB ILE 107 HB ILE 107 -0.634 6.100 -5.079 765 HG12 ILE 107 HG12 ILE 107 -2.009 3.651 -5.935 766 HG13 ILE 107 HG13 ILE 107 -0.265 3.627 -6.182 767 HG21 ILE 107 HG21 ILE 107 -2.520 7.149 -6.236 768 HG22 ILE 107 HG22 ILE 107 -3.053 5.902 -5.113 769 HG23 ILE 107 HG23 ILE 107 -3.010 5.569 -6.845 770 HD11 ILE 107 HD11 ILE 107 -1.595 4.266 -3.563 771 HD12 ILE 107 HD12 ILE 107 0.127 4.016 -3.857 772 HD13 ILE 107 HD13 ILE 107 -1.002 2.670 -4.024 773 H GLY 108 H GLY 108 1.784 4.657 -7.975 774 HA2 GLY 108 HA2 GLY 108 3.884 6.349 -7.592 775 HA3 GLY 108 HA3 GLY 108 3.668 5.530 -6.053 776 H TYR 109 H TYR 109 5.755 4.747 -6.443 777 HA TYR 109 HA TYR 109 5.872 2.249 -7.843 778 HB2 TYR 109 HB2 TYR 109 8.123 4.270 -7.990 779 HB3 TYR 109 HB3 TYR 109 8.089 2.689 -8.754 780 HD1 TYR 109 HD1 TYR 109 7.196 2.421 -10.927 781 HD2 TYR 109 HD2 TYR 109 6.529 6.040 -8.799 782 HE1 TYR 109 HE1 TYR 109 6.301 3.451 -12.974 783 HE2 TYR 109 HE2 TYR 109 5.633 7.087 -10.841 784 HH TYR 109 HH TYR 109 5.759 6.802 -13.263 785 H THR 110 H THR 110 6.967 0.723 -6.695 786 HA THR 110 HA THR 110 7.350 1.026 -3.958 787 HB THR 110 HB THR 110 8.662 -1.193 -4.287 788 HG1 THR 110 HG1 THR 110 8.783 -1.929 -6.252 789 HG21 THR 110 HG21 THR 110 6.366 -0.996 -3.400 790 HG22 THR 110 HG22 THR 110 6.596 -2.441 -4.385 791 HG23 THR 110 HG23 THR 110 5.761 -1.044 -5.055 792 H GLY 111 H GLY 111 9.307 0.915 -2.640 793 HA2 GLY 111 HA2 GLY 111 11.829 1.310 -4.017 794 HA3 GLY 111 HA3 GLY 111 11.246 2.701 -3.128 795 H ALA 112 H ALA 112 13.305 2.408 -2.087 796 HA ALA 112 HA ALA 112 12.949 0.981 0.353 797 HB1 ALA 112 HB1 ALA 112 14.385 -0.348 -1.502 798 HB2 ALA 112 HB2 ALA 112 14.715 -0.476 0.226 799 HB3 ALA 112 HB3 ALA 112 15.669 0.615 -0.777 800 H THR 113 H THR 113 12.704 3.613 -0.056 801 HA THR 113 HA THR 113 15.135 5.107 0.241 802 HB THR 113 HB THR 113 13.532 7.035 0.620 803 HG1 THR 113 HG1 THR 113 11.398 6.646 0.521 804 HG21 THR 113 HG21 THR 113 14.474 6.619 -1.572 805 HG22 THR 113 HG22 THR 113 12.775 7.056 -1.746 806 HG23 THR 113 HG23 THR 113 13.270 5.368 -1.889 807 H GLY 114 H GLY 114 13.644 3.234 2.466 808 HA2 GLY 114 HA2 GLY 114 14.104 5.105 4.701 809 HA3 GLY 114 HA3 GLY 114 13.107 3.659 4.783 810 H GLN 115 H GLN 115 14.442 3.313 6.755 811 HA GLN 115 HA GLN 115 17.190 2.454 6.304 812 HB2 GLN 115 HB2 GLN 115 15.477 2.756 8.765 813 HB3 GLN 115 HB3 GLN 115 17.023 1.922 8.824 814 HG2 GLN 115 HG2 GLN 115 18.168 3.915 8.083 815 HG3 GLN 115 HG3 GLN 115 16.631 4.759 7.895 816 HE21 GLN 115 HE21 GLN 115 18.966 3.509 10.143 817 HE22 GLN 115 HE22 GLN 115 18.373 4.342 11.536 818 H VAL 116 H VAL 116 17.027 0.661 5.042 819 HA VAL 116 HA VAL 116 16.383 -1.821 6.335 820 HB VAL 116 HB VAL 116 14.162 -1.048 5.468 821 HG11 VAL 116 HG11 VAL 116 15.416 -1.372 2.751 822 HG12 VAL 116 HG12 VAL 116 14.786 0.113 3.466 823 HG13 VAL 116 HG13 VAL 116 13.687 -1.203 3.053 824 HG21 VAL 116 HG21 VAL 116 14.492 -3.398 5.852 825 HG22 VAL 116 HG22 VAL 116 15.229 -3.596 4.264 826 HG23 VAL 116 HG23 VAL 116 13.520 -3.178 4.396 827 H THR 117 H THR 117 17.004 -3.706 4.964 828 HA THR 117 HA THR 117 19.398 -3.069 3.421 829 HB THR 117 HB THR 117 19.708 -5.595 3.441 830 HG1 THR 117 HG1 THR 117 17.640 -5.434 5.396 831 HG21 THR 117 HG21 THR 117 20.927 -4.125 4.962 832 HG22 THR 117 HG22 THR 117 20.487 -5.629 5.769 833 HG23 THR 117 HG23 THR 117 19.575 -4.156 6.093 834 H GLY 118 H GLY 118 16.141 -3.938 2.833 835 HA2 GLY 118 HA2 GLY 118 16.738 -4.258 -0.013 836 HA3 GLY 118 HA3 GLY 118 15.816 -5.529 0.772 837 HA PRO 119 HA PRO 119 13.019 -1.823 -0.543 838 HB2 PRO 119 HB2 PRO 119 12.267 -3.192 -3.000 839 HB3 PRO 119 HB3 PRO 119 12.952 -1.581 -2.807 840 HG2 PRO 119 HG2 PRO 119 14.322 -3.609 -3.951 841 HG3 PRO 119 HG3 PRO 119 15.107 -2.295 -3.054 842 HD2 PRO 119 HD2 PRO 119 14.469 -5.077 -2.159 843 HD3 PRO 119 HD3 PRO 119 15.936 -4.111 -1.896 844 H HIS 120 H HIS 120 10.762 -1.887 -0.142 845 HA HIS 120 HA HIS 120 9.306 -4.266 -0.479 846 HB2 HIS 120 HB2 HIS 120 8.757 -4.708 1.871 847 HB3 HIS 120 HB3 HIS 120 10.492 -4.819 1.617 848 HD1 HIS 120 HD1 HIS 120 11.978 -3.025 2.747 849 HD2 HIS 120 HD2 HIS 120 7.924 -2.662 3.579 850 HE1 HIS 120 HE1 HIS 120 11.832 -1.436 4.689 851 HE2 HIS 120 HE2 HIS 120 9.368 -1.232 5.180 852 H LEU 121 H LEU 121 7.252 -3.863 1.191 853 HA LEU 121 HA LEU 121 6.088 -1.387 0.362 854 HB2 LEU 121 HB2 LEU 121 5.127 -2.809 -1.157 855 HB3 LEU 121 HB3 LEU 121 5.130 -4.164 -0.068 856 HG LEU 121 HG LEU 121 3.222 -3.002 1.158 857 HD11 LEU 121 HD11 LEU 121 1.906 -1.400 -0.168 858 HD12 LEU 121 HD12 LEU 121 3.190 -1.357 -1.376 859 HD13 LEU 121 HD13 LEU 121 3.493 -0.759 0.255 860 HD21 LEU 121 HD21 LEU 121 1.554 -3.800 -0.443 861 HD22 LEU 121 HD22 LEU 121 2.892 -4.935 -0.273 862 HD23 LEU 121 HD23 LEU 121 2.798 -3.891 -1.690 863 H HIS 122 H HIS 122 5.057 -0.334 1.853 864 HA HIS 122 HA HIS 122 4.443 -1.634 4.339 865 HB2 HIS 122 HB2 HIS 122 6.119 -0.012 4.843 866 HB3 HIS 122 HB3 HIS 122 5.354 1.191 3.818 867 HD2 HIS 122 HD2 HIS 122 2.943 2.321 4.947 868 HE1 HIS 122 HE1 HIS 122 3.807 0.975 8.855 869 HE2 HIS 122 HE2 HIS 122 2.325 2.467 7.455 870 H PHE 123 H PHE 123 2.376 -2.042 4.465 871 HA PHE 123 HA PHE 123 0.453 -0.113 3.385 872 HB2 PHE 123 HB2 PHE 123 0.680 -2.458 2.314 873 HB3 PHE 123 HB3 PHE 123 -0.074 -3.056 3.783 874 HD1 PHE 123 HD1 PHE 123 -0.584 -1.058 0.746 875 HD2 PHE 123 HD2 PHE 123 -2.405 -2.777 4.189 876 HE1 PHE 123 HE1 PHE 123 -2.804 -0.647 -0.227 877 HE2 PHE 123 HE2 PHE 123 -4.629 -2.369 3.220 878 HZ PHE 123 HZ PHE 123 -4.830 -1.306 1.008 879 H GLU 124 H GLU 124 -0.337 0.983 5.062 880 HA GLU 124 HA GLU 124 -1.108 -0.383 7.486 881 HB2 GLU 124 HB2 GLU 124 0.738 1.489 7.465 882 HB3 GLU 124 HB3 GLU 124 -0.637 2.577 7.343 883 HG2 GLU 124 HG2 GLU 124 -1.528 1.681 9.435 884 HG3 GLU 124 HG3 GLU 124 -0.151 0.593 9.553 885 H MET 125 H MET 125 -3.148 -0.413 7.909 886 HA MET 125 HA MET 125 -4.994 1.334 6.580 887 HB2 MET 125 HB2 MET 125 -5.578 -0.617 5.600 888 HB3 MET 125 HB3 MET 125 -4.898 -1.539 6.893 889 HG2 MET 125 HG2 MET 125 -6.852 -1.613 8.091 890 HG3 MET 125 HG3 MET 125 -7.478 -0.143 7.341 891 HE1 MET 125 HE1 MET 125 -9.631 -3.574 6.504 892 HE2 MET 125 HE2 MET 125 -9.659 -2.152 7.548 893 HE3 MET 125 HE3 MET 125 -8.483 -3.435 7.836 894 H LEU 126 H LEU 126 -6.408 2.307 7.725 895 HA LEU 126 HA LEU 126 -6.700 1.822 10.563 896 HB2 LEU 126 HB2 LEU 126 -5.508 4.217 9.244 897 HB3 LEU 126 HB3 LEU 126 -6.570 4.524 10.598 898 HG LEU 126 HG LEU 126 -4.972 2.723 11.752 899 HD11 LEU 126 HD11 LEU 126 -3.235 4.062 9.684 900 HD12 LEU 126 HD12 LEU 126 -3.615 2.343 9.775 901 HD13 LEU 126 HD13 LEU 126 -2.657 3.104 11.047 902 HD21 LEU 126 HD21 LEU 126 -3.680 4.647 12.615 903 HD22 LEU 126 HD22 LEU 126 -5.425 4.904 12.624 904 HD23 LEU 126 HD23 LEU 126 -4.429 5.658 11.380 905 HA PRO 127 HA PRO 127 -10.999 3.143 9.979 906 HB2 PRO 127 HB2 PRO 127 -11.306 5.058 11.918 907 HB3 PRO 127 HB3 PRO 127 -11.489 3.342 12.211 908 HG2 PRO 127 HG2 PRO 127 -9.174 5.108 12.760 909 HG3 PRO 127 HG3 PRO 127 -9.785 3.733 13.708 910 HD2 PRO 127 HD2 PRO 127 -7.605 3.507 12.194 911 HD3 PRO 127 HD3 PRO 127 -8.761 2.182 12.338 912 H ALA 128 H ALA 128 -12.409 5.180 9.916 913 HA ALA 128 HA ALA 128 -11.294 7.017 8.110 914 HB1 ALA 128 HB1 ALA 128 -13.663 6.385 8.023 915 HB2 ALA 128 HB2 ALA 128 -13.476 8.131 8.205 916 HB3 ALA 128 HB3 ALA 128 -13.904 7.138 9.601 917 H ASN 129 H ASN 129 -11.694 6.783 11.492 918 HA ASN 129 HA ASN 129 -10.120 9.059 12.076 919 HB2 ASN 129 HB2 ASN 129 -13.031 9.367 12.253 920 HB3 ASN 129 HB3 ASN 129 -12.219 9.695 13.781 921 HD21 ASN 129 HD21 ASN 129 -12.528 10.634 10.438 922 HD22 ASN 129 HD22 ASN 129 -11.824 12.203 10.608 923 HA PRO 130 HA PRO 130 -9.336 5.775 14.768 924 HB2 PRO 130 HB2 PRO 130 -6.745 7.000 15.237 925 HB3 PRO 130 HB3 PRO 130 -7.141 5.444 14.493 926 HG2 PRO 130 HG2 PRO 130 -6.235 7.590 13.057 927 HG3 PRO 130 HG3 PRO 130 -7.209 6.289 12.365 928 HD2 PRO 130 HD2 PRO 130 -7.984 9.036 13.180 929 HD3 PRO 130 HD3 PRO 130 -8.573 8.028 11.843 930 H ASN 131 H ASN 131 -8.615 5.431 16.859 931 HA ASN 131 HA ASN 131 -8.937 7.635 18.708 932 HB2 ASN 131 HB2 ASN 131 -10.547 5.468 18.468 933 HB3 ASN 131 HB3 ASN 131 -9.372 4.921 19.646 934 HD21 ASN 131 HD21 ASN 131 -11.920 7.082 18.922 935 HD22 ASN 131 HD22 ASN 131 -12.180 7.653 20.518 936 H TRP 132 H TRP 132 -6.654 7.829 18.119 937 HA TRP 132 HA TRP 132 -4.716 5.929 18.696 938 HB2 TRP 132 HB2 TRP 132 -4.209 8.889 18.892 939 HB3 TRP 132 HB3 TRP 132 -3.087 7.631 18.397 940 HD1 TRP 132 HD1 TRP 132 -3.611 6.504 15.931 941 HE1 TRP 132 HE1 TRP 132 -4.526 7.628 13.802 942 HE3 TRP 132 HE3 TRP 132 -5.756 10.642 18.036 943 HZ2 TRP 132 HZ2 TRP 132 -5.958 9.904 13.114 944 HZ3 TRP 132 HZ3 TRP 132 -6.892 12.251 16.557 945 HH2 TRP 132 HH2 TRP 132 -6.991 11.890 14.142 946 H GLN 133 H GLN 133 -6.725 6.811 20.853 947 HA GLN 133 HA GLN 133 -5.161 7.749 23.013 948 HB2 GLN 133 HB2 GLN 133 -8.010 6.864 22.724 949 HB3 GLN 133 HB3 GLN 133 -7.310 7.438 24.209 950 HG2 GLN 133 HG2 GLN 133 -8.319 9.357 23.404 951 HG3 GLN 133 HG3 GLN 133 -6.666 9.538 22.818 952 HE21 GLN 133 HE21 GLN 133 -6.243 8.876 20.598 953 HE22 GLN 133 HE22 GLN 133 -7.472 8.998 19.402 954 H ASN 134 H ASN 134 -4.336 5.304 21.958 955 HA ASN 134 HA ASN 134 -3.250 3.455 22.625 956 HB2 ASN 134 HB2 ASN 134 -4.354 4.208 25.327 957 HB3 ASN 134 HB3 ASN 134 -3.388 2.757 25.070 958 HD21 ASN 134 HD21 ASN 134 -3.394 6.248 24.651 959 HD22 ASN 134 HD22 ASN 134 -1.691 6.454 24.807 960 H GLY 135 H GLY 135 -3.810 1.520 22.022 961 HA2 GLY 135 HA2 GLY 135 -5.521 -0.274 22.993 962 HA3 GLY 135 HA3 GLY 135 -6.609 0.813 22.148 963 H PHE 136 H PHE 136 -5.349 1.408 19.826 964 HA PHE 136 HA PHE 136 -4.299 -0.994 18.601 965 HB2 PHE 136 HB2 PHE 136 -5.999 -1.192 16.864 966 HB3 PHE 136 HB3 PHE 136 -6.714 -1.413 18.447 967 HD1 PHE 136 HD1 PHE 136 -6.956 1.664 19.075 968 HD2 PHE 136 HD2 PHE 136 -7.978 -0.738 15.700 969 HE1 PHE 136 HE1 PHE 136 -8.718 3.250 18.473 970 HE2 PHE 136 HE2 PHE 136 -9.738 0.868 15.099 971 HZ PHE 136 HZ PHE 136 -10.112 2.863 16.487 972 H SER 137 H SER 137 -4.917 2.313 18.622 973 HA SER 137 HA SER 137 -4.011 4.120 17.673 974 HB2 SER 137 HB2 SER 137 -1.797 3.018 17.956 975 HB3 SER 137 HB3 SER 137 -2.002 2.260 16.382 976 HG SER 137 HG SER 137 -0.742 4.232 16.375 977 H GLY 138 H GLY 138 -5.911 2.187 16.576 978 HA2 GLY 138 HA2 GLY 138 -7.474 2.347 14.911 979 HA3 GLY 138 HA3 GLY 138 -6.514 3.608 14.169 980 H ARG 139 H ARG 139 -4.223 1.418 14.530 981 HA ARG 139 HA ARG 139 -4.587 0.529 11.811 982 HB2 ARG 139 HB2 ARG 139 -2.331 -0.634 12.164 983 HB3 ARG 139 HB3 ARG 139 -2.378 1.115 12.130 984 HG2 ARG 139 HG2 ARG 139 -0.957 0.710 13.872 985 HG3 ARG 139 HG3 ARG 139 -2.488 0.912 14.715 986 HD2 ARG 139 HD2 ARG 139 -2.661 -1.360 15.178 987 HD3 ARG 139 HD3 ARG 139 -1.544 -1.808 13.890 988 HE ARG 139 HE ARG 139 0.238 -0.814 15.294 989 HH11 ARG 139 HH11 ARG 139 -2.755 -1.872 16.843 990 HH12 ARG 139 HH12 ARG 139 -1.959 -2.105 18.442 991 HH21 ARG 139 HH21 ARG 139 0.263 -1.667 18.696 992 HH22 ARG 139 HH22 ARG 139 1.244 -1.083 17.302 993 H ILE 140 H ILE 140 -5.299 -1.311 11.080 994 HA ILE 140 HA ILE 140 -5.481 -3.569 12.912 995 HB ILE 140 HB ILE 140 -7.565 -3.716 10.964 996 HG12 ILE 140 HG12 ILE 140 -8.984 -1.969 12.354 997 HG13 ILE 140 HG13 ILE 140 -7.410 -1.215 12.585 998 HG21 ILE 140 HG21 ILE 140 -7.587 -3.709 13.966 999 HG22 ILE 140 HG22 ILE 140 -7.438 -5.118 12.917 1000 HG23 ILE 140 HG23 ILE 140 -8.935 -4.187 12.935 1001 HD11 ILE 140 HD11 ILE 140 -7.135 -0.896 10.251 1002 HD12 ILE 140 HD12 ILE 140 -8.752 -0.329 10.674 1003 HD13 ILE 140 HD13 ILE 140 -8.542 -1.894 9.887 1004 H ASP 141 H ASP 141 -6.422 -5.536 11.386 1005 HA ASP 141 HA ASP 141 -4.147 -6.347 9.932 1006 HB2 ASP 141 HB2 ASP 141 -6.858 -7.582 10.357 1007 HB3 ASP 141 HB3 ASP 141 -5.628 -8.352 9.362 1008 HA PRO 142 HA PRO 142 -5.390 -4.883 5.864 1009 HB2 PRO 142 HB2 PRO 142 -3.459 -5.983 4.386 1010 HB3 PRO 142 HB3 PRO 142 -3.133 -4.655 5.504 1011 HG2 PRO 142 HG2 PRO 142 -2.674 -7.572 5.868 1012 HG3 PRO 142 HG3 PRO 142 -1.624 -6.212 6.291 1013 HD2 PRO 142 HD2 PRO 142 -3.200 -7.504 8.096 1014 HD3 PRO 142 HD3 PRO 142 -2.708 -5.806 8.253 1015 H THR 143 H THR 143 -6.408 -7.606 6.965 1016 HA THR 143 HA THR 143 -6.545 -9.550 5.039 1017 HB THR 143 HB THR 143 -8.792 -10.064 6.243 1018 HG1 THR 143 HG1 THR 143 -7.721 -7.935 7.729 1019 HG21 THR 143 HG21 THR 143 -6.815 -11.390 6.578 1020 HG22 THR 143 HG22 THR 143 -7.519 -11.028 8.155 1021 HG23 THR 143 HG23 THR 143 -6.105 -10.135 7.594 1022 H GLY 144 H GLY 144 -8.237 -6.570 5.181 1023 HA2 GLY 144 HA2 GLY 144 -10.391 -7.247 3.396 1024 HA3 GLY 144 HA3 GLY 144 -9.890 -5.620 3.847 1025 H TYR 145 H TYR 145 -7.120 -6.321 3.108 1026 HA TYR 145 HA TYR 145 -7.230 -5.772 0.285 1027 HB2 TYR 145 HB2 TYR 145 -5.898 -4.157 1.245 1028 HB3 TYR 145 HB3 TYR 145 -5.356 -5.230 2.521 1029 HD1 TYR 145 HD1 TYR 145 -3.283 -6.288 2.402 1030 HD2 TYR 145 HD2 TYR 145 -4.823 -4.366 -1.057 1031 HE1 TYR 145 HE1 TYR 145 -1.098 -6.536 1.297 1032 HE2 TYR 145 HE2 TYR 145 -2.651 -4.613 -2.178 1033 HH TYR 145 HH TYR 145 -0.160 -6.597 -0.934 1034 H ILE 146 H ILE 146 -6.780 -8.373 2.335 1035 HA ILE 146 HA ILE 146 -5.145 -9.847 0.461 1036 HB ILE 146 HB ILE 146 -5.916 -10.763 3.224 1037 HG12 ILE 146 HG12 ILE 146 -4.640 -8.672 3.448 1038 HG13 ILE 146 HG13 ILE 146 -3.721 -10.040 4.049 1039 HG21 ILE 146 HG21 ILE 146 -5.184 -12.551 1.718 1040 HG22 ILE 146 HG22 ILE 146 -4.068 -12.329 3.064 1041 HG23 ILE 146 HG23 ILE 146 -3.655 -11.709 1.467 1042 HD11 ILE 146 HD11 ILE 146 -2.285 -8.506 2.851 1043 HD12 ILE 146 HD12 ILE 146 -3.305 -8.628 1.416 1044 HD13 ILE 146 HD13 ILE 146 -2.396 -10.033 1.973 1045 H ALA 147 H ALA 147 -8.329 -9.428 1.364 1046 HA ALA 147 HA ALA 147 -9.332 -12.055 0.915 1047 HB1 ALA 147 HB1 ALA 147 -11.507 -11.092 1.190 1048 HB2 ALA 147 HB2 ALA 147 -10.833 -9.473 1.006 1049 HB3 ALA 147 HB3 ALA 147 -10.420 -10.443 2.419 1050 H ASN 148 H ASN 148 -8.757 -9.275 -0.977 1051 HA ASN 148 HA ASN 148 -10.078 -10.391 -3.276 1052 HB2 ASN 148 HB2 ASN 148 -9.447 -7.785 -3.903 1053 HB3 ASN 148 HB3 ASN 148 -11.007 -8.326 -3.360 1054 HD21 ASN 148 HD21 ASN 148 -7.980 -7.823 -1.707 1055 HD22 ASN 148 HD22 ASN 148 -8.586 -6.732 -0.520 1056 H ALA 149 H ALA 149 -7.440 -10.810 -1.987 1057 HA ALA 149 HA ALA 149 -5.657 -9.937 -3.998 1058 HB1 ALA 149 HB1 ALA 149 -5.230 -11.234 -1.344 1059 HB2 ALA 149 HB2 ALA 149 -4.972 -9.545 -1.769 1060 HB3 ALA 149 HB3 ALA 149 -3.914 -10.794 -2.435 1061 HA PRO 150 HA PRO 150 -5.406 -13.629 -6.391 1062 HB2 PRO 150 HB2 PRO 150 -2.693 -13.582 -6.946 1063 HB3 PRO 150 HB3 PRO 150 -3.946 -12.715 -7.842 1064 HG2 PRO 150 HG2 PRO 150 -2.095 -11.717 -5.766 1065 HG3 PRO 150 HG3 PRO 150 -2.754 -10.895 -7.187 1066 HD2 PRO 150 HD2 PRO 150 -3.653 -10.403 -4.688 1067 HD3 PRO 150 HD3 PRO 150 -4.697 -10.302 -6.116 1068 H VAL 151 H VAL 151 -3.819 -15.581 -6.713 1069 HA VAL 151 HA VAL 151 -3.622 -16.896 -4.156 1070 HB VAL 151 HB VAL 151 -3.713 -18.033 -6.901 1071 HG11 VAL 151 HG11 VAL 151 -3.701 -20.202 -6.004 1072 HG12 VAL 151 HG12 VAL 151 -3.948 -19.603 -4.364 1073 HG13 VAL 151 HG13 VAL 151 -2.397 -19.342 -5.174 1074 HG21 VAL 151 HG21 VAL 151 -5.836 -17.028 -6.080 1075 HG22 VAL 151 HG22 VAL 151 -5.810 -18.197 -4.758 1076 HG23 VAL 151 HG23 VAL 151 -5.941 -18.754 -6.426 1077 H PHE 152 H PHE 152 -1.853 -17.524 -3.368 1078 HA PHE 152 HA PHE 152 0.699 -17.233 -4.769 1079 HB2 PHE 152 HB2 PHE 152 0.485 -15.989 -2.666 1080 HB3 PHE 152 HB3 PHE 152 0.011 -17.444 -1.809 1081 HD1 PHE 152 HD1 PHE 152 1.674 -19.191 -1.355 1082 HD2 PHE 152 HD2 PHE 152 2.751 -15.467 -3.064 1083 HE1 PHE 152 HE1 PHE 152 4.035 -19.622 -0.782 1084 HE2 PHE 152 HE2 PHE 152 5.117 -15.877 -2.513 1085 HZ PHE 152 HZ PHE 152 5.760 -17.962 -1.367 1086 H ASN 153 H ASN 153 0.888 -19.104 -5.912 1087 HA ASN 153 HA ASN 153 1.458 -21.237 -6.399 1088 HB2 ASN 153 HB2 ASN 153 2.123 -21.143 -3.505 1089 HB3 ASN 153 HB3 ASN 153 2.051 -22.727 -4.272 1090 HD21 ASN 153 HD21 ASN 153 3.547 -19.556 -4.430 1091 HD22 ASN 153 HD22 ASN 153 4.987 -20.069 -5.236 1092 H GLY 154 H GLY 154 -0.957 -20.883 -3.877 1093 HA2 GLY 154 HA2 GLY 154 -3.105 -22.053 -4.757 1094 HA3 GLY 154 HA3 GLY 154 -2.127 -23.498 -4.540 1095 H THR 155 H THR 155 -3.256 -20.626 -2.772 1096 HA THR 155 HA THR 155 -2.974 -21.952 -0.235 1097 HB THR 155 HB THR 155 -3.830 -19.680 0.562 1098 HG1 THR 155 HG1 THR 155 -3.481 -19.190 -2.191 1099 HG21 THR 155 HG21 THR 155 -1.228 -19.853 -0.940 1100 HG22 THR 155 HG22 THR 155 -1.493 -20.318 0.741 1101 HG23 THR 155 HG23 THR 155 -1.618 -18.625 0.264 1102 H THR 156 H THR 156 -4.534 -23.334 0.126 1103 HA THR 156 HA THR 156 -7.337 -22.504 -0.186 1104 HB THR 156 HB THR 156 -7.830 -25.005 0.005 1105 HG1 THR 156 HG1 THR 156 -5.334 -25.590 -1.017 1106 HG21 THR 156 HG21 THR 156 -7.379 -25.409 -2.372 1107 HG22 THR 156 HG22 THR 156 -6.289 -24.021 -2.402 1108 HG23 THR 156 HG23 THR 156 -8.012 -23.783 -2.106 1109 HA PRO 157 HA PRO 157 -7.465 -22.771 4.273 1110 HB2 PRO 157 HB2 PRO 157 -10.257 -22.517 4.499 1111 HB3 PRO 157 HB3 PRO 157 -9.071 -21.211 4.565 1112 HG2 PRO 157 HG2 PRO 157 -10.969 -21.626 2.543 1113 HG3 PRO 157 HG3 PRO 157 -9.595 -20.509 2.492 1114 HD2 PRO 157 HD2 PRO 157 -9.887 -23.186 1.261 1115 HD3 PRO 157 HD3 PRO 157 -8.919 -21.796 0.748 1116 H THR 158 H THR 158 -9.972 -24.531 2.611 1117 HA THR 158 HA THR 158 -9.408 -26.985 3.888 1118 HB THR 158 HB THR 158 -10.661 -26.126 5.734 1119 HG1 THR 158 HG1 THR 158 -11.135 -28.281 5.264 1120 HG21 THR 158 HG21 THR 158 -12.772 -25.126 5.737 1121 HG22 THR 158 HG22 THR 158 -13.112 -25.649 4.089 1122 HG23 THR 158 HG23 THR 158 -11.931 -24.372 4.379 1123 H GLU 159 H GLU 159 -12.313 -25.508 2.609 1124 HA GLU 159 HA GLU 159 -12.718 -27.628 0.719 1125 HB2 GLU 159 HB2 GLU 159 -14.327 -25.248 1.562 1126 HB3 GLU 159 HB3 GLU 159 -14.763 -26.140 0.113 1127 HG2 GLU 159 HG2 GLU 159 -14.388 -27.569 2.712 1128 HG3 GLU 159 HG3 GLU 159 -15.896 -26.729 2.359 Start of MODEL 7 1 H1 MET 1 H1 MET 1 -26.924 -28.073 -24.536 2 H2 MET 1 H2 MET 1 -25.830 -28.568 -23.345 3 H3 MET 1 H3 MET 1 -25.970 -29.449 -24.781 4 HA MET 1 HA MET 1 -25.105 -27.623 -26.055 5 HB2 MET 1 HB2 MET 1 -25.189 -26.273 -23.375 6 HB3 MET 1 HB3 MET 1 -24.046 -25.743 -24.602 7 HG2 MET 1 HG2 MET 1 -25.909 -25.338 -26.143 8 HG3 MET 1 HG3 MET 1 -27.041 -25.831 -24.885 9 HE1 MET 1 HE1 MET 1 -27.465 -21.903 -25.233 10 HE2 MET 1 HE2 MET 1 -28.295 -23.454 -25.344 11 HE3 MET 1 HE3 MET 1 -27.053 -23.032 -26.522 12 H ARG 2 H ARG 2 -22.997 -27.771 -26.607 13 HA ARG 2 HA ARG 2 -21.305 -29.457 -24.922 14 HB2 ARG 2 HB2 ARG 2 -21.208 -28.669 -27.826 15 HB3 ARG 2 HB3 ARG 2 -19.847 -29.455 -27.039 16 HG2 ARG 2 HG2 ARG 2 -21.209 -31.382 -26.522 17 HG3 ARG 2 HG3 ARG 2 -22.633 -30.588 -27.194 18 HD2 ARG 2 HD2 ARG 2 -21.447 -30.478 -29.386 19 HD3 ARG 2 HD3 ARG 2 -20.153 -31.446 -28.677 20 HE ARG 2 HE ARG 2 -22.891 -32.494 -28.662 21 HH11 ARG 2 HH11 ARG 2 -19.581 -32.698 -29.873 22 HH12 ARG 2 HH12 ARG 2 -19.824 -34.350 -30.550 23 HH21 ARG 2 HH21 ARG 2 -23.211 -34.571 -29.505 24 HH22 ARG 2 HH22 ARG 2 -21.843 -35.389 -30.346 25 H GLY 3 H GLY 3 -19.675 -28.695 -23.776 26 HA2 GLY 3 HA2 GLY 3 -18.009 -26.523 -24.612 27 HA3 GLY 3 HA3 GLY 3 -19.101 -26.045 -23.320 28 H SER 4 H SER 4 -16.420 -28.102 -24.211 29 HA SER 4 HA SER 4 -15.772 -28.443 -21.358 30 HB2 SER 4 HB2 SER 4 -16.682 -30.550 -22.400 31 HB3 SER 4 HB3 SER 4 -15.284 -30.549 -23.473 32 HG SER 4 HG SER 4 -14.978 -31.848 -21.594 33 H HIS 5 H HIS 5 -14.605 -28.141 -24.669 34 HA HIS 5 HA HIS 5 -11.823 -27.992 -23.826 35 HB2 HIS 5 HB2 HIS 5 -13.150 -27.885 -26.534 36 HB3 HIS 5 HB3 HIS 5 -11.423 -27.636 -26.306 37 HD1 HIS 5 HD1 HIS 5 -9.981 -29.691 -26.007 38 HD2 HIS 5 HD2 HIS 5 -14.048 -30.544 -25.967 39 HE1 HIS 5 HE1 HIS 5 -10.143 -32.198 -26.115 40 HE2 HIS 5 HE2 HIS 5 -12.614 -32.692 -26.091 41 H HIS 6 H HIS 6 -14.320 -25.853 -25.140 42 HA HIS 6 HA HIS 6 -12.497 -23.566 -25.021 43 HB2 HIS 6 HB2 HIS 6 -14.253 -24.218 -26.935 44 HB3 HIS 6 HB3 HIS 6 -15.315 -23.249 -25.918 45 HD1 HIS 6 HD1 HIS 6 -15.035 -20.736 -26.007 46 HD2 HIS 6 HD2 HIS 6 -12.043 -22.775 -28.047 47 HE1 HIS 6 HE1 HIS 6 -13.768 -18.975 -27.278 48 HE2 HIS 6 HE2 HIS 6 -11.961 -20.232 -28.506 49 H HIS 7 H HIS 7 -12.647 -21.971 -23.573 50 HA HIS 7 HA HIS 7 -14.980 -21.837 -21.790 51 HB2 HIS 7 HB2 HIS 7 -12.078 -21.963 -20.982 52 HB3 HIS 7 HB3 HIS 7 -13.310 -21.286 -19.923 53 HD1 HIS 7 HD1 HIS 7 -12.081 -24.518 -21.333 54 HD2 HIS 7 HD2 HIS 7 -15.054 -23.157 -18.769 55 HE1 HIS 7 HE1 HIS 7 -12.983 -26.573 -20.198 56 HE2 HIS 7 HE2 HIS 7 -14.781 -25.726 -18.650 57 H HIS 8 H HIS 8 -15.403 -19.783 -20.889 58 HA HIS 8 HA HIS 8 -14.271 -17.575 -22.448 59 HB2 HIS 8 HB2 HIS 8 -16.854 -17.919 -20.945 60 HB3 HIS 8 HB3 HIS 8 -16.285 -16.323 -21.424 61 HD1 HIS 8 HD1 HIS 8 -17.633 -19.521 -22.832 62 HD2 HIS 8 HD2 HIS 8 -16.480 -15.752 -24.148 63 HE1 HIS 8 HE1 HIS 8 -18.460 -19.354 -25.200 64 HE2 HIS 8 HE2 HIS 8 -17.752 -17.064 -25.978 65 H HIS 9 H HIS 9 -15.086 -18.408 -19.073 66 HA HIS 9 HA HIS 9 -13.024 -16.502 -18.194 67 HB2 HIS 9 HB2 HIS 9 -15.818 -16.826 -17.113 68 HB3 HIS 9 HB3 HIS 9 -14.528 -16.107 -16.155 69 HD1 HIS 9 HD1 HIS 9 -16.947 -15.360 -18.826 70 HD2 HIS 9 HD2 HIS 9 -13.530 -13.626 -17.217 71 HE1 HIS 9 HE1 HIS 9 -16.939 -12.987 -19.662 72 HE2 HIS 9 HE2 HIS 9 -14.861 -11.957 -18.675 73 H HIS 10 H HIS 10 -11.821 -17.068 -16.415 74 HA HIS 10 HA HIS 10 -12.334 -19.666 -15.138 75 HB2 HIS 10 HB2 HIS 10 -10.546 -19.594 -17.126 76 HB3 HIS 10 HB3 HIS 10 -9.502 -19.025 -15.827 77 HD1 HIS 10 HD1 HIS 10 -11.583 -22.013 -16.818 78 HD2 HIS 10 HD2 HIS 10 -8.620 -20.976 -14.094 79 HE1 HIS 10 HE1 HIS 10 -10.868 -24.174 -15.747 80 HE2 HIS 10 HE2 HIS 10 -9.072 -23.523 -14.104 81 H GLY 11 H GLY 11 -10.471 -16.639 -15.123 82 HA2 GLY 11 HA2 GLY 11 -10.606 -15.287 -13.072 83 HA3 GLY 11 HA3 GLY 11 -10.410 -16.781 -12.169 84 H SER 12 H SER 12 -8.801 -14.541 -14.365 85 HA SER 12 HA SER 12 -6.172 -15.656 -13.722 86 HB2 SER 12 HB2 SER 12 -7.257 -13.911 -15.849 87 HB3 SER 12 HB3 SER 12 -5.610 -13.553 -15.305 88 HG SER 12 HG SER 12 -6.586 -15.707 -16.740 89 H ALA 13 H ALA 13 -4.414 -14.277 -13.135 90 HA ALA 13 HA ALA 13 -4.817 -11.631 -12.293 91 HB1 ALA 13 HB1 ALA 13 -4.167 -12.000 -9.900 92 HB2 ALA 13 HB2 ALA 13 -4.399 -13.729 -10.170 93 HB3 ALA 13 HB3 ALA 13 -5.764 -12.623 -10.317 94 H THR 14 H THR 14 -2.997 -10.615 -12.798 95 HA THR 14 HA THR 14 -0.579 -12.106 -13.208 96 HB THR 14 HB THR 14 -1.307 -10.623 -14.983 97 HG1 THR 14 HG1 THR 14 1.137 -10.288 -13.708 98 HG21 THR 14 HG21 THR 14 -1.134 -8.151 -14.731 99 HG22 THR 14 HG22 THR 14 -0.936 -8.379 -12.992 100 HG23 THR 14 HG23 THR 14 -2.438 -8.863 -13.779 101 H TYR 15 H TYR 15 -1.876 -10.334 -10.686 102 HA TYR 15 HA TYR 15 0.678 -9.489 -9.662 103 HB2 TYR 15 HB2 TYR 15 -1.946 -8.401 -9.560 104 HB3 TYR 15 HB3 TYR 15 -1.278 -8.572 -7.943 105 HD1 TYR 15 HD1 TYR 15 1.141 -7.621 -7.612 106 HD2 TYR 15 HD2 TYR 15 -1.427 -6.525 -10.822 107 HE1 TYR 15 HE1 TYR 15 2.445 -5.562 -7.945 108 HE2 TYR 15 HE2 TYR 15 -0.127 -4.466 -11.166 109 HH TYR 15 HH TYR 15 1.367 -2.999 -9.895 110 H THR 16 H THR 16 1.651 -10.380 -8.114 111 HA THR 16 HA THR 16 0.403 -12.637 -6.824 112 HB THR 16 HB THR 16 2.753 -13.055 -5.960 113 HG1 THR 16 HG1 THR 16 3.123 -10.726 -7.385 114 HG21 THR 16 HG21 THR 16 3.527 -13.977 -8.106 115 HG22 THR 16 HG22 THR 16 2.294 -13.030 -8.940 116 HG23 THR 16 HG23 THR 16 1.818 -14.314 -7.828 117 H ARG 17 H ARG 17 0.694 -13.033 -4.519 118 HA ARG 17 HA ARG 17 0.459 -10.638 -2.951 119 HB2 ARG 17 HB2 ARG 17 -0.888 -13.115 -2.922 120 HB3 ARG 17 HB3 ARG 17 0.001 -13.003 -1.407 121 HG2 ARG 17 HG2 ARG 17 -1.924 -11.994 -0.770 122 HG3 ARG 17 HG3 ARG 17 -1.066 -10.581 -1.378 123 HD2 ARG 17 HD2 ARG 17 -3.067 -12.225 -2.928 124 HD3 ARG 17 HD3 ARG 17 -3.387 -10.676 -2.160 125 HE ARG 17 HE ARG 17 -1.638 -11.091 -4.489 126 HH11 ARG 17 HH11 ARG 17 -3.581 -8.960 -2.454 127 HH12 ARG 17 HH12 ARG 17 -3.438 -7.573 -3.595 128 HH21 ARG 17 HH21 ARG 17 -2.270 -7.799 -5.538 129 HH22 ARG 17 HH22 ARG 17 -1.479 -9.363 -5.952 130 HA PRO 18 HA PRO 18 4.666 -11.504 -1.430 131 HB2 PRO 18 HB2 PRO 18 4.301 -9.049 0.121 132 HB3 PRO 18 HB3 PRO 18 5.506 -9.411 -1.122 133 HG2 PRO 18 HG2 PRO 18 3.529 -7.654 -1.558 134 HG3 PRO 18 HG3 PRO 18 4.158 -8.704 -2.845 135 HD2 PRO 18 HD2 PRO 18 1.653 -8.998 -1.233 136 HD3 PRO 18 HD3 PRO 18 1.921 -9.261 -2.972 137 H LEU 19 H LEU 19 1.785 -10.886 0.433 138 HA LEU 19 HA LEU 19 2.899 -12.335 2.696 139 HB2 LEU 19 HB2 LEU 19 2.063 -9.641 2.712 140 HB3 LEU 19 HB3 LEU 19 0.907 -10.551 3.619 141 HG LEU 19 HG LEU 19 2.663 -9.434 4.970 142 HD11 LEU 19 HD11 LEU 19 1.518 -11.165 6.065 143 HD12 LEU 19 HD12 LEU 19 3.227 -11.545 6.313 144 HD13 LEU 19 HD13 LEU 19 2.299 -12.421 5.095 145 HD21 LEU 19 HD21 LEU 19 4.526 -11.551 3.908 146 HD22 LEU 19 HD22 LEU 19 4.895 -10.267 5.057 147 HD23 LEU 19 HD23 LEU 19 4.542 -9.871 3.374 148 H ASP 20 H ASP 20 0.932 -12.437 4.227 149 HA ASP 20 HA ASP 20 -1.378 -13.543 2.899 150 HB2 ASP 20 HB2 ASP 20 0.497 -14.916 4.511 151 HB3 ASP 20 HB3 ASP 20 -1.045 -14.852 5.354 152 H THR 21 H THR 21 0.075 -11.742 5.365 153 HA THR 21 HA THR 21 -2.240 -10.398 6.129 154 HB THR 21 HB THR 21 -2.613 -12.578 7.284 155 HG1 THR 21 HG1 THR 21 -2.572 -11.140 9.506 156 HG21 THR 21 HG21 THR 21 -1.383 -13.164 9.285 157 HG22 THR 21 HG22 THR 21 -0.354 -11.743 9.109 158 HG23 THR 21 HG23 THR 21 -0.262 -13.049 7.927 159 H GLY 22 H GLY 22 -1.633 -9.445 8.518 160 HA2 GLY 22 HA2 GLY 22 0.940 -8.809 9.287 161 HA3 GLY 22 HA3 GLY 22 0.413 -7.544 8.183 162 H ASN 23 H ASN 23 0.464 -8.531 11.388 163 HA ASN 23 HA ASN 23 -1.241 -6.383 12.226 164 HB2 ASN 23 HB2 ASN 23 -2.525 -7.953 13.802 165 HB3 ASN 23 HB3 ASN 23 -2.998 -7.940 12.112 166 HD21 ASN 23 HD21 ASN 23 -2.115 -9.635 10.741 167 HD22 ASN 23 HD22 ASN 23 -1.809 -11.194 11.413 168 H ILE 24 H ILE 24 -0.453 -5.354 13.775 169 HA ILE 24 HA ILE 24 1.502 -6.645 15.509 170 HB ILE 24 HB ILE 24 1.210 -3.788 15.804 171 HG12 ILE 24 HG12 ILE 24 2.745 -3.428 13.713 172 HG13 ILE 24 HG13 ILE 24 2.006 -4.926 13.153 173 HG21 ILE 24 HG21 ILE 24 3.626 -3.814 15.900 174 HG22 ILE 24 HG22 ILE 24 3.631 -5.478 15.335 175 HG23 ILE 24 HG23 ILE 24 2.947 -5.093 16.908 176 HD11 ILE 24 HD11 ILE 24 0.633 -3.337 12.222 177 HD12 ILE 24 HD12 ILE 24 0.762 -2.267 13.617 178 HD13 ILE 24 HD13 ILE 24 -0.221 -3.735 13.721 179 H THR 25 H THR 25 -0.713 -7.457 16.120 180 HA THR 25 HA THR 25 -1.912 -5.874 18.277 181 HB THR 25 HB THR 25 -3.517 -6.726 16.697 182 HG1 THR 25 HG1 THR 25 -3.740 -7.030 19.210 183 HG21 THR 25 HG21 THR 25 -3.876 -9.045 16.194 184 HG22 THR 25 HG22 THR 25 -2.644 -9.536 17.357 185 HG23 THR 25 HG23 THR 25 -2.177 -8.670 15.892 186 H THR 26 H THR 26 -0.075 -8.724 17.641 187 HA THR 26 HA THR 26 -0.069 -9.419 20.502 188 HB THR 26 HB THR 26 0.767 -11.348 18.353 189 HG1 THR 26 HG1 THR 26 -1.379 -12.101 18.301 190 HG21 THR 26 HG21 THR 26 -0.298 -11.675 21.162 191 HG22 THR 26 HG22 THR 26 1.338 -12.013 20.596 192 HG23 THR 26 HG23 THR 26 -0.009 -13.010 20.048 193 H GLY 27 H GLY 27 2.018 -9.929 17.736 194 HA2 GLY 27 HA2 GLY 27 4.205 -8.398 18.758 195 HA3 GLY 27 HA3 GLY 27 4.462 -10.121 18.992 196 H PHE 28 H PHE 28 5.272 -7.681 17.030 197 HA PHE 28 HA PHE 28 4.845 -8.844 14.480 198 HB2 PHE 28 HB2 PHE 28 5.438 -6.310 15.339 199 HB3 PHE 28 HB3 PHE 28 6.926 -6.820 14.554 200 HD1 PHE 28 HD1 PHE 28 3.219 -7.028 13.891 201 HD2 PHE 28 HD2 PHE 28 7.119 -6.361 12.345 202 HE1 PHE 28 HE1 PHE 28 2.270 -6.627 11.660 203 HE2 PHE 28 HE2 PHE 28 6.182 -5.952 10.117 204 HZ PHE 28 HZ PHE 28 3.752 -6.095 9.774 205 H ASN 29 H ASN 29 6.395 -9.330 12.919 206 HA ASN 29 HA ASN 29 7.941 -11.470 13.589 207 HB2 ASN 29 HB2 ASN 29 7.718 -9.784 11.150 208 HB3 ASN 29 HB3 ASN 29 8.746 -11.196 11.186 209 HD21 ASN 29 HD21 ASN 29 5.634 -9.991 10.857 210 HD22 ASN 29 HD22 ASN 29 4.803 -11.486 10.675 211 H GLY 30 H GLY 30 8.895 -9.179 15.039 212 HA2 GLY 30 HA2 GLY 30 11.137 -9.056 15.927 213 HA3 GLY 30 HA3 GLY 30 11.749 -9.414 14.315 214 H TYR 31 H TYR 31 9.273 -7.419 13.789 215 HA TYR 31 HA TYR 31 11.017 -5.019 13.776 216 HB2 TYR 31 HB2 TYR 31 8.374 -5.213 12.337 217 HB3 TYR 31 HB3 TYR 31 9.698 -4.113 12.033 218 HD1 TYR 31 HD1 TYR 31 8.494 -7.570 11.530 219 HD2 TYR 31 HD2 TYR 31 11.547 -4.743 10.643 220 HE1 TYR 31 HE1 TYR 31 9.321 -9.035 9.744 221 HE2 TYR 31 HE2 TYR 31 12.385 -6.208 8.858 222 HH TYR 31 HH TYR 31 12.325 -8.576 8.232 223 HA PRO 32 HA PRO 32 8.082 -4.166 17.264 224 HB2 PRO 32 HB2 PRO 32 10.261 -2.860 18.644 225 HB3 PRO 32 HB3 PRO 32 9.420 -4.351 19.082 226 HG2 PRO 32 HG2 PRO 32 12.023 -4.289 18.282 227 HG3 PRO 32 HG3 PRO 32 10.957 -5.690 18.059 228 HD2 PRO 32 HD2 PRO 32 11.744 -3.588 16.079 229 HD3 PRO 32 HD3 PRO 32 11.598 -5.347 15.866 230 H GLY 33 H GLY 33 6.906 -2.372 17.606 231 HA2 GLY 33 HA2 GLY 33 6.496 -0.059 17.873 232 HA3 GLY 33 HA3 GLY 33 8.061 0.286 17.156 233 H HIS 34 H HIS 34 6.523 -1.952 15.272 234 HA HIS 34 HA HIS 34 6.025 -0.141 13.154 235 HB2 HIS 34 HB2 HIS 34 7.058 -2.526 13.102 236 HB3 HIS 34 HB3 HIS 34 5.393 -3.083 13.154 237 HD1 HIS 34 HD1 HIS 34 4.764 -3.801 10.874 238 HD2 HIS 34 HD2 HIS 34 7.124 -0.400 10.786 239 HE1 HIS 34 HE1 HIS 34 4.919 -3.084 8.457 240 H VAL 35 H VAL 35 4.080 0.572 12.456 241 HA VAL 35 HA VAL 35 1.709 -0.204 14.001 242 HB VAL 35 HB VAL 35 0.949 1.990 12.512 243 HG11 VAL 35 HG11 VAL 35 1.392 3.203 14.793 244 HG12 VAL 35 HG12 VAL 35 1.758 1.572 15.350 245 HG13 VAL 35 HG13 VAL 35 0.167 1.942 14.679 246 HG21 VAL 35 HG21 VAL 35 3.695 2.598 13.593 247 HG22 VAL 35 HG22 VAL 35 2.594 3.720 12.792 248 HG23 VAL 35 HG23 VAL 35 3.314 2.392 11.884 249 H GLY 36 H GLY 36 3.111 -0.673 10.976 250 HA2 GLY 36 HA2 GLY 36 0.512 -1.489 9.856 251 HA3 GLY 36 HA3 GLY 36 1.705 -0.646 8.874 252 H VAL 37 H VAL 37 1.878 -2.303 7.423 253 HA VAL 37 HA VAL 37 3.388 -4.624 8.368 254 HB VAL 37 HB VAL 37 1.042 -5.302 7.966 255 HG11 VAL 37 HG11 VAL 37 0.159 -5.436 5.699 256 HG12 VAL 37 HG12 VAL 37 1.574 -4.583 5.100 257 HG13 VAL 37 HG13 VAL 37 0.453 -3.769 6.188 258 HG21 VAL 37 HG21 VAL 37 3.142 -6.504 6.179 259 HG22 VAL 37 HG22 VAL 37 1.549 -7.222 6.410 260 HG23 VAL 37 HG23 VAL 37 2.641 -7.037 7.784 261 H ASP 38 H ASP 38 4.877 -5.535 6.847 262 HA ASP 38 HA ASP 38 5.507 -3.805 4.552 263 HB2 ASP 38 HB2 ASP 38 7.449 -4.881 6.615 264 HB3 ASP 38 HB3 ASP 38 7.946 -4.141 5.093 265 H TYR 39 H TYR 39 5.946 -4.707 2.726 266 HA TYR 39 HA TYR 39 6.074 -7.644 2.576 267 HB2 TYR 39 HB2 TYR 39 4.984 -5.870 0.405 268 HB3 TYR 39 HB3 TYR 39 4.822 -7.597 0.566 269 HD1 TYR 39 HD1 TYR 39 3.781 -4.394 2.060 270 HD2 TYR 39 HD2 TYR 39 2.867 -8.514 1.579 271 HE1 TYR 39 HE1 TYR 39 1.568 -4.011 3.004 272 HE2 TYR 39 HE2 TYR 39 0.633 -8.130 2.535 273 HH TYR 39 HH TYR 39 -0.706 -5.095 2.911 274 H ALA 40 H ALA 40 8.064 -8.164 2.095 275 HA ALA 40 HA ALA 40 9.993 -6.664 0.779 276 HB1 ALA 40 HB1 ALA 40 9.849 -9.671 0.922 277 HB2 ALA 40 HB2 ALA 40 10.472 -8.624 2.196 278 HB3 ALA 40 HB3 ALA 40 11.295 -8.700 0.638 279 H VAL 41 H VAL 41 9.546 -5.791 -1.152 280 HA VAL 41 HA VAL 41 9.253 -7.544 -3.428 281 HB VAL 41 HB VAL 41 6.932 -6.913 -2.831 282 HG11 VAL 41 HG11 VAL 41 7.138 -4.776 -1.831 283 HG12 VAL 41 HG12 VAL 41 6.166 -4.571 -3.289 284 HG13 VAL 41 HG13 VAL 41 7.864 -4.091 -3.285 285 HG21 VAL 41 HG21 VAL 41 7.330 -7.448 -5.114 286 HG22 VAL 41 HG22 VAL 41 7.965 -5.837 -5.445 287 HG23 VAL 41 HG23 VAL 41 6.254 -6.051 -5.076 288 HA PRO 42 HA PRO 42 12.651 -4.983 -4.850 289 HB2 PRO 42 HB2 PRO 42 11.450 -5.604 -7.513 290 HB3 PRO 42 HB3 PRO 42 13.136 -5.722 -6.982 291 HG2 PRO 42 HG2 PRO 42 11.688 -7.914 -7.193 292 HG3 PRO 42 HG3 PRO 42 12.789 -7.694 -5.817 293 HD2 PRO 42 HD2 PRO 42 9.815 -7.484 -5.899 294 HD3 PRO 42 HD3 PRO 42 10.875 -8.083 -4.608 295 H VAL 43 H VAL 43 13.076 -3.118 -5.257 296 HA VAL 43 HA VAL 43 11.223 -1.042 -5.301 297 HB VAL 43 HB VAL 43 13.256 -0.785 -4.156 298 HG11 VAL 43 HG11 VAL 43 14.663 -2.340 -5.269 299 HG12 VAL 43 HG12 VAL 43 15.480 -0.777 -5.218 300 HG13 VAL 43 HG13 VAL 43 14.725 -1.330 -6.715 301 HG21 VAL 43 HG21 VAL 43 13.882 1.363 -4.735 302 HG22 VAL 43 HG22 VAL 43 12.372 1.214 -5.642 303 HG23 VAL 43 HG23 VAL 43 13.914 0.991 -6.458 304 H GLY 44 H GLY 44 10.465 0.279 -6.853 305 HA2 GLY 44 HA2 GLY 44 10.692 1.463 -8.910 306 HA3 GLY 44 HA3 GLY 44 11.644 0.125 -9.505 307 H THR 45 H THR 45 9.079 -1.221 -7.927 308 HA THR 45 HA THR 45 7.722 -1.781 -10.379 309 HB THR 45 HB THR 45 6.848 -2.841 -7.719 310 HG1 THR 45 HG1 THR 45 9.249 -3.058 -8.200 311 HG21 THR 45 HG21 THR 45 6.292 -4.842 -9.060 312 HG22 THR 45 HG22 THR 45 6.889 -4.024 -10.504 313 HG23 THR 45 HG23 THR 45 5.471 -3.402 -9.661 314 HA PRO 46 HA PRO 46 4.673 1.459 -9.740 315 HB2 PRO 46 HB2 PRO 46 2.827 -0.226 -11.332 316 HB3 PRO 46 HB3 PRO 46 3.367 1.433 -11.624 317 HG2 PRO 46 HG2 PRO 46 4.262 -0.571 -13.127 318 HG3 PRO 46 HG3 PRO 46 5.319 0.776 -12.656 319 HD2 PRO 46 HD2 PRO 46 5.193 -1.997 -11.546 320 HD3 PRO 46 HD3 PRO 46 6.603 -0.971 -11.882 321 H VAL 47 H VAL 47 3.424 1.753 -8.046 322 HA VAL 47 HA VAL 47 1.998 -0.429 -6.844 323 HB VAL 47 HB VAL 47 2.439 2.265 -5.575 324 HG11 VAL 47 HG11 VAL 47 0.722 0.945 -4.509 325 HG12 VAL 47 HG12 VAL 47 2.142 1.000 -3.464 326 HG13 VAL 47 HG13 VAL 47 1.803 -0.447 -4.413 327 HG21 VAL 47 HG21 VAL 47 4.654 1.668 -5.800 328 HG22 VAL 47 HG22 VAL 47 4.301 -0.057 -5.724 329 HG23 VAL 47 HG23 VAL 47 4.249 0.914 -4.257 330 H ARG 48 H ARG 48 0.045 -0.608 -7.067 331 HA ARG 48 HA ARG 48 -1.517 1.562 -8.076 332 HB2 ARG 48 HB2 ARG 48 -1.998 -1.402 -8.140 333 HB3 ARG 48 HB3 ARG 48 -3.211 -0.233 -8.644 334 HG2 ARG 48 HG2 ARG 48 -2.201 0.183 -10.603 335 HG3 ARG 48 HG3 ARG 48 -0.575 0.069 -9.916 336 HD2 ARG 48 HD2 ARG 48 -0.844 -2.400 -9.847 337 HD3 ARG 48 HD3 ARG 48 -2.399 -2.216 -10.657 338 HE ARG 48 HE ARG 48 -0.152 -1.019 -12.029 339 HH11 ARG 48 HH11 ARG 48 -1.700 -4.538 -13.307 340 HH12 ARG 48 HH12 ARG 48 -2.151 -3.909 -11.680 341 HH21 ARG 48 HH21 ARG 48 -0.269 -3.364 -14.638 342 HH22 ARG 48 HH22 ARG 48 0.425 -1.800 -14.076 343 H ALA 49 H ALA 49 -3.593 2.014 -7.361 344 HA ALA 49 HA ALA 49 -3.756 2.046 -4.543 345 HB1 ALA 49 HB1 ALA 49 -5.912 3.244 -4.925 346 HB2 ALA 49 HB2 ALA 49 -5.682 2.988 -6.656 347 HB3 ALA 49 HB3 ALA 49 -4.527 3.962 -5.746 348 H VAL 50 H VAL 50 -4.629 0.586 -3.268 349 HA VAL 50 HA VAL 50 -5.896 -1.718 -4.218 350 HB VAL 50 HB VAL 50 -5.870 -0.794 -1.398 351 HG11 VAL 50 HG11 VAL 50 -7.395 -2.655 -1.725 352 HG12 VAL 50 HG12 VAL 50 -5.978 -3.181 -0.817 353 HG13 VAL 50 HG13 VAL 50 -6.121 -3.570 -2.531 354 HG21 VAL 50 HG21 VAL 50 -3.811 -2.368 -2.908 355 HG22 VAL 50 HG22 VAL 50 -3.843 -2.217 -1.151 356 HG23 VAL 50 HG23 VAL 50 -3.613 -0.789 -2.155 357 H ALA 51 H ALA 51 -7.236 1.312 -3.552 358 HA ALA 51 HA ALA 51 -9.810 0.607 -4.368 359 HB1 ALA 51 HB1 ALA 51 -9.372 0.932 -1.434 360 HB2 ALA 51 HB2 ALA 51 -10.334 -0.279 -2.281 361 HB3 ALA 51 HB3 ALA 51 -10.912 1.384 -2.163 362 H ASN 52 H ASN 52 -10.986 2.345 -4.937 363 HA ASN 52 HA ASN 52 -9.750 4.764 -5.381 364 HB2 ASN 52 HB2 ASN 52 -12.159 5.501 -5.894 365 HB3 ASN 52 HB3 ASN 52 -11.457 4.245 -6.848 366 HD21 ASN 52 HD21 ASN 52 -12.830 4.011 -3.666 367 HD22 ASN 52 HD22 ASN 52 -14.113 2.937 -4.084 368 H GLY 53 H GLY 53 -10.316 6.887 -4.640 369 HA2 GLY 53 HA2 GLY 53 -11.921 7.584 -2.508 370 HA3 GLY 53 HA3 GLY 53 -10.414 7.053 -1.783 371 H THR 54 H THR 54 -9.222 8.727 -1.208 372 HA THR 54 HA THR 54 -8.710 10.888 -2.991 373 HB THR 54 HB THR 54 -9.567 11.380 -0.203 374 HG1 THR 54 HG1 THR 54 -11.452 12.345 -1.635 375 HG21 THR 54 HG21 THR 54 -9.830 13.722 -0.909 376 HG22 THR 54 HG22 THR 54 -9.300 13.282 -2.532 377 HG23 THR 54 HG23 THR 54 -8.180 13.159 -1.174 378 H VAL 55 H VAL 55 -6.692 11.734 -2.686 379 HA VAL 55 HA VAL 55 -4.854 10.303 -1.030 380 HB VAL 55 HB VAL 55 -4.234 12.661 -2.811 381 HG11 VAL 55 HG11 VAL 55 -2.506 10.374 -1.888 382 HG12 VAL 55 HG12 VAL 55 -2.427 12.043 -1.324 383 HG13 VAL 55 HG13 VAL 55 -2.006 11.656 -2.993 384 HG21 VAL 55 HG21 VAL 55 -5.392 11.052 -4.204 385 HG22 VAL 55 HG22 VAL 55 -4.325 9.764 -3.645 386 HG23 VAL 55 HG23 VAL 55 -3.679 11.084 -4.616 387 H LYS 56 H LYS 56 -4.670 10.940 0.950 388 HA LYS 56 HA LYS 56 -5.138 13.650 1.815 389 HB2 LYS 56 HB2 LYS 56 -4.420 11.653 3.871 390 HB3 LYS 56 HB3 LYS 56 -5.653 12.897 3.909 391 HG2 LYS 56 HG2 LYS 56 -5.829 10.166 2.667 392 HG3 LYS 56 HG3 LYS 56 -6.736 10.787 4.036 393 HD2 LYS 56 HD2 LYS 56 -6.966 12.138 1.388 394 HD3 LYS 56 HD3 LYS 56 -7.829 10.622 1.649 395 HE2 LYS 56 HE2 LYS 56 -8.874 11.647 3.678 396 HE3 LYS 56 HE3 LYS 56 -8.120 13.177 3.229 397 HZ1 LYS 56 HZ1 LYS 56 -10.067 11.657 1.578 398 HZ2 LYS 56 HZ2 LYS 56 -9.344 13.124 1.145 399 HZ3 LYS 56 HZ3 LYS 56 -10.404 13.062 2.460 400 H PHE 57 H PHE 57 -2.617 11.629 1.043 401 HA PHE 57 HA PHE 57 -0.634 13.535 1.766 402 HB2 PHE 57 HB2 PHE 57 -0.956 11.902 3.799 403 HB3 PHE 57 HB3 PHE 57 -0.069 10.774 2.781 404 HD1 PHE 57 HD1 PHE 57 0.148 13.725 4.873 405 HD2 PHE 57 HD2 PHE 57 2.251 11.258 2.113 406 HE1 PHE 57 HE1 PHE 57 2.273 14.742 5.585 407 HE2 PHE 57 HE2 PHE 57 4.377 12.268 2.823 408 HZ PHE 57 HZ PHE 57 4.391 14.014 4.560 409 H ALA 58 H ALA 58 1.108 13.407 0.553 410 HA ALA 58 HA ALA 58 1.686 11.224 -1.181 411 HB1 ALA 58 HB1 ALA 58 0.109 12.370 -2.585 412 HB2 ALA 58 HB2 ALA 58 1.721 12.692 -3.217 413 HB3 ALA 58 HB3 ALA 58 0.884 13.921 -2.271 414 H GLY 59 H GLY 59 3.552 11.059 -0.091 415 HA2 GLY 59 HA2 GLY 59 5.400 13.301 0.074 416 HA3 GLY 59 HA3 GLY 59 5.600 11.730 0.839 417 H ASN 60 H ASN 60 6.010 13.603 -2.027 418 HA ASN 60 HA ASN 60 6.963 11.595 -3.760 419 HB2 ASN 60 HB2 ASN 60 7.148 14.598 -3.821 420 HB3 ASN 60 HB3 ASN 60 7.805 13.581 -5.098 421 HD21 ASN 60 HD21 ASN 60 4.859 13.230 -3.202 422 HD22 ASN 60 HD22 ASN 60 3.797 13.284 -4.542 423 H GLY 61 H GLY 61 8.719 10.649 -3.858 424 HA2 GLY 61 HA2 GLY 61 10.989 11.258 -2.180 425 HA3 GLY 61 HA3 GLY 61 10.808 9.858 -3.219 426 H ALA 62 H ALA 62 10.096 12.422 -5.121 427 HA ALA 62 HA ALA 62 12.523 12.271 -6.551 428 HB1 ALA 62 HB1 ALA 62 10.226 14.151 -6.958 429 HB2 ALA 62 HB2 ALA 62 10.337 12.525 -7.634 430 HB3 ALA 62 HB3 ALA 62 11.486 13.767 -8.131 431 H ASN 63 H ASN 63 11.193 14.528 -4.296 432 HA ASN 63 HA ASN 63 13.629 16.068 -4.368 433 HB2 ASN 63 HB2 ASN 63 11.373 17.018 -5.585 434 HB3 ASN 63 HB3 ASN 63 11.339 17.763 -3.999 435 HD21 ASN 63 HD21 ASN 63 12.687 17.732 -7.066 436 HD22 ASN 63 HD22 ASN 63 13.831 18.999 -6.851 437 H HIS 64 H HIS 64 12.392 14.127 -2.461 438 HA HIS 64 HA HIS 64 11.566 15.696 -0.301 439 HB2 HIS 64 HB2 HIS 64 11.260 13.606 0.879 440 HB3 HIS 64 HB3 HIS 64 10.481 13.581 -0.675 441 HD1 HIS 64 HD1 HIS 64 13.664 12.901 -1.781 442 HD2 HIS 64 HD2 HIS 64 11.063 10.741 0.633 443 HE1 HIS 64 HE1 HIS 64 14.445 10.514 -1.917 444 HE2 HIS 64 HE2 HIS 64 12.858 9.224 -0.448 445 HA PRO 65 HA PRO 65 15.757 16.298 1.379 446 HB2 PRO 65 HB2 PRO 65 14.154 17.633 3.502 447 HB3 PRO 65 HB3 PRO 65 15.527 18.271 2.569 448 HG2 PRO 65 HG2 PRO 65 13.126 19.155 2.068 449 HG3 PRO 65 HG3 PRO 65 14.195 18.725 0.711 450 HD2 PRO 65 HD2 PRO 65 12.011 17.073 1.964 451 HD3 PRO 65 HD3 PRO 65 12.309 17.469 0.269 452 H TRP 66 H TRP 66 16.811 15.728 3.317 453 HA TRP 66 HA TRP 66 15.452 13.642 4.798 454 HB2 TRP 66 HB2 TRP 66 18.377 14.368 4.801 455 HB3 TRP 66 HB3 TRP 66 17.636 13.054 5.707 456 HD1 TRP 66 HD1 TRP 66 18.160 14.107 2.013 457 HE1 TRP 66 HE1 TRP 66 18.295 11.975 0.579 458 HE3 TRP 66 HE3 TRP 66 17.257 10.608 5.647 459 HZ2 TRP 66 HZ2 TRP 66 18.057 9.189 0.935 460 HZ3 TRP 66 HZ3 TRP 66 17.229 8.233 5.008 461 HH2 TRP 66 HH2 TRP 66 17.620 7.541 2.700 462 H MET 67 H MET 67 15.387 16.717 4.935 463 HA MET 67 HA MET 67 16.232 17.287 7.584 464 HB2 MET 67 HB2 MET 67 14.764 18.836 5.488 465 HB3 MET 67 HB3 MET 67 14.895 19.460 7.125 466 HG2 MET 67 HG2 MET 67 17.323 19.437 6.956 467 HG3 MET 67 HG3 MET 67 17.212 18.770 5.329 468 HE1 MET 67 HE1 MET 67 18.913 21.319 6.026 469 HE2 MET 67 HE2 MET 67 18.477 22.444 4.740 470 HE3 MET 67 HE3 MET 67 18.763 20.744 4.367 471 H LEU 68 H LEU 68 13.205 16.745 5.913 472 HA LEU 68 HA LEU 68 12.038 16.201 8.537 473 HB2 LEU 68 HB2 LEU 68 9.921 17.154 7.891 474 HB3 LEU 68 HB3 LEU 68 11.181 18.346 7.702 475 HG LEU 68 HG LEU 68 11.065 17.452 5.168 476 HD11 LEU 68 HD11 LEU 68 8.700 17.123 4.564 477 HD12 LEU 68 HD12 LEU 68 8.253 17.144 6.269 478 HD13 LEU 68 HD13 LEU 68 9.269 15.848 5.640 479 HD21 LEU 68 HD21 LEU 68 9.257 19.512 6.446 480 HD22 LEU 68 HD22 LEU 68 9.606 19.388 4.722 481 HD23 LEU 68 HD23 LEU 68 10.898 19.774 5.856 482 H TRP 69 H TRP 69 13.318 14.580 6.167 483 HA TRP 69 HA TRP 69 11.143 12.599 6.173 484 HB2 TRP 69 HB2 TRP 69 12.685 12.876 3.624 485 HB3 TRP 69 HB3 TRP 69 11.095 12.184 3.883 486 HD1 TRP 69 HD1 TRP 69 12.488 15.796 4.378 487 HE1 TRP 69 HE1 TRP 69 10.880 17.430 3.254 488 HE3 TRP 69 HE3 TRP 69 9.113 12.449 2.494 489 HZ2 TRP 69 HZ2 TRP 69 8.522 17.336 1.723 490 HZ3 TRP 69 HZ3 TRP 69 7.220 13.317 1.204 491 HH2 TRP 69 HH2 TRP 69 6.925 15.708 0.824 492 H MET 70 H MET 70 11.870 10.839 7.116 493 HA MET 70 HA MET 70 14.661 10.019 6.652 494 HB2 MET 70 HB2 MET 70 12.831 9.630 9.002 495 HB3 MET 70 HB3 MET 70 14.233 8.598 8.763 496 HG2 MET 70 HG2 MET 70 14.885 10.300 10.255 497 HG3 MET 70 HG3 MET 70 15.633 10.673 8.704 498 HE1 MET 70 HE1 MET 70 14.744 14.133 10.489 499 HE2 MET 70 HE2 MET 70 16.067 13.126 9.898 500 HE3 MET 70 HE3 MET 70 15.129 12.617 11.303 501 H ALA 71 H ALA 71 11.310 8.921 6.607 502 HA ALA 71 HA ALA 71 12.032 6.178 6.026 503 HB1 ALA 71 HB1 ALA 71 9.621 5.768 5.946 504 HB2 ALA 71 HB2 ALA 71 9.333 7.498 6.127 505 HB3 ALA 71 HB3 ALA 71 10.109 6.593 7.427 506 H GLY 72 H GLY 72 11.401 8.986 4.196 507 HA2 GLY 72 HA2 GLY 72 11.936 9.091 1.875 508 HA3 GLY 72 HA3 GLY 72 11.527 7.393 1.736 509 H ASN 73 H ASN 73 9.890 7.141 0.424 510 HA ASN 73 HA ASN 73 7.929 9.143 -0.066 511 HB2 ASN 73 HB2 ASN 73 8.419 6.393 -1.152 512 HB3 ASN 73 HB3 ASN 73 6.994 7.325 -1.597 513 HD21 ASN 73 HD21 ASN 73 10.483 7.224 -1.688 514 HD22 ASN 73 HD22 ASN 73 10.668 8.274 -3.046 515 H ALA 74 H ALA 74 5.734 9.021 0.266 516 HA ALA 74 HA ALA 74 4.569 6.804 1.634 517 HB1 ALA 74 HB1 ALA 74 3.697 8.116 3.525 518 HB2 ALA 74 HB2 ALA 74 4.661 9.492 2.986 519 HB3 ALA 74 HB3 ALA 74 5.458 8.017 3.534 520 H VAL 75 H VAL 75 2.351 6.686 1.495 521 HA VAL 75 HA VAL 75 0.937 8.874 0.176 522 HB VAL 75 HB VAL 75 0.242 6.135 -0.793 523 HG11 VAL 75 HG11 VAL 75 -1.059 8.230 -1.296 524 HG12 VAL 75 HG12 VAL 75 -0.572 7.278 -2.700 525 HG13 VAL 75 HG13 VAL 75 0.310 8.747 -2.283 526 HG21 VAL 75 HG21 VAL 75 2.400 7.709 -2.156 527 HG22 VAL 75 HG22 VAL 75 1.804 6.107 -2.576 528 HG23 VAL 75 HG23 VAL 75 2.728 6.347 -1.093 529 H LEU 76 H LEU 76 -0.780 9.303 1.300 530 HA LEU 76 HA LEU 76 -2.162 7.140 2.690 531 HB2 LEU 76 HB2 LEU 76 -0.949 9.290 3.872 532 HB3 LEU 76 HB3 LEU 76 -2.609 9.798 3.797 533 HG LEU 76 HG LEU 76 -2.158 7.085 4.869 534 HD11 LEU 76 HD11 LEU 76 -0.227 8.204 5.818 535 HD12 LEU 76 HD12 LEU 76 -1.445 7.917 7.062 536 HD13 LEU 76 HD13 LEU 76 -1.248 9.530 6.377 537 HD21 LEU 76 HD21 LEU 76 -3.798 9.479 5.671 538 HD22 LEU 76 HD22 LEU 76 -3.767 7.961 6.562 539 HD23 LEU 76 HD23 LEU 76 -4.360 7.995 4.900 540 H ILE 77 H ILE 77 -4.085 6.935 2.260 541 HA ILE 77 HA ILE 77 -5.634 8.891 0.844 542 HB ILE 77 HB ILE 77 -4.936 6.158 -0.136 543 HG12 ILE 77 HG12 ILE 77 -5.093 8.479 -1.945 544 HG13 ILE 77 HG13 ILE 77 -3.810 8.498 -0.740 545 HG21 ILE 77 HG21 ILE 77 -7.202 7.794 -1.259 546 HG22 ILE 77 HG22 ILE 77 -7.395 6.337 -0.288 547 HG23 ILE 77 HG23 ILE 77 -6.624 6.243 -1.870 548 HD11 ILE 77 HD11 ILE 77 -3.198 7.564 -2.991 549 HD12 ILE 77 HD12 ILE 77 -4.245 6.194 -2.617 550 HD13 ILE 77 HD13 ILE 77 -2.838 6.532 -1.608 551 H GLN 78 H GLN 78 -7.794 8.596 0.979 552 HA GLN 78 HA GLN 78 -8.793 6.979 3.125 553 HB2 GLN 78 HB2 GLN 78 -9.229 9.359 3.302 554 HB3 GLN 78 HB3 GLN 78 -10.001 9.366 1.728 555 HG2 GLN 78 HG2 GLN 78 -11.397 7.440 3.101 556 HG3 GLN 78 HG3 GLN 78 -11.103 8.661 4.323 557 HE21 GLN 78 HE21 GLN 78 -12.469 7.919 1.301 558 HE22 GLN 78 HE22 GLN 78 -13.556 9.245 1.184 559 H HIS 79 H HIS 79 -9.686 5.211 2.602 560 HA HIS 79 HA HIS 79 -10.361 4.400 -0.003 561 HB2 HIS 79 HB2 HIS 79 -10.500 3.138 2.672 562 HB3 HIS 79 HB3 HIS 79 -11.403 2.406 1.349 563 HD1 HIS 79 HD1 HIS 79 -9.101 3.232 -0.769 564 HD2 HIS 79 HD2 HIS 79 -8.664 0.985 2.697 565 HE1 HIS 79 HE1 HIS 79 -6.990 1.891 -1.097 566 HE2 HIS 79 HE2 HIS 79 -6.761 0.522 1.003 567 H ALA 80 H ALA 80 -12.428 2.915 -0.063 568 HA ALA 80 HA ALA 80 -14.482 4.677 -0.615 569 HB1 ALA 80 HB1 ALA 80 -14.757 1.702 -0.447 570 HB2 ALA 80 HB2 ALA 80 -14.012 2.545 -1.804 571 HB3 ALA 80 HB3 ALA 80 -15.714 2.815 -1.425 572 H ASP 81 H ASP 81 -13.773 3.124 2.303 573 HA ASP 81 HA ASP 81 -16.480 3.376 3.293 574 HB2 ASP 81 HB2 ASP 81 -14.635 1.365 3.638 575 HB3 ASP 81 HB3 ASP 81 -14.666 2.217 5.171 576 H GLY 82 H GLY 82 -13.543 4.934 3.261 577 HA2 GLY 82 HA2 GLY 82 -13.443 7.200 4.055 578 HA3 GLY 82 HA3 GLY 82 -14.403 6.707 5.440 579 H MET 83 H MET 83 -12.434 4.191 5.107 580 HA MET 83 HA MET 83 -10.787 4.872 7.225 581 HB2 MET 83 HB2 MET 83 -9.702 2.649 6.608 582 HB3 MET 83 HB3 MET 83 -11.346 2.646 7.150 583 HG2 MET 83 HG2 MET 83 -11.891 2.669 4.606 584 HG3 MET 83 HG3 MET 83 -10.235 2.085 4.453 585 HE1 MET 83 HE1 MET 83 -12.848 0.557 3.444 586 HE2 MET 83 HE2 MET 83 -12.554 -1.101 3.956 587 HE3 MET 83 HE3 MET 83 -11.255 -0.156 3.230 588 H HIS 84 H HIS 84 -8.355 4.564 7.165 589 HA HIS 84 HA HIS 84 -7.396 5.988 4.835 590 HB2 HIS 84 HB2 HIS 84 -6.417 5.991 7.679 591 HB3 HIS 84 HB3 HIS 84 -5.457 6.639 6.362 592 HD1 HIS 84 HD1 HIS 84 -5.952 8.998 5.638 593 HD2 HIS 84 HD2 HIS 84 -8.877 7.436 8.140 594 HE1 HIS 84 HE1 HIS 84 -7.452 10.935 6.213 595 HE2 HIS 84 HE2 HIS 84 -9.220 9.964 7.720 596 H THR 85 H THR 85 -5.477 5.318 3.782 597 HA THR 85 HA THR 85 -4.275 2.850 4.709 598 HB THR 85 HB THR 85 -4.267 2.665 1.939 599 HG1 THR 85 HG1 THR 85 -5.978 4.110 1.735 600 HG21 THR 85 HG21 THR 85 -4.412 0.816 3.552 601 HG22 THR 85 HG22 THR 85 -5.644 0.683 2.299 602 HG23 THR 85 HG23 THR 85 -6.080 1.268 3.903 603 H GLY 86 H GLY 86 -2.185 2.991 4.698 604 HA2 GLY 86 HA2 GLY 86 -0.916 5.153 3.171 605 HA3 GLY 86 HA3 GLY 86 -0.262 4.428 4.631 606 H TYR 87 H TYR 87 1.041 4.817 2.161 607 HA TYR 87 HA TYR 87 1.924 2.132 1.568 608 HB2 TYR 87 HB2 TYR 87 1.556 4.248 -0.587 609 HB3 TYR 87 HB3 TYR 87 1.993 2.565 -0.821 610 HD1 TYR 87 HD1 TYR 87 0.344 1.132 -1.630 611 HD2 TYR 87 HD2 TYR 87 -0.897 4.593 0.544 612 HE1 TYR 87 HE1 TYR 87 -2.027 0.605 -2.117 613 HE2 TYR 87 HE2 TYR 87 -3.237 4.052 0.064 614 HH TYR 87 HH TYR 87 -4.218 1.052 -1.227 615 H ALA 88 H ALA 88 3.819 2.419 2.713 616 HA ALA 88 HA ALA 88 5.363 4.848 2.094 617 HB1 ALA 88 HB1 ALA 88 6.311 4.776 4.329 618 HB2 ALA 88 HB2 ALA 88 5.386 3.323 4.689 619 HB3 ALA 88 HB3 ALA 88 4.551 4.842 4.389 620 H HIS 89 H HIS 89 7.749 4.599 2.727 621 HA HIS 89 HA HIS 89 9.803 3.818 2.247 622 HB2 HIS 89 HB2 HIS 89 8.417 1.163 2.622 623 HB3 HIS 89 HB3 HIS 89 10.135 1.282 2.256 624 HD1 HIS 89 HD1 HIS 89 7.926 3.153 4.747 625 HD2 HIS 89 HD2 HIS 89 11.460 0.974 4.586 626 HE1 HIS 89 HE1 HIS 89 8.883 3.254 7.069 627 HE2 HIS 89 HE2 HIS 89 11.023 1.930 6.950 628 H LEU 90 H LEU 90 7.694 4.236 0.110 629 HA LEU 90 HA LEU 90 8.482 2.647 -2.118 630 HB2 LEU 90 HB2 LEU 90 6.927 5.212 -2.202 631 HB3 LEU 90 HB3 LEU 90 6.927 3.927 -3.384 632 HG LEU 90 HG LEU 90 5.880 3.503 -0.587 633 HD11 LEU 90 HD11 LEU 90 4.674 5.377 -1.530 634 HD12 LEU 90 HD12 LEU 90 3.646 3.945 -1.495 635 HD13 LEU 90 HD13 LEU 90 4.373 4.470 -3.012 636 HD21 LEU 90 HD21 LEU 90 6.243 1.460 -1.702 637 HD22 LEU 90 HD22 LEU 90 5.585 2.080 -3.213 638 HD23 LEU 90 HD23 LEU 90 4.514 1.783 -1.845 639 H SER 91 H SER 91 9.086 3.903 -4.233 640 HA SER 91 HA SER 91 11.374 5.544 -3.591 641 HB2 SER 91 HB2 SER 91 11.832 3.414 -4.791 642 HB3 SER 91 HB3 SER 91 10.865 4.009 -6.135 643 HG SER 91 HG SER 91 12.987 5.568 -5.170 644 H LYS 92 H LYS 92 8.280 5.701 -4.952 645 HA LYS 92 HA LYS 92 8.549 8.397 -5.635 646 HB2 LYS 92 HB2 LYS 92 9.398 6.708 -7.675 647 HB3 LYS 92 HB3 LYS 92 7.773 7.187 -8.139 648 HG2 LYS 92 HG2 LYS 92 8.339 9.496 -8.010 649 HG3 LYS 92 HG3 LYS 92 9.928 9.095 -7.355 650 HD2 LYS 92 HD2 LYS 92 10.596 8.079 -9.414 651 HD3 LYS 92 HD3 LYS 92 8.951 8.169 -10.050 652 HE2 LYS 92 HE2 LYS 92 9.081 10.601 -10.080 653 HE3 LYS 92 HE3 LYS 92 10.698 10.540 -9.380 654 HZ1 LYS 92 HZ1 LYS 92 9.923 9.432 -12.026 655 HZ2 LYS 92 HZ2 LYS 92 11.477 9.401 -11.359 656 HZ3 LYS 92 HZ3 LYS 92 10.766 10.878 -11.774 657 H ILE 93 H ILE 93 6.696 9.354 -6.390 658 HA ILE 93 HA ILE 93 4.230 7.874 -6.046 659 HB ILE 93 HB ILE 93 5.169 10.286 -4.740 660 HG12 ILE 93 HG12 ILE 93 3.072 9.559 -3.279 661 HG13 ILE 93 HG13 ILE 93 3.349 8.051 -4.143 662 HG21 ILE 93 HG21 ILE 93 3.645 11.391 -6.223 663 HG22 ILE 93 HG22 ILE 93 3.094 11.463 -4.550 664 HG23 ILE 93 HG23 ILE 93 2.349 10.332 -5.674 665 HD11 ILE 93 HD11 ILE 93 5.654 8.010 -3.339 666 HD12 ILE 93 HD12 ILE 93 4.515 8.072 -1.997 667 HD13 ILE 93 HD13 ILE 93 5.385 9.526 -2.481 668 H SER 94 H SER 94 2.490 8.470 -7.276 669 HA SER 94 HA SER 94 3.024 10.098 -9.623 670 HB2 SER 94 HB2 SER 94 2.435 7.551 -9.735 671 HB3 SER 94 HB3 SER 94 0.801 8.136 -9.413 672 HG SER 94 HG SER 94 2.464 8.710 -11.632 673 H VAL 95 H VAL 95 1.433 10.066 -6.726 674 HA VAL 95 HA VAL 95 -0.840 11.479 -7.664 675 HB VAL 95 HB VAL 95 -1.498 11.120 -5.145 676 HG11 VAL 95 HG11 VAL 95 -2.734 10.358 -7.138 677 HG12 VAL 95 HG12 VAL 95 -2.790 9.199 -5.812 678 HG13 VAL 95 HG13 VAL 95 -1.713 8.919 -7.181 679 HG21 VAL 95 HG21 VAL 95 0.485 10.044 -4.368 680 HG22 VAL 95 HG22 VAL 95 0.409 8.860 -5.674 681 HG23 VAL 95 HG23 VAL 95 -0.809 8.846 -4.399 682 H SER 96 H SER 96 -1.624 12.848 -5.530 683 HA SER 96 HA SER 96 0.386 14.555 -4.504 684 HB2 SER 96 HB2 SER 96 -1.671 15.681 -6.423 685 HB3 SER 96 HB3 SER 96 -0.574 16.645 -5.433 686 HG SER 96 HG SER 96 0.439 16.479 -7.351 687 H THR 97 H THR 97 -0.312 15.673 -2.752 688 HA THR 97 HA THR 97 -2.354 14.623 -1.225 689 HB THR 97 HB THR 97 -1.324 17.420 -0.838 690 HG1 THR 97 HG1 THR 97 0.574 16.413 -1.028 691 HG21 THR 97 HG21 THR 97 -1.904 15.274 1.204 692 HG22 THR 97 HG22 THR 97 -3.074 16.494 0.714 693 HG23 THR 97 HG23 THR 97 -1.576 16.979 1.508 694 H ASP 98 H ASP 98 -4.492 14.928 -1.177 695 HA ASP 98 HA ASP 98 -6.533 15.958 -1.167 696 HB2 ASP 98 HB2 ASP 98 -4.905 18.291 -1.883 697 HB3 ASP 98 HB3 ASP 98 -6.514 18.306 -2.601 698 H SER 99 H SER 99 -4.703 14.954 -3.734 699 HA SER 99 HA SER 99 -6.584 15.416 -5.825 700 HB2 SER 99 HB2 SER 99 -4.222 13.542 -5.690 701 HB3 SER 99 HB3 SER 99 -5.115 13.956 -7.153 702 HG SER 99 HG SER 99 -4.161 16.105 -5.701 703 H THR 100 H THR 100 -7.920 13.846 -6.789 704 HA THR 100 HA THR 100 -8.834 11.800 -5.041 705 HB THR 100 HB THR 100 -10.392 11.278 -7.007 706 HG1 THR 100 HG1 THR 100 -9.392 12.422 -8.647 707 HG21 THR 100 HG21 THR 100 -11.876 13.133 -6.357 708 HG22 THR 100 HG22 THR 100 -10.507 13.915 -5.561 709 HG23 THR 100 HG23 THR 100 -11.103 12.363 -4.969 710 H VAL 101 H VAL 101 -8.834 9.614 -5.405 711 HA VAL 101 HA VAL 101 -7.094 8.680 -7.498 712 HB VAL 101 HB VAL 101 -6.786 6.768 -5.650 713 HG11 VAL 101 HG11 VAL 101 -5.114 9.230 -6.024 714 HG12 VAL 101 HG12 VAL 101 -5.013 7.723 -6.939 715 HG13 VAL 101 HG13 VAL 101 -4.564 7.752 -5.232 716 HG21 VAL 101 HG21 VAL 101 -6.278 7.775 -3.499 717 HG22 VAL 101 HG22 VAL 101 -7.977 7.982 -3.910 718 HG23 VAL 101 HG23 VAL 101 -6.856 9.332 -4.081 719 H LYS 102 H LYS 102 -7.299 6.335 -7.902 720 HA LYS 102 HA LYS 102 -9.872 5.207 -7.487 721 HB2 LYS 102 HB2 LYS 102 -9.680 6.528 -9.663 722 HB3 LYS 102 HB3 LYS 102 -8.650 5.208 -10.151 723 HG2 LYS 102 HG2 LYS 102 -10.555 3.655 -9.658 724 HG3 LYS 102 HG3 LYS 102 -11.556 5.083 -9.408 725 HD2 LYS 102 HD2 LYS 102 -10.847 5.800 -11.744 726 HD3 LYS 102 HD3 LYS 102 -10.235 4.157 -11.945 727 HE2 LYS 102 HE2 LYS 102 -12.453 3.261 -11.486 728 HE3 LYS 102 HE3 LYS 102 -13.073 4.891 -11.229 729 HZ1 LYS 102 HZ1 LYS 102 -13.655 4.254 -13.414 730 HZ2 LYS 102 HZ2 LYS 102 -12.094 3.710 -13.766 731 HZ3 LYS 102 HZ3 LYS 102 -12.388 5.364 -13.573 732 H GLN 103 H GLN 103 -9.961 3.058 -7.582 733 HA GLN 103 HA GLN 103 -7.828 1.612 -6.657 734 HB2 GLN 103 HB2 GLN 103 -10.358 1.137 -6.551 735 HB3 GLN 103 HB3 GLN 103 -10.127 0.362 -8.105 736 HG2 GLN 103 HG2 GLN 103 -8.339 -0.513 -5.924 737 HG3 GLN 103 HG3 GLN 103 -10.032 -0.978 -5.805 738 HE21 GLN 103 HE21 GLN 103 -8.602 -0.504 -8.873 739 HE22 GLN 103 HE22 GLN 103 -8.492 -2.143 -9.307 740 H GLY 104 H GLY 104 -6.383 0.297 -7.529 741 HA2 GLY 104 HA2 GLY 104 -5.072 -0.814 -9.039 742 HA3 GLY 104 HA3 GLY 104 -6.304 -0.569 -10.212 743 H GLN 105 H GLN 105 -5.818 2.422 -9.217 744 HA GLN 105 HA GLN 105 -4.285 3.197 -11.473 745 HB2 GLN 105 HB2 GLN 105 -6.165 4.496 -10.449 746 HB3 GLN 105 HB3 GLN 105 -5.126 4.835 -9.085 747 HG2 GLN 105 HG2 GLN 105 -3.687 6.179 -10.441 748 HG3 GLN 105 HG3 GLN 105 -4.540 5.692 -11.910 749 HE21 GLN 105 HE21 GLN 105 -4.951 7.327 -8.820 750 HE22 GLN 105 HE22 GLN 105 -6.230 8.366 -9.326 751 H ILE 106 H ILE 106 -2.279 4.020 -11.572 752 HA ILE 106 HA ILE 106 -0.490 3.002 -9.685 753 HB ILE 106 HB ILE 106 -0.013 4.583 -12.133 754 HG12 ILE 106 HG12 ILE 106 0.980 1.809 -11.648 755 HG13 ILE 106 HG13 ILE 106 -0.718 2.050 -12.034 756 HG21 ILE 106 HG21 ILE 106 2.080 3.468 -10.276 757 HG22 ILE 106 HG22 ILE 106 1.774 5.175 -10.593 758 HG23 ILE 106 HG23 ILE 106 2.407 4.140 -11.874 759 HD11 ILE 106 HD11 ILE 106 1.675 2.685 -13.735 760 HD12 ILE 106 HD12 ILE 106 0.047 3.253 -14.111 761 HD13 ILE 106 HD13 ILE 106 0.386 1.522 -14.053 762 H ILE 107 H ILE 107 -0.541 3.891 -7.824 763 HA ILE 107 HA ILE 107 -0.635 6.712 -7.454 764 HB ILE 107 HB ILE 107 -0.607 5.916 -4.976 765 HG12 ILE 107 HG12 ILE 107 -2.044 3.512 -5.704 766 HG13 ILE 107 HG13 ILE 107 -0.362 3.430 -6.216 767 HG21 ILE 107 HG21 ILE 107 -2.985 5.394 -6.734 768 HG22 ILE 107 HG22 ILE 107 -2.492 6.977 -6.133 769 HG23 ILE 107 HG23 ILE 107 -3.018 5.730 -5.003 770 HD11 ILE 107 HD11 ILE 107 -0.923 2.525 -3.926 771 HD12 ILE 107 HD12 ILE 107 -1.142 4.204 -3.433 772 HD13 ILE 107 HD13 ILE 107 0.425 3.658 -4.028 773 H GLY 108 H GLY 108 1.815 4.515 -7.876 774 HA2 GLY 108 HA2 GLY 108 3.895 6.226 -7.492 775 HA3 GLY 108 HA3 GLY 108 3.689 5.408 -5.950 776 H TYR 109 H TYR 109 5.770 4.643 -6.324 777 HA TYR 109 HA TYR 109 5.920 2.144 -7.712 778 HB2 TYR 109 HB2 TYR 109 8.177 4.156 -7.893 779 HB3 TYR 109 HB3 TYR 109 8.093 2.590 -8.684 780 HD1 TYR 109 HD1 TYR 109 7.160 2.391 -10.853 781 HD2 TYR 109 HD2 TYR 109 6.581 5.970 -8.635 782 HE1 TYR 109 HE1 TYR 109 6.232 3.476 -12.858 783 HE2 TYR 109 HE2 TYR 109 5.654 7.069 -10.631 784 HH TYR 109 HH TYR 109 5.734 6.834 -13.067 785 H THR 110 H THR 110 7.059 0.648 -6.575 786 HA THR 110 HA THR 110 7.388 0.933 -3.831 787 HB THR 110 HB THR 110 8.866 -1.228 -4.259 788 HG1 THR 110 HG1 THR 110 8.457 -0.596 -6.675 789 HG21 THR 110 HG21 THR 110 6.682 -2.515 -4.391 790 HG22 THR 110 HG22 THR 110 5.889 -0.943 -4.458 791 HG23 THR 110 HG23 THR 110 6.848 -1.385 -3.048 792 H GLY 111 H GLY 111 9.307 0.881 -2.456 793 HA2 GLY 111 HA2 GLY 111 11.812 1.523 -3.811 794 HA3 GLY 111 HA3 GLY 111 11.159 2.743 -2.738 795 H ALA 112 H ALA 112 13.342 2.349 -1.856 796 HA ALA 112 HA ALA 112 13.103 0.562 0.366 797 HB1 ALA 112 HB1 ALA 112 15.041 -0.671 0.003 798 HB2 ALA 112 HB2 ALA 112 15.764 0.586 -0.999 799 HB3 ALA 112 HB3 ALA 112 14.493 -0.437 -1.660 800 H THR 113 H THR 113 12.715 3.240 0.389 801 HA THR 113 HA THR 113 15.132 4.704 0.934 802 HB THR 113 HB THR 113 13.560 6.594 1.463 803 HG1 THR 113 HG1 THR 113 11.545 4.883 0.421 804 HG21 THR 113 HG21 THR 113 13.211 5.214 -1.205 805 HG22 THR 113 HG22 THR 113 14.500 6.340 -0.771 806 HG23 THR 113 HG23 THR 113 12.832 6.905 -0.872 807 H GLY 114 H GLY 114 13.472 2.579 2.827 808 HA2 GLY 114 HA2 GLY 114 13.820 4.115 5.316 809 HA3 GLY 114 HA3 GLY 114 12.873 2.647 5.150 810 H GLN 115 H GLN 115 14.159 2.160 7.164 811 HA GLN 115 HA GLN 115 16.917 1.335 6.648 812 HB2 GLN 115 HB2 GLN 115 15.288 1.671 9.151 813 HB3 GLN 115 HB3 GLN 115 16.783 0.748 9.173 814 HG2 GLN 115 HG2 GLN 115 17.896 2.790 8.174 815 HG3 GLN 115 HG3 GLN 115 16.408 3.659 8.547 816 HE21 GLN 115 HE21 GLN 115 15.865 4.049 10.686 817 HE22 GLN 115 HE22 GLN 115 16.999 3.873 11.976 818 H VAL 116 H VAL 116 16.720 -0.437 5.382 819 HA VAL 116 HA VAL 116 16.090 -2.927 6.688 820 HB VAL 116 HB VAL 116 14.729 -3.642 4.543 821 HG11 VAL 116 HG11 VAL 116 13.915 -3.763 6.834 822 HG12 VAL 116 HG12 VAL 116 12.650 -3.197 5.743 823 HG13 VAL 116 HG13 VAL 116 13.493 -2.051 6.784 824 HG21 VAL 116 HG21 VAL 116 14.038 -0.703 4.703 825 HG22 VAL 116 HG22 VAL 116 13.231 -1.910 3.702 826 HG23 VAL 116 HG23 VAL 116 14.910 -1.478 3.381 827 H THR 117 H THR 117 16.657 -4.828 5.242 828 HA THR 117 HA THR 117 19.212 -4.314 4.005 829 HB THR 117 HB THR 117 19.170 -6.829 3.584 830 HG1 THR 117 HG1 THR 117 17.397 -7.474 5.427 831 HG21 THR 117 HG21 THR 117 18.916 -5.776 6.402 832 HG22 THR 117 HG22 THR 117 20.393 -5.886 5.445 833 HG23 THR 117 HG23 THR 117 19.572 -7.356 5.972 834 H GLY 118 H GLY 118 16.086 -4.219 2.845 835 HA2 GLY 118 HA2 GLY 118 16.985 -4.119 0.112 836 HA3 GLY 118 HA3 GLY 118 15.966 -5.509 0.451 837 HA PRO 119 HA PRO 119 13.212 -1.859 -0.713 838 HB2 PRO 119 HB2 PRO 119 12.090 -3.809 -2.628 839 HB3 PRO 119 HB3 PRO 119 12.675 -2.170 -2.925 840 HG2 PRO 119 HG2 PRO 119 14.082 -4.216 -3.816 841 HG3 PRO 119 HG3 PRO 119 14.899 -2.828 -3.075 842 HD2 PRO 119 HD2 PRO 119 14.178 -5.453 -1.805 843 HD3 PRO 119 HD3 PRO 119 15.756 -4.628 -1.843 844 H HIS 120 H HIS 120 11.037 -1.590 -0.055 845 HA HIS 120 HA HIS 120 9.485 -3.848 0.655 846 HB2 HIS 120 HB2 HIS 120 10.769 -2.120 2.729 847 HB3 HIS 120 HB3 HIS 120 9.161 -2.764 3.040 848 HD1 HIS 120 HD1 HIS 120 12.693 -3.621 3.233 849 HD2 HIS 120 HD2 HIS 120 9.096 -5.689 2.989 850 HE1 HIS 120 HE1 HIS 120 13.219 -5.972 3.953 851 HE2 HIS 120 HE2 HIS 120 11.028 -7.207 3.799 852 H LEU 121 H LEU 121 7.452 -3.417 1.302 853 HA LEU 121 HA LEU 121 6.319 -0.897 0.523 854 HB2 LEU 121 HB2 LEU 121 5.579 -2.345 -1.116 855 HB3 LEU 121 HB3 LEU 121 5.488 -3.706 -0.040 856 HG LEU 121 HG LEU 121 3.433 -2.559 0.973 857 HD11 LEU 121 HD11 LEU 121 3.701 -0.936 -1.556 858 HD12 LEU 121 HD12 LEU 121 3.723 -0.330 0.099 859 HD13 LEU 121 HD13 LEU 121 2.245 -1.022 -0.568 860 HD21 LEU 121 HD21 LEU 121 1.967 -3.481 -0.689 861 HD22 LEU 121 HD22 LEU 121 3.383 -4.521 -0.545 862 HD23 LEU 121 HD23 LEU 121 3.237 -3.414 -1.909 863 H HIS 122 H HIS 122 5.219 0.085 2.007 864 HA HIS 122 HA HIS 122 4.517 -1.347 4.389 865 HB2 HIS 122 HB2 HIS 122 6.169 0.264 4.997 866 HB3 HIS 122 HB3 HIS 122 5.387 1.514 4.044 867 HD2 HIS 122 HD2 HIS 122 2.908 2.474 5.215 868 HE1 HIS 122 HE1 HIS 122 3.852 0.978 9.049 869 HE2 HIS 122 HE2 HIS 122 2.298 2.471 7.731 870 H PHE 123 H PHE 123 2.480 -1.802 4.444 871 HA PHE 123 HA PHE 123 0.510 0.127 3.434 872 HB2 PHE 123 HB2 PHE 123 0.731 -2.099 2.202 873 HB3 PHE 123 HB3 PHE 123 0.123 -2.866 3.662 874 HD1 PHE 123 HD1 PHE 123 -0.745 -0.596 0.893 875 HD2 PHE 123 HD2 PHE 123 -2.179 -2.883 4.184 876 HE1 PHE 123 HE1 PHE 123 -3.051 -0.303 0.089 877 HE2 PHE 123 HE2 PHE 123 -4.485 -2.595 3.385 878 HZ PHE 123 HZ PHE 123 -4.923 -1.305 1.334 879 H GLU 124 H GLU 124 -0.266 1.140 5.163 880 HA GLU 124 HA GLU 124 -1.124 -0.385 7.454 881 HB2 GLU 124 HB2 GLU 124 0.797 1.347 7.670 882 HB3 GLU 124 HB3 GLU 124 -0.475 2.547 7.523 883 HG2 GLU 124 HG2 GLU 124 -1.564 1.611 9.511 884 HG3 GLU 124 HG3 GLU 124 -0.259 0.446 9.663 885 H MET 125 H MET 125 -3.244 -0.400 7.729 886 HA MET 125 HA MET 125 -4.926 1.565 6.537 887 HB2 MET 125 HB2 MET 125 -6.623 -0.161 6.580 888 HB3 MET 125 HB3 MET 125 -5.220 -0.699 5.726 889 HG2 MET 125 HG2 MET 125 -4.549 -2.008 7.691 890 HG3 MET 125 HG3 MET 125 -6.052 -1.527 8.477 891 HE1 MET 125 HE1 MET 125 -8.789 -3.454 6.731 892 HE2 MET 125 HE2 MET 125 -8.387 -1.798 7.188 893 HE3 MET 125 HE3 MET 125 -8.169 -3.112 8.343 894 H LEU 126 H LEU 126 -6.261 2.653 7.709 895 HA LEU 126 HA LEU 126 -6.572 2.046 10.510 896 HB2 LEU 126 HB2 LEU 126 -5.467 4.554 9.284 897 HB3 LEU 126 HB3 LEU 126 -6.386 4.692 10.764 898 HG LEU 126 HG LEU 126 -4.627 2.772 11.479 899 HD11 LEU 126 HD11 LEU 126 -3.471 2.853 9.327 900 HD12 LEU 126 HD12 LEU 126 -2.424 3.379 10.647 901 HD13 LEU 126 HD13 LEU 126 -3.149 4.569 9.567 902 HD21 LEU 126 HD21 LEU 126 -4.192 5.748 11.576 903 HD22 LEU 126 HD22 LEU 126 -3.398 4.558 12.606 904 HD23 LEU 126 HD23 LEU 126 -5.143 4.794 12.714 905 HA PRO 127 HA PRO 127 -10.871 3.392 9.978 906 HB2 PRO 127 HB2 PRO 127 -11.183 5.254 11.968 907 HB3 PRO 127 HB3 PRO 127 -11.376 3.531 12.210 908 HG2 PRO 127 HG2 PRO 127 -9.056 5.270 12.824 909 HG3 PRO 127 HG3 PRO 127 -9.675 3.869 13.726 910 HD2 PRO 127 HD2 PRO 127 -7.488 3.683 12.218 911 HD3 PRO 127 HD3 PRO 127 -8.647 2.356 12.310 912 H ALA 128 H ALA 128 -12.281 5.429 9.955 913 HA ALA 128 HA ALA 128 -11.157 7.312 8.207 914 HB1 ALA 128 HB1 ALA 128 -13.529 6.689 8.118 915 HB2 ALA 128 HB2 ALA 128 -13.332 8.430 8.332 916 HB3 ALA 128 HB3 ALA 128 -13.760 7.415 9.710 917 H ASN 129 H ASN 129 -11.554 6.993 11.581 918 HA ASN 129 HA ASN 129 -9.954 9.230 12.228 919 HB2 ASN 129 HB2 ASN 129 -12.860 9.582 12.405 920 HB3 ASN 129 HB3 ASN 129 -12.054 9.841 13.948 921 HD21 ASN 129 HD21 ASN 129 -12.270 10.887 10.619 922 HD22 ASN 129 HD22 ASN 129 -11.552 12.440 10.858 923 HA PRO 130 HA PRO 130 -9.216 5.886 14.842 924 HB2 PRO 130 HB2 PRO 130 -6.625 7.056 15.399 925 HB3 PRO 130 HB3 PRO 130 -7.024 5.552 14.558 926 HG2 PRO 130 HG2 PRO 130 -6.076 7.775 13.267 927 HG3 PRO 130 HG3 PRO 130 -7.042 6.520 12.486 928 HD2 PRO 130 HD2 PRO 130 -7.828 9.217 13.456 929 HD3 PRO 130 HD3 PRO 130 -8.383 8.303 12.038 930 H ASN 131 H ASN 131 -8.516 5.465 16.921 931 HA ASN 131 HA ASN 131 -8.831 7.597 18.855 932 HB2 ASN 131 HB2 ASN 131 -10.484 5.486 18.505 933 HB3 ASN 131 HB3 ASN 131 -9.321 4.844 19.650 934 HD21 ASN 131 HD21 ASN 131 -11.771 7.166 19.040 935 HD22 ASN 131 HD22 ASN 131 -12.037 7.626 20.671 936 H TRP 132 H TRP 132 -6.529 7.766 18.313 937 HA TRP 132 HA TRP 132 -4.652 5.785 18.825 938 HB2 TRP 132 HB2 TRP 132 -4.032 8.706 19.153 939 HB3 TRP 132 HB3 TRP 132 -2.970 7.426 18.584 940 HD1 TRP 132 HD1 TRP 132 -3.509 6.482 16.060 941 HE1 TRP 132 HE1 TRP 132 -4.407 7.746 14.006 942 HE3 TRP 132 HE3 TRP 132 -5.568 10.526 18.415 943 HZ2 TRP 132 HZ2 TRP 132 -5.800 10.084 13.460 944 HZ3 TRP 132 HZ3 TRP 132 -6.676 12.241 17.038 945 HH2 TRP 132 HH2 TRP 132 -6.790 12.025 14.608 946 H GLN 133 H GLN 133 -6.640 6.606 21.010 947 HA GLN 133 HA GLN 133 -5.065 7.431 23.208 948 HB2 GLN 133 HB2 GLN 133 -7.919 6.576 22.893 949 HB3 GLN 133 HB3 GLN 133 -7.208 7.072 24.401 950 HG2 GLN 133 HG2 GLN 133 -8.221 9.027 23.689 951 HG3 GLN 133 HG3 GLN 133 -6.563 9.237 23.126 952 HE21 GLN 133 HE21 GLN 133 -6.127 8.672 20.867 953 HE22 GLN 133 HE22 GLN 133 -7.352 8.865 19.677 954 H ASN 134 H ASN 134 -4.248 5.050 22.040 955 HA ASN 134 HA ASN 134 -3.203 3.143 22.558 956 HB2 ASN 134 HB2 ASN 134 -4.152 3.831 25.335 957 HB3 ASN 134 HB3 ASN 134 -3.272 2.343 24.992 958 HD21 ASN 134 HD21 ASN 134 -3.118 5.844 24.694 959 HD22 ASN 134 HD22 ASN 134 -1.400 5.960 24.782 960 H GLY 135 H GLY 135 -3.768 1.237 21.963 961 HA2 GLY 135 HA2 GLY 135 -5.473 -0.571 22.899 962 HA3 GLY 135 HA3 GLY 135 -6.570 0.556 22.116 963 H PHE 136 H PHE 136 -5.357 1.246 19.822 964 HA PHE 136 HA PHE 136 -4.373 -1.107 18.448 965 HB2 PHE 136 HB2 PHE 136 -6.162 -0.561 16.579 966 HB3 PHE 136 HB3 PHE 136 -6.523 -1.674 17.883 967 HD1 PHE 136 HD1 PHE 136 -6.576 2.079 18.159 968 HD2 PHE 136 HD2 PHE 136 -8.833 -1.532 17.898 969 HE1 PHE 136 HE1 PHE 136 -8.618 3.312 18.655 970 HE2 PHE 136 HE2 PHE 136 -10.880 -0.282 18.419 971 HZ PHE 136 HZ PHE 136 -10.777 2.146 18.800 972 H SER 137 H SER 137 -4.898 2.233 18.654 973 HA SER 137 HA SER 137 -3.937 4.066 17.779 974 HB2 SER 137 HB2 SER 137 -1.968 2.039 16.735 975 HB3 SER 137 HB3 SER 137 -1.828 3.753 16.347 976 HG SER 137 HG SER 137 -2.152 3.718 18.904 977 H GLY 138 H GLY 138 -5.872 2.218 16.596 978 HA2 GLY 138 HA2 GLY 138 -7.403 2.436 14.916 979 HA3 GLY 138 HA3 GLY 138 -6.432 3.720 14.232 980 H ARG 139 H ARG 139 -4.172 1.475 14.559 981 HA ARG 139 HA ARG 139 -4.493 0.689 11.802 982 HB2 ARG 139 HB2 ARG 139 -2.238 -0.478 12.162 983 HB3 ARG 139 HB3 ARG 139 -2.288 1.273 12.191 984 HG2 ARG 139 HG2 ARG 139 -0.897 0.769 13.948 985 HG3 ARG 139 HG3 ARG 139 -2.441 0.986 14.763 986 HD2 ARG 139 HD2 ARG 139 -2.750 -1.427 14.827 987 HD3 ARG 139 HD3 ARG 139 -1.241 -1.659 13.953 988 HE ARG 139 HE ARG 139 -0.262 -0.429 16.008 989 HH11 ARG 139 HH11 ARG 139 -2.939 -2.731 16.085 990 HH12 ARG 139 HH12 ARG 139 -2.579 -3.247 17.773 991 HH21 ARG 139 HH21 ARG 139 -0.839 -2.314 18.915 992 HH22 ARG 139 HH22 ARG 139 0.190 -1.054 18.140 993 H ILE 140 H ILE 140 -5.260 -1.107 11.017 994 HA ILE 140 HA ILE 140 -5.359 -3.459 12.724 995 HB ILE 140 HB ILE 140 -7.458 -3.505 10.759 996 HG12 ILE 140 HG12 ILE 140 -8.884 -1.943 12.359 997 HG13 ILE 140 HG13 ILE 140 -7.322 -1.181 12.627 998 HG21 ILE 140 HG21 ILE 140 -8.781 -4.248 12.647 999 HG22 ILE 140 HG22 ILE 140 -7.497 -3.758 13.751 1000 HG23 ILE 140 HG23 ILE 140 -7.224 -5.074 12.608 1001 HD11 ILE 140 HD11 ILE 140 -8.662 -0.091 10.871 1002 HD12 ILE 140 HD12 ILE 140 -8.587 -1.583 9.933 1003 HD13 ILE 140 HD13 ILE 140 -7.110 -0.691 10.290 1004 H ASP 141 H ASP 141 -6.264 -5.364 11.066 1005 HA ASP 141 HA ASP 141 -3.914 -5.954 9.581 1006 HB2 ASP 141 HB2 ASP 141 -5.072 -8.173 9.181 1007 HB3 ASP 141 HB3 ASP 141 -4.744 -7.742 10.850 1008 HA PRO 142 HA PRO 142 -5.511 -4.826 5.506 1009 HB2 PRO 142 HB2 PRO 142 -3.460 -6.235 4.136 1010 HB3 PRO 142 HB3 PRO 142 -3.535 -4.511 4.495 1011 HG2 PRO 142 HG2 PRO 142 -1.734 -6.342 5.575 1012 HG3 PRO 142 HG3 PRO 142 -2.026 -4.692 6.145 1013 HD2 PRO 142 HD2 PRO 142 -2.929 -7.261 7.274 1014 HD3 PRO 142 HD3 PRO 142 -2.677 -5.694 8.064 1015 H THR 143 H THR 143 -5.558 -7.902 6.787 1016 HA THR 143 HA THR 143 -5.750 -9.716 4.753 1017 HB THR 143 HB THR 143 -7.467 -10.798 6.465 1018 HG1 THR 143 HG1 THR 143 -7.037 -10.055 8.560 1019 HG21 THR 143 HG21 THR 143 -4.511 -10.507 6.944 1020 HG22 THR 143 HG22 THR 143 -5.276 -11.693 5.888 1021 HG23 THR 143 HG23 THR 143 -5.540 -11.764 7.630 1022 H GLY 144 H GLY 144 -8.001 -7.294 5.586 1023 HA2 GLY 144 HA2 GLY 144 -10.382 -8.474 4.532 1024 HA3 GLY 144 HA3 GLY 144 -10.129 -6.763 4.856 1025 H TYR 145 H TYR 145 -7.746 -6.614 3.201 1026 HA TYR 145 HA TYR 145 -9.006 -6.369 0.628 1027 HB2 TYR 145 HB2 TYR 145 -6.256 -5.430 1.416 1028 HB3 TYR 145 HB3 TYR 145 -7.159 -4.960 -0.013 1029 HD1 TYR 145 HD1 TYR 145 -6.936 -4.611 3.639 1030 HD2 TYR 145 HD2 TYR 145 -8.769 -3.197 0.072 1031 HE1 TYR 145 HE1 TYR 145 -7.789 -2.654 4.859 1032 HE2 TYR 145 HE2 TYR 145 -9.633 -1.239 1.284 1033 HH TYR 145 HH TYR 145 -8.522 -0.351 4.349 1034 H ILE 146 H ILE 146 -6.968 -8.484 2.241 1035 HA ILE 146 HA ILE 146 -5.663 -9.443 -0.151 1036 HB ILE 146 HB ILE 146 -5.110 -10.391 2.641 1037 HG12 ILE 146 HG12 ILE 146 -4.731 -7.988 2.691 1038 HG13 ILE 146 HG13 ILE 146 -3.183 -8.814 2.725 1039 HG21 ILE 146 HG21 ILE 146 -2.885 -11.000 1.737 1040 HG22 ILE 146 HG22 ILE 146 -3.436 -10.508 0.136 1041 HG23 ILE 146 HG23 ILE 146 -4.214 -11.861 0.956 1042 HD11 ILE 146 HD11 ILE 146 -3.212 -6.777 1.311 1043 HD12 ILE 146 HD12 ILE 146 -4.387 -7.562 0.256 1044 HD13 ILE 146 HD13 ILE 146 -2.766 -8.234 0.425 1045 H ALA 147 H ALA 147 -8.338 -10.101 1.694 1046 HA ALA 147 HA ALA 147 -8.423 -12.938 1.483 1047 HB1 ALA 147 HB1 ALA 147 -10.643 -12.763 2.394 1048 HB2 ALA 147 HB2 ALA 147 -10.645 -11.026 2.094 1049 HB3 ALA 147 HB3 ALA 147 -9.547 -11.713 3.291 1050 H ASN 148 H ASN 148 -9.543 -10.248 -0.344 1051 HA ASN 148 HA ASN 148 -10.917 -11.934 -2.225 1052 HB2 ASN 148 HB2 ASN 148 -11.337 -9.274 -2.958 1053 HB3 ASN 148 HB3 ASN 148 -12.466 -10.301 -2.128 1054 HD21 ASN 148 HD21 ASN 148 -9.540 -8.696 -1.111 1055 HD22 ASN 148 HD22 ASN 148 -10.239 -7.850 0.217 1056 H ALA 149 H ALA 149 -8.020 -11.301 -1.764 1057 HA ALA 149 HA ALA 149 -7.299 -10.243 -4.300 1058 HB1 ALA 149 HB1 ALA 149 -5.430 -10.830 -2.055 1059 HB2 ALA 149 HB2 ALA 149 -6.475 -9.414 -2.034 1060 HB3 ALA 149 HB3 ALA 149 -5.280 -9.604 -3.315 1061 HA PRO 150 HA PRO 150 -5.877 -13.984 -6.243 1062 HB2 PRO 150 HB2 PRO 150 -3.320 -13.278 -7.024 1063 HB3 PRO 150 HB3 PRO 150 -4.806 -12.889 -7.903 1064 HG2 PRO 150 HG2 PRO 150 -3.263 -11.210 -5.992 1065 HG3 PRO 150 HG3 PRO 150 -4.022 -10.755 -7.530 1066 HD2 PRO 150 HD2 PRO 150 -5.202 -10.137 -5.229 1067 HD3 PRO 150 HD3 PRO 150 -6.165 -10.714 -6.601 1068 H VAL 151 H VAL 151 -3.848 -15.474 -6.438 1069 HA VAL 151 HA VAL 151 -2.873 -16.088 -3.762 1070 HB VAL 151 HB VAL 151 -3.514 -17.965 -5.980 1071 HG11 VAL 151 HG11 VAL 151 -1.532 -18.585 -4.541 1072 HG12 VAL 151 HG12 VAL 151 -2.836 -19.778 -4.638 1073 HG13 VAL 151 HG13 VAL 151 -2.687 -18.752 -3.211 1074 HG21 VAL 151 HG21 VAL 151 -4.853 -17.688 -3.306 1075 HG22 VAL 151 HG22 VAL 151 -5.301 -18.806 -4.594 1076 HG23 VAL 151 HG23 VAL 151 -5.496 -17.069 -4.828 1077 H PHE 152 H PHE 152 -0.831 -16.332 -3.485 1078 HA PHE 152 HA PHE 152 1.070 -16.108 -5.703 1079 HB2 PHE 152 HB2 PHE 152 1.414 -14.404 -4.066 1080 HB3 PHE 152 HB3 PHE 152 1.238 -15.527 -2.733 1081 HD1 PHE 152 HD1 PHE 152 3.509 -14.398 -5.411 1082 HD2 PHE 152 HD2 PHE 152 3.093 -16.700 -1.874 1083 HE1 PHE 152 HE1 PHE 152 5.951 -14.587 -5.271 1084 HE2 PHE 152 HE2 PHE 152 5.544 -16.910 -1.722 1085 HZ PHE 152 HZ PHE 152 6.976 -15.851 -3.423 1086 H ASN 153 H ASN 153 1.262 -18.156 -6.461 1087 HA ASN 153 HA ASN 153 2.051 -20.258 -6.721 1088 HB2 ASN 153 HB2 ASN 153 3.651 -19.299 -4.433 1089 HB3 ASN 153 HB3 ASN 153 3.613 -21.045 -4.669 1090 HD21 ASN 153 HD21 ASN 153 4.390 -17.977 -6.173 1091 HD22 ASN 153 HD22 ASN 153 5.492 -18.612 -7.341 1092 H GLY 154 H GLY 154 0.428 -19.592 -3.718 1093 HA2 GLY 154 HA2 GLY 154 -1.511 -21.108 -3.317 1094 HA3 GLY 154 HA3 GLY 154 -0.381 -22.434 -3.548 1095 H THR 155 H THR 155 -1.040 -19.625 -1.494 1096 HA THR 155 HA THR 155 0.562 -20.672 0.657 1097 HB THR 155 HB THR 155 -0.228 -18.483 1.724 1098 HG1 THR 155 HG1 THR 155 -1.150 -18.156 -0.927 1099 HG21 THR 155 HG21 THR 155 1.471 -18.465 -0.756 1100 HG22 THR 155 HG22 THR 155 2.023 -18.733 0.898 1101 HG23 THR 155 HG23 THR 155 1.411 -17.149 0.418 1102 H THR 156 H THR 156 -0.421 -22.229 1.699 1103 HA THR 156 HA THR 156 -3.137 -21.784 2.754 1104 HB THR 156 HB THR 156 -3.220 -24.337 2.955 1105 HG1 THR 156 HG1 THR 156 -1.269 -24.223 0.894 1106 HG21 THR 156 HG21 THR 156 -4.618 -23.214 1.369 1107 HG22 THR 156 HG22 THR 156 -3.883 -24.594 0.552 1108 HG23 THR 156 HG23 THR 156 -3.263 -22.968 0.267 1109 HA PRO 157 HA PRO 157 -0.858 -22.137 6.629 1110 HB2 PRO 157 HB2 PRO 157 -3.113 -21.427 8.189 1111 HB3 PRO 157 HB3 PRO 157 -1.783 -20.373 7.699 1112 HG2 PRO 157 HG2 PRO 157 -4.419 -20.168 6.827 1113 HG3 PRO 157 HG3 PRO 157 -3.009 -19.394 6.081 1114 HD2 PRO 157 HD2 PRO 157 -4.476 -21.838 5.252 1115 HD3 PRO 157 HD3 PRO 157 -3.628 -20.631 4.270 1116 H THR 158 H THR 158 -4.085 -23.364 6.300 1117 HA THR 158 HA THR 158 -3.455 -25.941 7.273 1118 HB THR 158 HB THR 158 -3.707 -24.932 9.446 1119 HG1 THR 158 HG1 THR 158 -4.539 -26.985 9.390 1120 HG21 THR 158 HG21 THR 158 -5.625 -23.801 10.288 1121 HG22 THR 158 HG22 THR 158 -6.515 -24.093 8.795 1122 HG23 THR 158 HG23 THR 158 -5.135 -22.993 8.798 1123 H GLU 159 H GLU 159 -6.248 -23.850 7.133 1124 HA GLU 159 HA GLU 159 -7.859 -25.762 5.742 1125 HB2 GLU 159 HB2 GLU 159 -8.518 -23.901 7.514 1126 HB3 GLU 159 HB3 GLU 159 -8.737 -22.935 6.063 1127 HG2 GLU 159 HG2 GLU 159 -10.295 -24.648 5.202 1128 HG3 GLU 159 HG3 GLU 159 -10.123 -25.526 6.722 Start of MODEL 8 1 H1 MET 1 H1 MET 1 -22.230 -28.513 7.599 2 H2 MET 1 H2 MET 1 -21.406 -27.646 8.792 3 H3 MET 1 H3 MET 1 -21.223 -29.324 8.691 4 HA MET 1 HA MET 1 -20.364 -27.371 6.639 5 HB2 MET 1 HB2 MET 1 -18.886 -28.841 8.805 6 HB3 MET 1 HB3 MET 1 -18.060 -28.319 7.344 7 HG2 MET 1 HG2 MET 1 -18.768 -26.001 7.818 8 HG3 MET 1 HG3 MET 1 -19.484 -26.561 9.329 9 HE1 MET 1 HE1 MET 1 -17.943 -24.615 10.523 10 HE2 MET 1 HE2 MET 1 -17.268 -24.231 8.940 11 HE3 MET 1 HE3 MET 1 -16.194 -24.538 10.305 12 H ARG 2 H ARG 2 -19.642 -28.189 4.751 13 HA ARG 2 HA ARG 2 -19.521 -31.109 4.421 14 HB2 ARG 2 HB2 ARG 2 -21.080 -29.152 2.738 15 HB3 ARG 2 HB3 ARG 2 -20.591 -30.724 2.123 16 HG2 ARG 2 HG2 ARG 2 -21.852 -31.824 3.893 17 HG3 ARG 2 HG3 ARG 2 -22.322 -30.253 4.543 18 HD2 ARG 2 HD2 ARG 2 -23.446 -29.739 2.412 19 HD3 ARG 2 HD3 ARG 2 -23.017 -31.342 1.817 20 HE ARG 2 HE ARG 2 -24.350 -31.900 4.088 21 HH11 ARG 2 HH11 ARG 2 -25.154 -29.853 1.329 22 HH12 ARG 2 HH12 ARG 2 -26.926 -30.120 1.517 23 HH21 ARG 2 HH21 ARG 2 -26.578 -32.246 4.340 24 HH22 ARG 2 HH22 ARG 2 -27.716 -31.452 3.192 25 H GLY 3 H GLY 3 -18.728 -27.926 3.064 26 HA2 GLY 3 HA2 GLY 3 -16.444 -27.413 2.467 27 HA3 GLY 3 HA3 GLY 3 -16.243 -29.088 1.982 28 H SER 4 H SER 4 -18.729 -26.662 1.202 29 HA SER 4 HA SER 4 -18.279 -27.217 -1.649 30 HB2 SER 4 HB2 SER 4 -20.676 -26.010 -0.247 31 HB3 SER 4 HB3 SER 4 -20.545 -26.255 -1.988 32 HG SER 4 HG SER 4 -21.660 -27.949 -0.786 33 H HIS 5 H HIS 5 -17.821 -25.612 -3.088 34 HA HIS 5 HA HIS 5 -17.464 -22.894 -2.005 35 HB2 HIS 5 HB2 HIS 5 -15.399 -24.527 -2.685 36 HB3 HIS 5 HB3 HIS 5 -15.680 -23.701 -4.214 37 HD1 HIS 5 HD1 HIS 5 -15.480 -21.038 -4.137 38 HD2 HIS 5 HD2 HIS 5 -14.064 -23.064 -0.797 39 HE1 HIS 5 HE1 HIS 5 -14.048 -19.380 -2.901 40 HE2 HIS 5 HE2 HIS 5 -13.200 -20.628 -0.882 41 H HIS 6 H HIS 6 -17.708 -21.160 -3.492 42 HA HIS 6 HA HIS 6 -19.564 -21.775 -5.668 43 HB2 HIS 6 HB2 HIS 6 -19.070 -19.429 -3.926 44 HB3 HIS 6 HB3 HIS 6 -19.581 -19.083 -5.575 45 HD1 HIS 6 HD1 HIS 6 -20.827 -20.247 -2.307 46 HD2 HIS 6 HD2 HIS 6 -22.178 -20.097 -6.235 47 HE1 HIS 6 HE1 HIS 6 -23.310 -20.638 -2.181 48 HE2 HIS 6 HE2 HIS 6 -24.107 -20.542 -4.570 49 H HIS 7 H HIS 7 -16.507 -20.077 -5.084 50 HA HIS 7 HA HIS 7 -16.130 -19.851 -7.997 51 HB2 HIS 7 HB2 HIS 7 -16.108 -17.794 -6.288 52 HB3 HIS 7 HB3 HIS 7 -14.424 -18.285 -6.129 53 HD1 HIS 7 HD1 HIS 7 -13.011 -18.271 -8.412 54 HD2 HIS 7 HD2 HIS 7 -16.682 -16.328 -8.523 55 HE1 HIS 7 HE1 HIS 7 -12.941 -16.817 -10.463 56 HE2 HIS 7 HE2 HIS 7 -15.174 -15.650 -10.511 57 H HIS 8 H HIS 8 -14.398 -20.750 -8.945 58 HA HIS 8 HA HIS 8 -12.378 -22.045 -7.232 59 HB2 HIS 8 HB2 HIS 8 -13.777 -23.116 -9.680 60 HB3 HIS 8 HB3 HIS 8 -12.244 -23.775 -9.123 61 HD1 HIS 8 HD1 HIS 8 -15.871 -23.567 -8.210 62 HD2 HIS 8 HD2 HIS 8 -12.387 -25.371 -6.840 63 HE1 HIS 8 HE1 HIS 8 -16.614 -25.242 -6.487 64 HE2 HIS 8 HE2 HIS 8 -14.488 -26.323 -5.672 65 H HIS 9 H HIS 9 -10.313 -21.620 -7.704 66 HA HIS 9 HA HIS 9 -9.760 -19.950 -10.048 67 HB2 HIS 9 HB2 HIS 9 -9.079 -19.514 -7.474 68 HB3 HIS 9 HB3 HIS 9 -7.652 -20.395 -8.009 69 HD1 HIS 9 HD1 HIS 9 -9.388 -17.134 -8.320 70 HD2 HIS 9 HD2 HIS 9 -6.109 -19.067 -9.991 71 HE1 HIS 9 HE1 HIS 9 -8.091 -15.344 -9.519 72 HE2 HIS 9 HE2 HIS 9 -6.111 -16.535 -10.524 73 H HIS 10 H HIS 10 -9.050 -20.957 -11.782 74 HA HIS 10 HA HIS 10 -6.886 -22.909 -11.584 75 HB2 HIS 10 HB2 HIS 10 -9.325 -23.987 -11.701 76 HB3 HIS 10 HB3 HIS 10 -9.132 -23.648 -13.417 77 HD1 HIS 10 HD1 HIS 10 -7.409 -25.051 -14.715 78 HD2 HIS 10 HD2 HIS 10 -7.649 -25.997 -10.676 79 HE1 HIS 10 HE1 HIS 10 -6.127 -27.199 -14.450 80 HE2 HIS 10 HE2 HIS 10 -6.286 -27.753 -11.998 81 H GLY 11 H GLY 11 -5.458 -22.728 -13.217 82 HA2 GLY 11 HA2 GLY 11 -5.187 -22.365 -15.676 83 HA3 GLY 11 HA3 GLY 11 -6.179 -20.933 -15.452 84 H SER 12 H SER 12 -4.928 -19.229 -15.778 85 HA SER 12 HA SER 12 -2.142 -19.223 -14.883 86 HB2 SER 12 HB2 SER 12 -3.714 -17.730 -16.888 87 HB3 SER 12 HB3 SER 12 -2.474 -16.803 -16.029 88 HG SER 12 HG SER 12 -2.213 -18.891 -17.853 89 H ALA 13 H ALA 13 -1.255 -17.290 -13.913 90 HA ALA 13 HA ALA 13 -2.938 -15.403 -12.673 91 HB1 ALA 13 HB1 ALA 13 -1.435 -17.359 -10.934 92 HB2 ALA 13 HB2 ALA 13 -3.181 -17.124 -10.993 93 HB3 ALA 13 HB3 ALA 13 -2.143 -15.857 -10.338 94 H THR 14 H THR 14 -1.883 -13.601 -13.196 95 HA THR 14 HA THR 14 0.984 -13.611 -13.420 96 HB THR 14 HB THR 14 -0.283 -12.787 -15.318 97 HG1 THR 14 HG1 THR 14 1.318 -11.462 -15.656 98 HG21 THR 14 HG21 THR 14 -2.242 -11.846 -14.238 99 HG22 THR 14 HG22 THR 14 -1.462 -10.616 -15.233 100 HG23 THR 14 HG23 THR 14 -1.256 -10.595 -13.480 101 H TYR 15 H TYR 15 -1.395 -12.469 -11.231 102 HA TYR 15 HA TYR 15 0.388 -10.535 -10.074 103 HB2 TYR 15 HB2 TYR 15 -2.459 -10.811 -10.278 104 HB3 TYR 15 HB3 TYR 15 -1.924 -10.353 -8.668 105 HD1 TYR 15 HD1 TYR 15 -0.365 -8.315 -8.489 106 HD2 TYR 15 HD2 TYR 15 -2.626 -9.215 -11.977 107 HE1 TYR 15 HE1 TYR 15 -0.099 -5.991 -9.254 108 HE2 TYR 15 HE2 TYR 15 -2.363 -6.898 -12.752 109 HH TYR 15 HH TYR 15 -1.905 -4.682 -11.815 110 H THR 16 H THR 16 1.565 -10.914 -8.475 111 HA THR 16 HA THR 16 1.071 -13.276 -6.872 112 HB THR 16 HB THR 16 3.487 -12.864 -6.121 113 HG1 THR 16 HG1 THR 16 3.679 -11.325 -8.477 114 HG21 THR 16 HG21 THR 16 2.894 -14.616 -7.711 115 HG22 THR 16 HG22 THR 16 4.400 -13.835 -8.196 116 HG23 THR 16 HG23 THR 16 2.892 -13.435 -9.022 117 H ARG 17 H ARG 17 0.741 -13.234 -4.697 118 HA ARG 17 HA ARG 17 0.521 -10.712 -3.347 119 HB2 ARG 17 HB2 ARG 17 -0.980 -13.069 -3.273 120 HB3 ARG 17 HB3 ARG 17 -0.140 -13.022 -1.727 121 HG2 ARG 17 HG2 ARG 17 -2.010 -11.870 -1.163 122 HG3 ARG 17 HG3 ARG 17 -1.024 -10.527 -1.734 123 HD2 ARG 17 HD2 ARG 17 -3.046 -12.023 -3.398 124 HD3 ARG 17 HD3 ARG 17 -3.342 -10.487 -2.593 125 HE ARG 17 HE ARG 17 -1.501 -10.909 -4.849 126 HH11 ARG 17 HH11 ARG 17 -3.439 -8.744 -2.843 127 HH12 ARG 17 HH12 ARG 17 -3.167 -7.332 -3.928 128 HH21 ARG 17 HH21 ARG 17 -1.896 -7.553 -5.808 129 HH22 ARG 17 HH22 ARG 17 -1.153 -9.139 -6.226 130 HA PRO 18 HA PRO 18 4.627 -11.570 -1.529 131 HB2 PRO 18 HB2 PRO 18 4.094 -9.112 -0.007 132 HB3 PRO 18 HB3 PRO 18 5.437 -9.484 -1.094 133 HG2 PRO 18 HG2 PRO 18 3.533 -7.740 -1.789 134 HG3 PRO 18 HG3 PRO 18 4.298 -8.814 -2.977 135 HD2 PRO 18 HD2 PRO 18 1.613 -9.040 -1.686 136 HD3 PRO 18 HD3 PRO 18 2.101 -9.391 -3.358 137 H LEU 19 H LEU 19 1.673 -10.820 0.211 138 HA LEU 19 HA LEU 19 2.596 -12.380 2.486 139 HB2 LEU 19 HB2 LEU 19 1.947 -9.635 2.528 140 HB3 LEU 19 HB3 LEU 19 0.697 -10.479 3.372 141 HG LEU 19 HG LEU 19 2.461 -9.518 4.817 142 HD11 LEU 19 HD11 LEU 19 1.173 -11.215 5.811 143 HD12 LEU 19 HD12 LEU 19 2.848 -11.681 6.125 144 HD13 LEU 19 HD13 LEU 19 1.937 -12.485 4.846 145 HD21 LEU 19 HD21 LEU 19 4.239 -11.724 3.801 146 HD22 LEU 19 HD22 LEU 19 4.643 -10.434 4.932 147 HD23 LEU 19 HD23 LEU 19 4.351 -10.060 3.233 148 H ASP 20 H ASP 20 0.575 -12.380 3.937 149 HA ASP 20 HA ASP 20 -1.761 -13.278 2.506 150 HB2 ASP 20 HB2 ASP 20 -0.047 -14.836 4.127 151 HB3 ASP 20 HB3 ASP 20 -1.605 -14.678 4.925 152 H THR 21 H THR 21 -0.267 -11.657 5.066 153 HA THR 21 HA THR 21 -2.513 -10.190 5.799 154 HB THR 21 HB THR 21 -3.085 -12.358 6.870 155 HG1 THR 21 HG1 THR 21 -3.511 -10.045 7.746 156 HG21 THR 21 HG21 THR 21 -1.961 -13.027 8.953 157 HG22 THR 21 HG22 THR 21 -0.755 -11.765 8.702 158 HG23 THR 21 HG23 THR 21 -0.870 -13.111 7.570 159 H GLY 22 H GLY 22 -1.934 -9.388 8.255 160 HA2 GLY 22 HA2 GLY 22 0.627 -8.892 9.126 161 HA3 GLY 22 HA3 GLY 22 0.215 -7.581 8.030 162 H ASN 23 H ASN 23 0.094 -8.611 11.216 163 HA ASN 23 HA ASN 23 -1.543 -6.403 12.030 164 HB2 ASN 23 HB2 ASN 23 -2.927 -7.942 13.554 165 HB3 ASN 23 HB3 ASN 23 -3.362 -7.881 11.852 166 HD21 ASN 23 HD21 ASN 23 -2.536 -9.590 10.475 167 HD22 ASN 23 HD22 ASN 23 -2.296 -11.168 11.129 168 H ILE 24 H ILE 24 -0.791 -5.418 13.592 169 HA ILE 24 HA ILE 24 1.103 -6.745 15.364 170 HB ILE 24 HB ILE 24 0.817 -3.863 15.578 171 HG12 ILE 24 HG12 ILE 24 2.494 -3.586 13.593 172 HG13 ILE 24 HG13 ILE 24 1.836 -5.123 13.060 173 HG21 ILE 24 HG21 ILE 24 3.083 -5.796 15.639 174 HG22 ILE 24 HG22 ILE 24 2.498 -4.731 16.913 175 HG23 ILE 24 HG23 ILE 24 3.378 -4.063 15.539 176 HD11 ILE 24 HD11 ILE 24 -0.453 -3.872 13.438 177 HD12 ILE 24 HD12 ILE 24 0.455 -3.740 11.927 178 HD13 ILE 24 HD13 ILE 24 0.563 -2.456 13.134 179 H THR 25 H THR 25 -1.132 -7.527 15.924 180 HA THR 25 HA THR 25 -2.420 -5.927 18.007 181 HB THR 25 HB THR 25 -3.961 -6.866 16.436 182 HG1 THR 25 HG1 THR 25 -4.839 -6.923 18.460 183 HG21 THR 25 HG21 THR 25 -4.203 -9.195 15.911 184 HG22 THR 25 HG22 THR 25 -2.978 -9.639 17.100 185 HG23 THR 25 HG23 THR 25 -2.516 -8.743 15.651 186 H THR 26 H THR 26 -0.481 -8.735 17.533 187 HA THR 26 HA THR 26 -0.481 -9.275 20.433 188 HB THR 26 HB THR 26 0.322 -11.337 18.398 189 HG1 THR 26 HG1 THR 26 -1.984 -12.086 18.943 190 HG21 THR 26 HG21 THR 26 0.926 -11.774 20.728 191 HG22 THR 26 HG22 THR 26 -0.308 -12.908 20.179 192 HG23 THR 26 HG23 THR 26 -0.755 -11.552 21.216 193 H GLY 27 H GLY 27 1.582 -9.947 17.684 194 HA2 GLY 27 HA2 GLY 27 3.780 -8.364 18.604 195 HA3 GLY 27 HA3 GLY 27 4.041 -10.074 18.926 196 H PHE 28 H PHE 28 4.881 -7.763 16.842 197 HA PHE 28 HA PHE 28 4.379 -9.022 14.353 198 HB2 PHE 28 HB2 PHE 28 5.098 -6.469 15.073 199 HB3 PHE 28 HB3 PHE 28 6.539 -7.086 14.270 200 HD1 PHE 28 HD1 PHE 28 2.821 -7.107 13.775 201 HD2 PHE 28 HD2 PHE 28 6.666 -6.811 11.994 202 HE1 PHE 28 HE1 PHE 28 1.776 -6.773 11.573 203 HE2 PHE 28 HE2 PHE 28 5.635 -6.462 9.799 204 HZ PHE 28 HZ PHE 28 3.185 -6.454 9.587 205 H ASN 29 H ASN 29 5.890 -9.624 12.798 206 HA ASN 29 HA ASN 29 7.319 -11.821 13.517 207 HB2 ASN 29 HB2 ASN 29 7.148 -10.172 11.056 208 HB3 ASN 29 HB3 ASN 29 8.150 -11.604 11.097 209 HD21 ASN 29 HD21 ASN 29 5.048 -10.333 10.840 210 HD22 ASN 29 HD22 ASN 29 4.185 -11.814 10.678 211 H GLY 30 H GLY 30 8.407 -9.560 14.924 212 HA2 GLY 30 HA2 GLY 30 10.653 -9.568 15.822 213 HA3 GLY 30 HA3 GLY 30 11.245 -9.983 14.217 214 H TYR 31 H TYR 31 8.868 -7.844 13.731 215 HA TYR 31 HA TYR 31 10.743 -5.550 13.621 216 HB2 TYR 31 HB2 TYR 31 8.025 -5.629 12.307 217 HB3 TYR 31 HB3 TYR 31 9.374 -4.580 11.938 218 HD1 TYR 31 HD1 TYR 31 8.380 -8.195 11.793 219 HD2 TYR 31 HD2 TYR 31 10.769 -5.077 10.152 220 HE1 TYR 31 HE1 TYR 31 9.066 -9.687 9.966 221 HE2 TYR 31 HE2 TYR 31 11.462 -6.568 8.326 222 HH TYR 31 HH TYR 31 11.637 -8.983 7.882 223 HA PRO 32 HA PRO 32 8.012 -4.525 17.235 224 HB2 PRO 32 HB2 PRO 32 10.314 -3.253 18.455 225 HB3 PRO 32 HB3 PRO 32 9.431 -4.685 18.997 226 HG2 PRO 32 HG2 PRO 32 11.985 -4.781 18.068 227 HG3 PRO 32 HG3 PRO 32 10.843 -6.134 17.943 228 HD2 PRO 32 HD2 PRO 32 11.641 -4.140 15.858 229 HD3 PRO 32 HD3 PRO 32 11.389 -5.893 15.710 230 H GLY 33 H GLY 33 6.935 -2.665 17.629 231 HA2 GLY 33 HA2 GLY 33 6.582 -0.345 17.805 232 HA3 GLY 33 HA3 GLY 33 8.131 -0.069 17.026 233 H HIS 34 H HIS 34 6.477 -2.319 15.258 234 HA HIS 34 HA HIS 34 5.967 -0.548 13.111 235 HB2 HIS 34 HB2 HIS 34 6.889 -3.004 13.119 236 HB3 HIS 34 HB3 HIS 34 5.186 -3.443 13.135 237 HD1 HIS 34 HD1 HIS 34 4.543 -4.089 10.823 238 HD2 HIS 34 HD2 HIS 34 7.133 -0.857 10.843 239 HE1 HIS 34 HE1 HIS 34 4.807 -3.350 8.419 240 H VAL 35 H VAL 35 4.068 0.301 12.533 241 HA VAL 35 HA VAL 35 1.659 -0.483 14.022 242 HB VAL 35 HB VAL 35 0.993 1.837 12.683 243 HG11 VAL 35 HG11 VAL 35 0.178 1.897 14.784 244 HG12 VAL 35 HG12 VAL 35 1.640 2.830 15.105 245 HG13 VAL 35 HG13 VAL 35 1.603 1.107 15.469 246 HG21 VAL 35 HG21 VAL 35 3.308 2.263 12.045 247 HG22 VAL 35 HG22 VAL 35 3.795 2.194 13.739 248 HG23 VAL 35 HG23 VAL 35 2.729 3.483 13.180 249 H GLY 36 H GLY 36 3.090 -0.945 11.060 250 HA2 GLY 36 HA2 GLY 36 0.477 -1.460 9.797 251 HA3 GLY 36 HA3 GLY 36 1.792 -0.707 8.904 252 H VAL 37 H VAL 37 1.851 -2.331 7.405 253 HA VAL 37 HA VAL 37 3.159 -4.793 8.296 254 HB VAL 37 HB VAL 37 0.810 -5.347 7.851 255 HG11 VAL 37 HG11 VAL 37 0.251 -5.346 5.260 256 HG12 VAL 37 HG12 VAL 37 1.328 -3.952 5.298 257 HG13 VAL 37 HG13 VAL 37 -0.120 -3.972 6.303 258 HG21 VAL 37 HG21 VAL 37 1.189 -7.135 6.094 259 HG22 VAL 37 HG22 VAL 37 2.284 -7.150 7.478 260 HG23 VAL 37 HG23 VAL 37 2.824 -6.495 5.934 261 H ASP 38 H ASP 38 4.616 -5.746 6.755 262 HA ASP 38 HA ASP 38 5.389 -3.966 4.542 263 HB2 ASP 38 HB2 ASP 38 7.211 -5.228 6.599 264 HB3 ASP 38 HB3 ASP 38 7.795 -4.515 5.096 265 H TYR 39 H TYR 39 5.992 -4.811 2.697 266 HA TYR 39 HA TYR 39 5.951 -7.750 2.421 267 HB2 TYR 39 HB2 TYR 39 4.892 -5.875 0.314 268 HB3 TYR 39 HB3 TYR 39 4.693 -7.603 0.415 269 HD1 TYR 39 HD1 TYR 39 3.758 -4.459 2.136 270 HD2 TYR 39 HD2 TYR 39 2.673 -8.484 1.305 271 HE1 TYR 39 HE1 TYR 39 1.556 -4.070 3.120 272 HE2 TYR 39 HE2 TYR 39 0.461 -8.094 2.295 273 HH TYR 39 HH TYR 39 -0.574 -6.549 3.931 274 H ALA 40 H ALA 40 8.004 -8.232 2.005 275 HA ALA 40 HA ALA 40 9.937 -6.669 0.790 276 HB1 ALA 40 HB1 ALA 40 10.459 -8.598 2.180 277 HB2 ALA 40 HB2 ALA 40 11.275 -8.694 0.619 278 HB3 ALA 40 HB3 ALA 40 9.841 -9.673 0.925 279 H VAL 41 H VAL 41 9.738 -5.795 -1.155 280 HA VAL 41 HA VAL 41 9.605 -7.482 -3.470 281 HB VAL 41 HB VAL 41 7.217 -6.989 -3.073 282 HG11 VAL 41 HG11 VAL 41 7.024 -4.958 -1.996 283 HG12 VAL 41 HG12 VAL 41 6.487 -4.566 -3.630 284 HG13 VAL 41 HG13 VAL 41 8.119 -4.142 -3.111 285 HG21 VAL 41 HG21 VAL 41 6.668 -6.087 -5.315 286 HG22 VAL 41 HG22 VAL 41 7.883 -7.362 -5.344 287 HG23 VAL 41 HG23 VAL 41 8.370 -5.678 -5.528 288 HA PRO 42 HA PRO 42 12.931 -4.669 -4.531 289 HB2 PRO 42 HB2 PRO 42 12.767 -5.015 -7.296 290 HB3 PRO 42 HB3 PRO 42 13.718 -6.009 -6.185 291 HG2 PRO 42 HG2 PRO 42 11.052 -6.551 -7.381 292 HG3 PRO 42 HG3 PRO 42 12.368 -7.677 -6.993 293 HD2 PRO 42 HD2 PRO 42 10.175 -7.507 -5.467 294 HD3 PRO 42 HD3 PRO 42 11.771 -7.818 -4.761 295 H VAL 43 H VAL 43 13.303 -2.805 -5.074 296 HA VAL 43 HA VAL 43 11.378 -0.833 -5.271 297 HB VAL 43 HB VAL 43 13.427 -0.426 -4.186 298 HG11 VAL 43 HG11 VAL 43 14.805 -1.146 -6.745 299 HG12 VAL 43 HG12 VAL 43 14.940 -1.913 -5.162 300 HG13 VAL 43 HG13 VAL 43 15.615 -0.305 -5.421 301 HG21 VAL 43 HG21 VAL 43 12.415 1.422 -5.850 302 HG22 VAL 43 HG22 VAL 43 14.031 1.279 -6.534 303 HG23 VAL 43 HG23 VAL 43 13.835 1.728 -4.843 304 H GLY 44 H GLY 44 10.661 0.496 -6.878 305 HA2 GLY 44 HA2 GLY 44 10.766 1.502 -9.019 306 HA3 GLY 44 HA3 GLY 44 11.764 0.165 -9.538 307 H THR 45 H THR 45 9.280 -1.178 -7.854 308 HA THR 45 HA THR 45 7.899 -1.916 -10.249 309 HB THR 45 HB THR 45 7.170 -2.897 -7.511 310 HG1 THR 45 HG1 THR 45 9.014 -4.366 -9.000 311 HG21 THR 45 HG21 THR 45 5.691 -3.614 -9.283 312 HG22 THR 45 HG22 THR 45 6.674 -4.990 -8.786 313 HG23 THR 45 HG23 THR 45 7.059 -4.124 -10.273 314 HA PRO 46 HA PRO 46 4.763 1.248 -9.665 315 HB2 PRO 46 HB2 PRO 46 2.958 -0.580 -11.149 316 HB3 PRO 46 HB3 PRO 46 3.395 1.096 -11.503 317 HG2 PRO 46 HG2 PRO 46 4.363 -0.906 -12.968 318 HG3 PRO 46 HG3 PRO 46 5.348 0.518 -12.578 319 HD2 PRO 46 HD2 PRO 46 5.443 -2.222 -11.399 320 HD3 PRO 46 HD3 PRO 46 6.766 -1.098 -11.769 321 H VAL 47 H VAL 47 3.570 1.553 -7.931 322 HA VAL 47 HA VAL 47 2.263 -0.635 -6.611 323 HB VAL 47 HB VAL 47 2.652 2.108 -5.430 324 HG11 VAL 47 HG11 VAL 47 2.264 -0.587 -4.122 325 HG12 VAL 47 HG12 VAL 47 1.024 0.652 -4.317 326 HG13 VAL 47 HG13 VAL 47 2.423 0.959 -3.287 327 HG21 VAL 47 HG21 VAL 47 4.537 0.602 -4.167 328 HG22 VAL 47 HG22 VAL 47 4.872 1.731 -5.479 329 HG23 VAL 47 HG23 VAL 47 4.667 0.013 -5.825 330 H ARG 48 H ARG 48 0.293 -0.863 -6.713 331 HA ARG 48 HA ARG 48 -1.348 1.219 -7.772 332 HB2 ARG 48 HB2 ARG 48 -1.786 -1.744 -7.632 333 HB3 ARG 48 HB3 ARG 48 -3.041 -0.626 -8.142 334 HG2 ARG 48 HG2 ARG 48 -2.114 -0.269 -10.161 335 HG3 ARG 48 HG3 ARG 48 -0.457 -0.412 -9.556 336 HD2 ARG 48 HD2 ARG 48 -0.690 -2.301 -10.880 337 HD3 ARG 48 HD3 ARG 48 -1.047 -2.919 -9.272 338 HE ARG 48 HE ARG 48 -3.076 -2.278 -11.314 339 HH11 ARG 48 HH11 ARG 48 -3.531 -5.150 -8.493 340 HH12 ARG 48 HH12 ARG 48 -2.042 -4.136 -8.492 341 HH21 ARG 48 HH21 ARG 48 -5.144 -4.822 -10.069 342 HH22 ARG 48 HH22 ARG 48 -4.948 -3.548 -11.328 343 H ALA 49 H ALA 49 -3.424 1.639 -7.008 344 HA ALA 49 HA ALA 49 -3.479 1.860 -4.192 345 HB1 ALA 49 HB1 ALA 49 -4.365 3.639 -5.603 346 HB2 ALA 49 HB2 ALA 49 -5.617 3.026 -4.522 347 HB3 ALA 49 HB3 ALA 49 -5.605 2.548 -6.219 348 H VAL 50 H VAL 50 -4.201 0.399 -2.814 349 HA VAL 50 HA VAL 50 -5.439 -1.983 -3.598 350 HB VAL 50 HB VAL 50 -5.252 -0.932 -0.829 351 HG11 VAL 50 HG11 VAL 50 -5.334 -3.252 -0.101 352 HG12 VAL 50 HG12 VAL 50 -5.495 -3.773 -1.779 353 HG13 VAL 50 HG13 VAL 50 -6.775 -2.827 -1.022 354 HG21 VAL 50 HG21 VAL 50 -3.054 -0.954 -1.808 355 HG22 VAL 50 HG22 VAL 50 -3.295 -2.603 -2.378 356 HG23 VAL 50 HG23 VAL 50 -3.185 -2.274 -0.648 357 H ALA 51 H ALA 51 -6.843 1.026 -2.992 358 HA ALA 51 HA ALA 51 -9.438 0.187 -3.604 359 HB1 ALA 51 HB1 ALA 51 -8.850 0.801 -0.734 360 HB2 ALA 51 HB2 ALA 51 -9.720 -0.580 -1.400 361 HB3 ALA 51 HB3 ALA 51 -10.461 1.021 -1.416 362 H ASN 52 H ASN 52 -10.716 1.849 -4.194 363 HA ASN 52 HA ASN 52 -9.595 4.266 -4.891 364 HB2 ASN 52 HB2 ASN 52 -12.060 4.900 -5.267 365 HB3 ASN 52 HB3 ASN 52 -11.388 3.604 -6.190 366 HD21 ASN 52 HD21 ASN 52 -12.493 3.528 -2.900 367 HD22 ASN 52 HD22 ASN 52 -13.772 2.399 -3.145 368 H GLY 53 H GLY 53 -10.183 6.424 -4.247 369 HA2 GLY 53 HA2 GLY 53 -11.672 7.192 -2.061 370 HA3 GLY 53 HA3 GLY 53 -10.104 6.759 -1.408 371 H THR 54 H THR 54 -8.978 8.510 -0.981 372 HA THR 54 HA THR 54 -8.616 10.582 -2.898 373 HB THR 54 HB THR 54 -9.539 11.188 -0.150 374 HG1 THR 54 HG1 THR 54 -11.468 11.975 -1.374 375 HG21 THR 54 HG21 THR 54 -8.153 12.968 -1.099 376 HG22 THR 54 HG22 THR 54 -9.829 13.503 -0.972 377 HG23 THR 54 HG23 THR 54 -9.178 13.005 -2.534 378 H VAL 55 H VAL 55 -6.617 11.465 -2.758 379 HA VAL 55 HA VAL 55 -4.697 10.293 -1.003 380 HB VAL 55 HB VAL 55 -4.195 12.476 -3.032 381 HG11 VAL 55 HG11 VAL 55 -2.376 10.310 -1.994 382 HG12 VAL 55 HG12 VAL 55 -2.339 12.011 -1.527 383 HG13 VAL 55 HG13 VAL 55 -1.949 11.543 -3.184 384 HG21 VAL 55 HG21 VAL 55 -3.717 10.809 -4.731 385 HG22 VAL 55 HG22 VAL 55 -5.382 10.662 -4.178 386 HG23 VAL 55 HG23 VAL 55 -4.164 9.519 -3.617 387 H LYS 56 H LYS 56 -4.463 11.141 0.884 388 HA LYS 56 HA LYS 56 -4.960 13.930 1.440 389 HB2 LYS 56 HB2 LYS 56 -4.364 11.879 3.539 390 HB3 LYS 56 HB3 LYS 56 -5.198 13.412 3.725 391 HG2 LYS 56 HG2 LYS 56 -7.169 12.432 3.392 392 HG3 LYS 56 HG3 LYS 56 -6.613 11.793 1.844 393 HD2 LYS 56 HD2 LYS 56 -7.104 9.850 2.960 394 HD3 LYS 56 HD3 LYS 56 -5.396 10.030 3.336 395 HE2 LYS 56 HE2 LYS 56 -6.355 9.517 5.403 396 HE3 LYS 56 HE3 LYS 56 -6.202 11.270 5.448 397 HZ1 LYS 56 HZ1 LYS 56 -8.574 11.326 4.654 398 HZ2 LYS 56 HZ2 LYS 56 -8.342 10.772 6.235 399 HZ3 LYS 56 HZ3 LYS 56 -8.650 9.670 4.992 400 H PHE 57 H PHE 57 -2.445 11.759 0.999 401 HA PHE 57 HA PHE 57 -0.474 13.759 1.538 402 HB2 PHE 57 HB2 PHE 57 -0.771 12.191 3.627 403 HB3 PHE 57 HB3 PHE 57 0.097 11.027 2.631 404 HD1 PHE 57 HD1 PHE 57 2.405 11.469 1.922 405 HD2 PHE 57 HD2 PHE 57 0.353 14.059 4.605 406 HE1 PHE 57 HE1 PHE 57 4.544 12.498 2.555 407 HE2 PHE 57 HE2 PHE 57 2.493 15.090 5.248 408 HZ PHE 57 HZ PHE 57 4.593 14.311 4.221 409 H ALA 58 H ALA 58 1.238 13.588 0.275 410 HA ALA 58 HA ALA 58 1.763 11.327 -1.372 411 HB1 ALA 58 HB1 ALA 58 0.936 13.971 -2.572 412 HB2 ALA 58 HB2 ALA 58 0.150 12.408 -2.790 413 HB3 ALA 58 HB3 ALA 58 1.748 12.694 -3.476 414 H GLY 59 H GLY 59 3.660 11.209 -0.334 415 HA2 GLY 59 HA2 GLY 59 5.506 13.462 -0.351 416 HA3 GLY 59 HA3 GLY 59 5.733 11.939 0.497 417 H ASN 60 H ASN 60 6.045 13.643 -2.488 418 HA ASN 60 HA ASN 60 7.011 11.520 -4.098 419 HB2 ASN 60 HB2 ASN 60 7.065 14.515 -4.435 420 HB3 ASN 60 HB3 ASN 60 7.700 13.405 -5.643 421 HD21 ASN 60 HD21 ASN 60 4.860 13.164 -3.584 422 HD22 ASN 60 HD22 ASN 60 3.737 13.042 -4.868 423 H GLY 61 H GLY 61 8.815 10.667 -4.182 424 HA2 GLY 61 HA2 GLY 61 11.092 11.534 -2.630 425 HA3 GLY 61 HA3 GLY 61 10.970 10.051 -3.558 426 H ALA 62 H ALA 62 10.047 12.421 -5.607 427 HA ALA 62 HA ALA 62 12.458 12.324 -7.083 428 HB1 ALA 62 HB1 ALA 62 9.990 13.936 -7.615 429 HB2 ALA 62 HB2 ALA 62 10.248 12.274 -8.146 430 HB3 ALA 62 HB3 ALA 62 11.268 13.570 -8.772 431 H ASN 63 H ASN 63 10.950 14.658 -5.018 432 HA ASN 63 HA ASN 63 13.230 16.394 -5.299 433 HB2 ASN 63 HB2 ASN 63 10.797 16.999 -6.466 434 HB3 ASN 63 HB3 ASN 63 10.884 17.978 -5.015 435 HD21 ASN 63 HD21 ASN 63 11.909 17.523 -8.171 436 HD22 ASN 63 HD22 ASN 63 13.014 18.838 -8.272 437 H HIS 64 H HIS 64 12.073 14.542 -3.181 438 HA HIS 64 HA HIS 64 11.217 16.255 -1.154 439 HB2 HIS 64 HB2 HIS 64 11.167 14.272 0.252 440 HB3 HIS 64 HB3 HIS 64 10.312 14.032 -1.241 441 HD1 HIS 64 HD1 HIS 64 13.541 13.530 -2.399 442 HD2 HIS 64 HD2 HIS 64 11.155 11.367 0.227 443 HE1 HIS 64 HE1 HIS 64 14.516 11.212 -2.355 444 HE2 HIS 64 HE2 HIS 64 13.057 9.920 -0.760 445 HA PRO 65 HA PRO 65 15.412 17.374 0.228 446 HB2 PRO 65 HB2 PRO 65 13.827 18.812 2.291 447 HB3 PRO 65 HB3 PRO 65 15.078 19.446 1.200 448 HG2 PRO 65 HG2 PRO 65 12.578 20.072 0.783 449 HG3 PRO 65 HG3 PRO 65 13.605 19.596 -0.594 450 HD2 PRO 65 HD2 PRO 65 11.651 17.905 0.954 451 HD3 PRO 65 HD3 PRO 65 11.818 18.146 -0.786 452 H TRP 66 H TRP 66 16.582 17.103 2.179 453 HA TRP 66 HA TRP 66 15.460 15.051 3.886 454 HB2 TRP 66 HB2 TRP 66 18.292 16.068 3.712 455 HB3 TRP 66 HB3 TRP 66 17.723 14.809 4.799 456 HD1 TRP 66 HD1 TRP 66 17.986 15.426 0.973 457 HE1 TRP 66 HE1 TRP 66 18.389 13.158 -0.174 458 HE3 TRP 66 HE3 TRP 66 17.714 12.363 5.072 459 HZ2 TRP 66 HZ2 TRP 66 18.570 10.439 0.553 460 HZ3 TRP 66 HZ3 TRP 66 18.013 9.944 4.753 461 HH2 TRP 66 HH2 TRP 66 18.431 9.002 2.540 462 H MET 67 H MET 67 15.228 18.179 3.718 463 HA MET 67 HA MET 67 16.124 19.071 6.256 464 HB2 MET 67 HB2 MET 67 14.401 20.312 4.137 465 HB3 MET 67 HB3 MET 67 14.674 21.108 5.679 466 HG2 MET 67 HG2 MET 67 17.085 21.113 5.235 467 HG3 MET 67 HG3 MET 67 16.787 20.350 3.674 468 HE1 MET 67 HE1 MET 67 17.825 24.058 2.797 469 HE2 MET 67 HE2 MET 67 18.149 22.359 2.452 470 HE3 MET 67 HE3 MET 67 18.449 23.004 4.066 471 H LEU 68 H LEU 68 13.030 18.222 4.837 472 HA LEU 68 HA LEU 68 12.042 17.954 7.578 473 HB2 LEU 68 HB2 LEU 68 9.820 18.611 6.894 474 HB3 LEU 68 HB3 LEU 68 10.967 19.867 6.509 475 HG LEU 68 HG LEU 68 10.864 18.611 4.125 476 HD11 LEU 68 HD11 LEU 68 8.520 18.050 3.653 477 HD12 LEU 68 HD12 LEU 68 8.106 18.299 5.350 478 HD13 LEU 68 HD13 LEU 68 9.191 16.987 4.889 479 HD21 LEU 68 HD21 LEU 68 8.974 20.727 5.164 480 HD22 LEU 68 HD22 LEU 68 9.281 20.378 3.463 481 HD23 LEU 68 HD23 LEU 68 10.581 20.991 4.485 482 H TRP 69 H TRP 69 13.306 16.131 5.329 483 HA TRP 69 HA TRP 69 11.302 14.023 5.737 484 HB2 TRP 69 HB2 TRP 69 12.859 14.081 3.171 485 HB3 TRP 69 HB3 TRP 69 11.362 13.235 3.528 486 HD1 TRP 69 HD1 TRP 69 12.361 17.002 3.470 487 HE1 TRP 69 HE1 TRP 69 10.549 18.300 2.231 488 HE3 TRP 69 HE3 TRP 69 9.263 13.114 2.254 489 HZ2 TRP 69 HZ2 TRP 69 8.152 17.769 0.859 490 HZ3 TRP 69 HZ3 TRP 69 7.236 13.612 0.968 491 HH2 TRP 69 HH2 TRP 69 6.689 15.890 0.283 492 H MET 70 H MET 70 12.027 11.972 6.096 493 HA MET 70 HA MET 70 14.873 11.391 5.956 494 HB2 MET 70 HB2 MET 70 14.016 12.348 8.319 495 HB3 MET 70 HB3 MET 70 13.633 10.647 8.549 496 HG2 MET 70 HG2 MET 70 15.934 10.039 8.111 497 HG3 MET 70 HG3 MET 70 16.337 11.722 7.779 498 HE1 MET 70 HE1 MET 70 18.017 9.986 9.812 499 HE2 MET 70 HE2 MET 70 18.206 11.132 11.139 500 HE3 MET 70 HE3 MET 70 18.332 11.687 9.470 501 H ALA 71 H ALA 71 11.583 10.415 6.012 502 HA ALA 71 HA ALA 71 12.177 7.569 6.134 503 HB1 ALA 71 HB1 ALA 71 10.232 8.419 7.342 504 HB2 ALA 71 HB2 ALA 71 9.774 7.240 6.115 505 HB3 ALA 71 HB3 ALA 71 9.530 8.960 5.817 506 H GLY 72 H GLY 72 11.367 9.986 3.801 507 HA2 GLY 72 HA2 GLY 72 12.044 9.674 1.502 508 HA3 GLY 72 HA3 GLY 72 11.662 7.973 1.674 509 H ASN 73 H ASN 73 10.045 7.459 0.396 510 HA ASN 73 HA ASN 73 8.017 9.364 -0.319 511 HB2 ASN 73 HB2 ASN 73 8.640 6.588 -1.275 512 HB3 ASN 73 HB3 ASN 73 7.216 7.475 -1.801 513 HD21 ASN 73 HD21 ASN 73 10.721 7.484 -1.760 514 HD22 ASN 73 HD22 ASN 73 10.916 8.456 -3.173 515 H ALA 74 H ALA 74 5.881 9.246 0.177 516 HA ALA 74 HA ALA 74 4.778 6.955 1.487 517 HB1 ALA 74 HB1 ALA 74 4.988 9.567 2.971 518 HB2 ALA 74 HB2 ALA 74 5.732 8.029 3.418 519 HB3 ALA 74 HB3 ALA 74 3.977 8.211 3.474 520 H VAL 75 H VAL 75 2.528 6.874 1.463 521 HA VAL 75 HA VAL 75 1.111 9.111 0.231 522 HB VAL 75 HB VAL 75 0.355 6.388 -0.745 523 HG11 VAL 75 HG11 VAL 75 -0.889 8.571 -1.186 524 HG12 VAL 75 HG12 VAL 75 -0.565 7.523 -2.565 525 HG13 VAL 75 HG13 VAL 75 0.428 8.955 -2.295 526 HG21 VAL 75 HG21 VAL 75 2.556 7.959 -2.067 527 HG22 VAL 75 HG22 VAL 75 1.865 6.435 -2.618 528 HG23 VAL 75 HG23 VAL 75 2.803 6.491 -1.125 529 H LEU 76 H LEU 76 -0.579 9.561 1.407 530 HA LEU 76 HA LEU 76 -1.925 7.420 2.872 531 HB2 LEU 76 HB2 LEU 76 -0.728 9.589 3.979 532 HB3 LEU 76 HB3 LEU 76 -2.357 10.170 3.816 533 HG LEU 76 HG LEU 76 -2.124 7.507 5.051 534 HD11 LEU 76 HD11 LEU 76 -0.124 8.538 5.985 535 HD12 LEU 76 HD12 LEU 76 -1.383 8.385 7.210 536 HD13 LEU 76 HD13 LEU 76 -1.065 9.951 6.465 537 HD21 LEU 76 HD21 LEU 76 -4.218 8.764 4.887 538 HD22 LEU 76 HD22 LEU 76 -3.513 10.064 5.845 539 HD23 LEU 76 HD23 LEU 76 -3.763 8.475 6.567 540 H ILE 77 H ILE 77 -3.828 7.127 2.463 541 HA ILE 77 HA ILE 77 -5.481 8.950 0.992 542 HB ILE 77 HB ILE 77 -4.672 6.206 0.108 543 HG12 ILE 77 HG12 ILE 77 -4.885 8.450 -1.790 544 HG13 ILE 77 HG13 ILE 77 -3.601 8.542 -0.589 545 HG21 ILE 77 HG21 ILE 77 -6.376 6.105 -1.565 546 HG22 ILE 77 HG22 ILE 77 -6.936 7.729 -1.163 547 HG23 ILE 77 HG23 ILE 77 -7.170 6.408 -0.018 548 HD11 ILE 77 HD11 ILE 77 -3.993 6.157 -2.369 549 HD12 ILE 77 HD12 ILE 77 -2.587 6.571 -1.388 550 HD13 ILE 77 HD13 ILE 77 -2.985 7.536 -2.810 551 H GLN 78 H GLN 78 -7.624 8.554 1.174 552 HA GLN 78 HA GLN 78 -8.528 6.977 3.394 553 HB2 GLN 78 HB2 GLN 78 -9.167 9.310 3.450 554 HB3 GLN 78 HB3 GLN 78 -9.873 9.195 1.851 555 HG2 GLN 78 HG2 GLN 78 -11.236 7.268 3.168 556 HG3 GLN 78 HG3 GLN 78 -10.982 8.433 4.455 557 HE21 GLN 78 HE21 GLN 78 -12.339 7.802 1.403 558 HE22 GLN 78 HE22 GLN 78 -13.441 9.120 1.348 559 H HIS 79 H HIS 79 -9.268 5.083 2.947 560 HA HIS 79 HA HIS 79 -9.853 4.131 0.370 561 HB2 HIS 79 HB2 HIS 79 -9.962 2.956 3.085 562 HB3 HIS 79 HB3 HIS 79 -10.775 2.119 1.769 563 HD1 HIS 79 HD1 HIS 79 -8.474 3.040 -0.315 564 HD2 HIS 79 HD2 HIS 79 -7.996 0.934 3.234 565 HE1 HIS 79 HE1 HIS 79 -6.282 1.811 -0.549 566 HE2 HIS 79 HE2 HIS 79 -6.022 0.535 1.609 567 H ALA 80 H ALA 80 -11.802 2.517 0.320 568 HA ALA 80 HA ALA 80 -13.978 4.101 -0.298 569 HB1 ALA 80 HB1 ALA 80 -15.085 2.107 -1.015 570 HB2 ALA 80 HB2 ALA 80 -14.001 1.117 -0.040 571 HB3 ALA 80 HB3 ALA 80 -13.378 1.990 -1.438 572 H ASP 81 H ASP 81 -13.157 2.721 2.668 573 HA ASP 81 HA ASP 81 -15.864 2.708 3.667 574 HB2 ASP 81 HB2 ASP 81 -13.558 1.166 4.243 575 HB3 ASP 81 HB3 ASP 81 -14.139 1.936 5.710 576 H GLY 82 H GLY 82 -13.104 4.589 3.559 577 HA2 GLY 82 HA2 GLY 82 -13.244 6.908 4.187 578 HA3 GLY 82 HA3 GLY 82 -14.208 6.425 5.574 579 H MET 83 H MET 83 -12.022 4.088 5.463 580 HA MET 83 HA MET 83 -10.515 5.053 7.593 581 HB2 MET 83 HB2 MET 83 -9.316 2.879 7.307 582 HB3 MET 83 HB3 MET 83 -11.023 2.749 7.573 583 HG2 MET 83 HG2 MET 83 -11.366 2.293 5.215 584 HG3 MET 83 HG3 MET 83 -9.647 2.525 4.921 585 HE1 MET 83 HE1 MET 83 -11.770 0.453 7.638 586 HE2 MET 83 HE2 MET 83 -11.603 -1.139 6.897 587 HE3 MET 83 HE3 MET 83 -12.440 0.151 6.034 588 H HIS 84 H HIS 84 -7.954 4.798 7.492 589 HA HIS 84 HA HIS 84 -7.222 5.979 4.960 590 HB2 HIS 84 HB2 HIS 84 -5.630 7.477 5.965 591 HB3 HIS 84 HB3 HIS 84 -7.229 7.757 6.609 592 HD1 HIS 84 HD1 HIS 84 -3.774 6.863 7.560 593 HD2 HIS 84 HD2 HIS 84 -7.506 7.150 9.366 594 HE1 HIS 84 HE1 HIS 84 -3.316 6.985 10.029 595 HE2 HIS 84 HE2 HIS 84 -5.589 7.166 11.103 596 H THR 85 H THR 85 -5.247 5.455 4.036 597 HA THR 85 HA THR 85 -3.789 3.282 5.291 598 HB THR 85 HB THR 85 -3.702 2.642 2.661 599 HG1 THR 85 HG1 THR 85 -5.663 4.303 2.733 600 HG21 THR 85 HG21 THR 85 -5.420 0.887 3.268 601 HG22 THR 85 HG22 THR 85 -5.559 1.702 4.827 602 HG23 THR 85 HG23 THR 85 -4.018 0.998 4.331 603 H GLY 86 H GLY 86 -1.731 3.583 5.245 604 HA2 GLY 86 HA2 GLY 86 -0.596 5.633 3.483 605 HA3 GLY 86 HA3 GLY 86 0.162 5.001 4.939 606 H TYR 87 H TYR 87 1.352 5.240 2.355 607 HA TYR 87 HA TYR 87 2.110 2.491 1.872 608 HB2 TYR 87 HB2 TYR 87 1.716 4.577 -0.305 609 HB3 TYR 87 HB3 TYR 87 2.272 2.930 -0.543 610 HD1 TYR 87 HD1 TYR 87 0.735 1.361 -1.298 611 HD2 TYR 87 HD2 TYR 87 -0.724 4.760 0.825 612 HE1 TYR 87 HE1 TYR 87 -1.589 0.651 -1.746 613 HE2 TYR 87 HE2 TYR 87 -3.031 4.041 0.392 614 HH TYR 87 HH TYR 87 -4.249 2.643 -1.270 615 H ALA 88 H ALA 88 4.013 2.649 2.947 616 HA ALA 88 HA ALA 88 5.711 4.972 2.318 617 HB1 ALA 88 HB1 ALA 88 5.602 3.287 4.807 618 HB2 ALA 88 HB2 ALA 88 5.172 4.983 4.628 619 HB3 ALA 88 HB3 ALA 88 6.856 4.483 4.490 620 H HIS 89 H HIS 89 8.072 4.575 2.604 621 HA HIS 89 HA HIS 89 10.024 3.686 1.904 622 HB2 HIS 89 HB2 HIS 89 8.612 1.027 2.284 623 HB3 HIS 89 HB3 HIS 89 10.336 1.208 1.978 624 HD1 HIS 89 HD1 HIS 89 7.874 2.646 4.514 625 HD2 HIS 89 HD2 HIS 89 11.718 1.084 4.292 626 HE1 HIS 89 HE1 HIS 89 8.754 2.690 6.870 627 HE2 HIS 89 HE2 HIS 89 11.082 1.739 6.712 628 H LEU 90 H LEU 90 8.167 4.546 -0.036 629 HA LEU 90 HA LEU 90 8.587 2.825 -2.322 630 HB2 LEU 90 HB2 LEU 90 7.070 5.406 -2.340 631 HB3 LEU 90 HB3 LEU 90 6.941 4.073 -3.458 632 HG LEU 90 HG LEU 90 6.072 3.862 -0.572 633 HD11 LEU 90 HD11 LEU 90 3.829 4.313 -1.279 634 HD12 LEU 90 HD12 LEU 90 4.335 4.461 -2.960 635 HD13 LEU 90 HD13 LEU 90 4.850 5.660 -1.774 636 HD21 LEU 90 HD21 LEU 90 5.705 2.170 -3.020 637 HD22 LEU 90 HD22 LEU 90 4.628 2.046 -1.628 638 HD23 LEU 90 HD23 LEU 90 6.353 1.719 -1.443 639 H SER 91 H SER 91 9.175 4.075 -4.427 640 HA SER 91 HA SER 91 11.422 5.786 -3.804 641 HB2 SER 91 HB2 SER 91 11.976 3.633 -4.917 642 HB3 SER 91 HB3 SER 91 11.004 4.138 -6.295 643 HG SER 91 HG SER 91 12.870 5.990 -5.534 644 H LYS 92 H LYS 92 8.342 5.816 -5.191 645 HA LYS 92 HA LYS 92 8.546 8.490 -5.987 646 HB2 LYS 92 HB2 LYS 92 9.354 6.689 -7.968 647 HB3 LYS 92 HB3 LYS 92 7.722 7.161 -8.406 648 HG2 LYS 92 HG2 LYS 92 8.291 9.438 -8.507 649 HG3 LYS 92 HG3 LYS 92 9.854 9.138 -7.744 650 HD2 LYS 92 HD2 LYS 92 9.399 7.557 -10.160 651 HD3 LYS 92 HD3 LYS 92 9.406 9.298 -10.457 652 HE2 LYS 92 HE2 LYS 92 11.589 9.510 -9.444 653 HE3 LYS 92 HE3 LYS 92 11.574 7.812 -8.973 654 HZ1 LYS 92 HZ1 LYS 92 11.522 8.785 -11.779 655 HZ2 LYS 92 HZ2 LYS 92 11.636 7.174 -11.276 656 HZ3 LYS 92 HZ3 LYS 92 12.909 8.246 -10.973 657 H ILE 93 H ILE 93 6.623 9.354 -6.757 658 HA ILE 93 HA ILE 93 4.237 7.791 -6.262 659 HB ILE 93 HB ILE 93 5.093 10.317 -5.112 660 HG12 ILE 93 HG12 ILE 93 3.136 9.585 -3.509 661 HG13 ILE 93 HG13 ILE 93 3.364 8.047 -4.331 662 HG21 ILE 93 HG21 ILE 93 3.448 11.233 -6.606 663 HG22 ILE 93 HG22 ILE 93 2.974 11.396 -4.915 664 HG23 ILE 93 HG23 ILE 93 2.238 10.152 -5.921 665 HD11 ILE 93 HD11 ILE 93 4.751 7.839 -2.498 666 HD12 ILE 93 HD12 ILE 93 5.237 9.532 -2.541 667 HD13 ILE 93 HD13 ILE 93 5.872 8.401 -3.738 668 H SER 94 H SER 94 2.448 8.237 -7.476 669 HA SER 94 HA SER 94 2.849 9.735 -9.931 670 HB2 SER 94 HB2 SER 94 2.385 7.166 -9.893 671 HB3 SER 94 HB3 SER 94 0.733 7.678 -9.538 672 HG SER 94 HG SER 94 1.009 7.439 -11.772 673 H VAL 95 H VAL 95 1.346 9.785 -6.994 674 HA VAL 95 HA VAL 95 -1.021 11.036 -7.921 675 HB VAL 95 HB VAL 95 -1.495 10.839 -5.310 676 HG11 VAL 95 HG11 VAL 95 -1.878 8.563 -7.236 677 HG12 VAL 95 HG12 VAL 95 -2.887 10.008 -7.168 678 HG13 VAL 95 HG13 VAL 95 -2.840 8.902 -5.798 679 HG21 VAL 95 HG21 VAL 95 0.451 8.639 -5.911 680 HG22 VAL 95 HG22 VAL 95 -0.761 8.499 -4.640 681 HG23 VAL 95 HG23 VAL 95 0.454 9.772 -4.558 682 H SER 96 H SER 96 -1.760 12.533 -5.837 683 HA SER 96 HA SER 96 0.232 14.393 -5.077 684 HB2 SER 96 HB2 SER 96 -1.985 15.280 -6.943 685 HB3 SER 96 HB3 SER 96 -0.865 16.359 -6.110 686 HG SER 96 HG SER 96 -0.266 15.861 -8.303 687 H THR 97 H THR 97 -0.405 15.637 -3.399 688 HA THR 97 HA THR 97 -2.281 14.652 -1.637 689 HB THR 97 HB THR 97 -1.362 17.511 -1.590 690 HG1 THR 97 HG1 THR 97 0.422 16.289 -0.268 691 HG21 THR 97 HG21 THR 97 -2.964 16.565 0.163 692 HG22 THR 97 HG22 THR 97 -1.507 17.354 0.765 693 HG23 THR 97 HG23 THR 97 -1.601 15.594 0.719 694 H ASP 98 H ASP 98 -4.425 14.826 -1.508 695 HA ASP 98 HA ASP 98 -6.520 15.728 -1.424 696 HB2 ASP 98 HB2 ASP 98 -5.130 18.107 -2.555 697 HB3 ASP 98 HB3 ASP 98 -6.875 17.996 -2.758 698 H SER 99 H SER 99 -4.800 14.688 -4.043 699 HA SER 99 HA SER 99 -6.798 14.995 -6.051 700 HB2 SER 99 HB2 SER 99 -4.299 14.771 -6.469 701 HB3 SER 99 HB3 SER 99 -4.487 13.064 -6.058 702 HG SER 99 HG SER 99 -5.747 14.462 -8.185 703 H THR 100 H THR 100 -8.118 13.341 -6.882 704 HA THR 100 HA THR 100 -8.905 11.359 -5.005 705 HB THR 100 HB THR 100 -10.517 10.701 -6.889 706 HG1 THR 100 HG1 THR 100 -10.875 12.702 -8.227 707 HG21 THR 100 HG21 THR 100 -12.033 12.537 -6.266 708 HG22 THR 100 HG22 THR 100 -10.663 13.398 -5.560 709 HG23 THR 100 HG23 THR 100 -11.187 11.858 -4.873 710 H VAL 101 H VAL 101 -8.855 9.159 -5.257 711 HA VAL 101 HA VAL 101 -7.175 8.157 -7.370 712 HB VAL 101 HB VAL 101 -6.745 6.355 -5.437 713 HG11 VAL 101 HG11 VAL 101 -5.033 7.275 -6.813 714 HG12 VAL 101 HG12 VAL 101 -4.548 7.459 -5.125 715 HG13 VAL 101 HG13 VAL 101 -5.177 8.844 -6.019 716 HG21 VAL 101 HG21 VAL 101 -7.896 7.559 -3.701 717 HG22 VAL 101 HG22 VAL 101 -6.925 8.996 -4.014 718 HG23 VAL 101 HG23 VAL 101 -6.167 7.544 -3.363 719 H LYS 102 H LYS 102 -7.320 5.755 -7.577 720 HA LYS 102 HA LYS 102 -9.846 4.600 -7.002 721 HB2 LYS 102 HB2 LYS 102 -9.861 5.759 -9.256 722 HB3 LYS 102 HB3 LYS 102 -8.735 4.510 -9.722 723 HG2 LYS 102 HG2 LYS 102 -10.479 2.830 -9.020 724 HG3 LYS 102 HG3 LYS 102 -11.592 4.185 -8.861 725 HD2 LYS 102 HD2 LYS 102 -11.109 4.749 -11.255 726 HD3 LYS 102 HD3 LYS 102 -10.216 3.230 -11.365 727 HE2 LYS 102 HE2 LYS 102 -12.272 2.037 -10.638 728 HE3 LYS 102 HE3 LYS 102 -13.138 3.570 -10.696 729 HZ1 LYS 102 HZ1 LYS 102 -11.875 2.150 -12.977 730 HZ2 LYS 102 HZ2 LYS 102 -12.535 3.704 -13.078 731 HZ3 LYS 102 HZ3 LYS 102 -13.530 2.386 -12.713 732 H GLN 103 H GLN 103 -9.869 2.432 -6.968 733 HA GLN 103 HA GLN 103 -7.641 1.132 -6.051 734 HB2 GLN 103 HB2 GLN 103 -10.130 0.555 -5.785 735 HB3 GLN 103 HB3 GLN 103 -9.954 -0.293 -7.307 736 HG2 GLN 103 HG2 GLN 103 -8.022 -0.971 -5.175 737 HG3 GLN 103 HG3 GLN 103 -9.684 -1.509 -4.962 738 HE21 GLN 103 HE21 GLN 103 -8.471 -1.137 -8.126 739 HE22 GLN 103 HE22 GLN 103 -8.268 -2.789 -8.470 740 H GLY 104 H GLY 104 -6.175 -0.175 -6.910 741 HA2 GLY 104 HA2 GLY 104 -4.882 -1.322 -8.413 742 HA3 GLY 104 HA3 GLY 104 -6.172 -1.191 -9.542 743 H GLN 105 H GLN 105 -5.740 1.873 -8.700 744 HA GLN 105 HA GLN 105 -4.359 2.566 -11.081 745 HB2 GLN 105 HB2 GLN 105 -6.229 3.868 -10.067 746 HB3 GLN 105 HB3 GLN 105 -5.163 4.308 -8.751 747 HG2 GLN 105 HG2 GLN 105 -3.812 5.631 -10.204 748 HG3 GLN 105 HG3 GLN 105 -4.663 5.028 -11.629 749 HE21 GLN 105 HE21 GLN 105 -5.065 6.859 -8.657 750 HE22 GLN 105 HE22 GLN 105 -6.401 7.804 -9.195 751 H ILE 106 H ILE 106 -2.389 3.392 -11.347 752 HA ILE 106 HA ILE 106 -0.461 2.573 -9.509 753 HB ILE 106 HB ILE 106 -0.176 4.057 -12.048 754 HG12 ILE 106 HG12 ILE 106 0.803 1.279 -11.492 755 HG13 ILE 106 HG13 ILE 106 -0.883 1.561 -11.905 756 HG21 ILE 106 HG21 ILE 106 1.701 4.710 -10.657 757 HG22 ILE 106 HG22 ILE 106 2.263 3.618 -11.922 758 HG23 ILE 106 HG23 ILE 106 2.030 3.018 -10.280 759 HD11 ILE 106 HD11 ILE 106 0.244 0.924 -13.887 760 HD12 ILE 106 HD12 ILE 106 1.542 2.084 -13.602 761 HD13 ILE 106 HD13 ILE 106 -0.077 2.655 -14.015 762 H ILE 107 H ILE 107 -0.452 3.579 -7.689 763 HA ILE 107 HA ILE 107 -0.637 6.414 -7.505 764 HB ILE 107 HB ILE 107 -0.482 5.838 -4.996 765 HG12 ILE 107 HG12 ILE 107 -1.642 3.202 -5.679 766 HG13 ILE 107 HG13 ILE 107 0.107 3.342 -5.817 767 HG21 ILE 107 HG21 ILE 107 -2.486 6.670 -6.037 768 HG22 ILE 107 HG22 ILE 107 -2.902 5.355 -4.941 769 HG23 ILE 107 HG23 ILE 107 -2.848 5.069 -6.680 770 HD11 ILE 107 HD11 ILE 107 -1.543 3.876 -3.359 771 HD12 ILE 107 HD12 ILE 107 0.201 4.103 -3.481 772 HD13 ILE 107 HD13 ILE 107 -0.493 2.490 -3.648 773 H GLY 108 H GLY 108 1.886 4.247 -7.830 774 HA2 GLY 108 HA2 GLY 108 3.907 6.080 -7.701 775 HA3 GLY 108 HA3 GLY 108 3.798 5.387 -6.090 776 H TYR 109 H TYR 109 5.886 4.654 -6.461 777 HA TYR 109 HA TYR 109 6.084 2.082 -7.705 778 HB2 TYR 109 HB2 TYR 109 8.256 4.170 -8.010 779 HB3 TYR 109 HB3 TYR 109 8.263 2.547 -8.684 780 HD1 TYR 109 HD1 TYR 109 7.303 2.120 -10.814 781 HD2 TYR 109 HD2 TYR 109 6.607 5.841 -8.885 782 HE1 TYR 109 HE1 TYR 109 6.308 2.999 -12.887 783 HE2 TYR 109 HE2 TYR 109 5.609 6.738 -10.951 784 HH TYR 109 HH TYR 109 4.678 4.803 -13.526 785 H THR 110 H THR 110 7.277 0.678 -6.535 786 HA THR 110 HA THR 110 7.624 1.087 -3.806 787 HB THR 110 HB THR 110 9.150 -1.067 -4.187 788 HG1 THR 110 HG1 THR 110 8.967 -0.756 -6.525 789 HG21 THR 110 HG21 THR 110 7.033 -2.404 -4.117 790 HG22 THR 110 HG22 THR 110 6.156 -0.896 -4.335 791 HG23 THR 110 HG23 THR 110 7.145 -1.136 -2.898 792 H GLY 111 H GLY 111 9.495 1.187 -2.459 793 HA2 GLY 111 HA2 GLY 111 12.055 1.690 -3.771 794 HA3 GLY 111 HA3 GLY 111 11.386 3.001 -2.820 795 H ALA 112 H ALA 112 13.407 2.776 -1.639 796 HA ALA 112 HA ALA 112 13.028 1.075 0.616 797 HB1 ALA 112 HB1 ALA 112 14.549 -0.061 -1.235 798 HB2 ALA 112 HB2 ALA 112 14.936 -0.222 0.477 799 HB3 ALA 112 HB3 ALA 112 15.788 0.964 -0.512 800 H THR 113 H THR 113 12.698 3.757 0.460 801 HA THR 113 HA THR 113 15.105 5.161 1.193 802 HB THR 113 HB THR 113 13.661 7.156 1.376 803 HG1 THR 113 HG1 THR 113 11.616 5.248 0.847 804 HG21 THR 113 HG21 THR 113 13.215 5.554 -1.150 805 HG22 THR 113 HG22 THR 113 14.615 6.570 -0.801 806 HG23 THR 113 HG23 THR 113 13.022 7.301 -0.988 807 H GLY 114 H GLY 114 13.122 3.193 2.939 808 HA2 GLY 114 HA2 GLY 114 13.088 4.796 5.385 809 HA3 GLY 114 HA3 GLY 114 12.336 3.223 5.162 810 H GLN 115 H GLN 115 13.239 1.673 6.323 811 HA GLN 115 HA GLN 115 15.978 1.963 7.293 812 HB2 GLN 115 HB2 GLN 115 13.614 0.321 8.065 813 HB3 GLN 115 HB3 GLN 115 15.210 -0.307 8.451 814 HG2 GLN 115 HG2 GLN 115 15.717 1.750 9.677 815 HG3 GLN 115 HG3 GLN 115 14.106 2.363 9.301 816 HE21 GLN 115 HE21 GLN 115 12.329 1.516 10.355 817 HE22 GLN 115 HE22 GLN 115 12.466 0.519 11.759 818 H VAL 116 H VAL 116 17.525 0.270 7.149 819 HA VAL 116 HA VAL 116 18.921 -1.023 5.954 820 HB VAL 116 HB VAL 116 18.115 -3.285 5.288 821 HG11 VAL 116 HG11 VAL 116 18.979 -2.831 7.504 822 HG12 VAL 116 HG12 VAL 116 17.690 -4.033 7.568 823 HG13 VAL 116 HG13 VAL 116 17.369 -2.369 8.057 824 HG21 VAL 116 HG21 VAL 116 15.820 -2.868 4.659 825 HG22 VAL 116 HG22 VAL 116 15.437 -2.309 6.287 826 HG23 VAL 116 HG23 VAL 116 15.855 -3.999 6.012 827 H THR 117 H THR 117 19.425 -2.240 3.893 828 HA THR 117 HA THR 117 18.783 -0.502 1.665 829 HB THR 117 HB THR 117 20.421 -2.007 0.422 830 HG1 THR 117 HG1 THR 117 20.845 -3.000 3.061 831 HG21 THR 117 HG21 THR 117 22.402 -1.075 1.601 832 HG22 THR 117 HG22 THR 117 21.337 -0.556 2.908 833 HG23 THR 117 HG23 THR 117 21.146 0.125 1.293 834 H GLY 118 H GLY 118 17.127 -2.959 2.936 835 HA2 GLY 118 HA2 GLY 118 16.523 -4.469 0.528 836 HA3 GLY 118 HA3 GLY 118 15.867 -4.746 2.128 837 HA PRO 119 HA PRO 119 13.108 -1.562 -0.349 838 HB2 PRO 119 HB2 PRO 119 12.582 -3.108 -2.750 839 HB3 PRO 119 HB3 PRO 119 13.189 -1.461 -2.611 840 HG2 PRO 119 HG2 PRO 119 14.699 -3.517 -3.531 841 HG3 PRO 119 HG3 PRO 119 15.372 -2.092 -2.717 842 HD2 PRO 119 HD2 PRO 119 14.879 -4.829 -1.631 843 HD3 PRO 119 HD3 PRO 119 16.228 -3.712 -1.335 844 H HIS 120 H HIS 120 10.890 -1.688 -0.006 845 HA HIS 120 HA HIS 120 9.409 -4.023 -0.430 846 HB2 HIS 120 HB2 HIS 120 8.785 -4.497 1.933 847 HB3 HIS 120 HB3 HIS 120 10.492 -4.779 1.628 848 HD1 HIS 120 HD1 HIS 120 12.177 -3.039 2.661 849 HD2 HIS 120 HD2 HIS 120 8.221 -2.607 3.862 850 HE1 HIS 120 HE1 HIS 120 12.252 -1.546 4.682 851 HE2 HIS 120 HE2 HIS 120 9.846 -1.292 5.394 852 H LEU 121 H LEU 121 7.323 -3.650 1.188 853 HA LEU 121 HA LEU 121 6.316 -1.051 0.550 854 HB2 LEU 121 HB2 LEU 121 5.300 -2.303 -1.080 855 HB3 LEU 121 HB3 LEU 121 5.191 -3.725 -0.088 856 HG LEU 121 HG LEU 121 3.348 -2.496 1.191 857 HD11 LEU 121 HD11 LEU 121 3.473 -0.741 -1.262 858 HD12 LEU 121 HD12 LEU 121 3.768 -0.239 0.403 859 HD13 LEU 121 HD13 LEU 121 2.156 -0.759 -0.089 860 HD21 LEU 121 HD21 LEU 121 2.906 -3.222 -1.700 861 HD22 LEU 121 HD22 LEU 121 1.658 -3.116 -0.459 862 HD23 LEU 121 HD23 LEU 121 2.921 -4.340 -0.336 863 H HIS 122 H HIS 122 5.348 -0.055 2.109 864 HA HIS 122 HA HIS 122 4.694 -1.488 4.508 865 HB2 HIS 122 HB2 HIS 122 6.443 0.006 5.097 866 HB3 HIS 122 HB3 HIS 122 5.758 1.303 4.132 867 HD2 HIS 122 HD2 HIS 122 3.456 2.561 5.322 868 HE1 HIS 122 HE1 HIS 122 4.202 0.955 9.159 869 HE2 HIS 122 HE2 HIS 122 2.849 2.633 7.837 870 H PHE 123 H PHE 123 2.608 -1.815 4.642 871 HA PHE 123 HA PHE 123 0.754 0.254 3.709 872 HB2 PHE 123 HB2 PHE 123 0.777 -2.033 2.528 873 HB3 PHE 123 HB3 PHE 123 0.094 -2.682 4.008 874 HD1 PHE 123 HD1 PHE 123 -2.229 -2.492 4.478 875 HD2 PHE 123 HD2 PHE 123 -0.505 -0.355 1.214 876 HE1 PHE 123 HE1 PHE 123 -4.475 -1.960 3.640 877 HE2 PHE 123 HE2 PHE 123 -2.753 0.182 0.382 878 HZ PHE 123 HZ PHE 123 -4.737 -0.623 1.591 879 H GLU 124 H GLU 124 0.052 1.319 5.398 880 HA GLU 124 HA GLU 124 -0.703 -0.045 7.816 881 HB2 GLU 124 HB2 GLU 124 1.190 1.776 7.800 882 HB3 GLU 124 HB3 GLU 124 -0.155 2.905 7.688 883 HG2 GLU 124 HG2 GLU 124 -1.076 1.970 9.775 884 HG3 GLU 124 HG3 GLU 124 0.324 0.905 9.890 885 H MET 125 H MET 125 -2.725 0.005 8.290 886 HA MET 125 HA MET 125 -4.558 1.749 6.932 887 HB2 MET 125 HB2 MET 125 -4.946 -0.274 5.890 888 HB3 MET 125 HB3 MET 125 -4.559 -1.150 7.330 889 HG2 MET 125 HG2 MET 125 -6.688 -1.108 8.119 890 HG3 MET 125 HG3 MET 125 -7.049 0.438 7.348 891 HE1 MET 125 HE1 MET 125 -7.779 -3.021 7.566 892 HE2 MET 125 HE2 MET 125 -8.695 -3.375 6.104 893 HE3 MET 125 HE3 MET 125 -9.238 -2.101 7.197 894 H LEU 126 H LEU 126 -5.994 2.700 8.075 895 HA LEU 126 HA LEU 126 -6.381 2.097 10.877 896 HB2 LEU 126 HB2 LEU 126 -5.125 4.547 9.714 897 HB3 LEU 126 HB3 LEU 126 -6.207 4.774 11.068 898 HG LEU 126 HG LEU 126 -4.622 2.860 12.099 899 HD11 LEU 126 HD11 LEU 126 -3.234 2.744 10.076 900 HD12 LEU 126 HD12 LEU 126 -2.315 3.274 11.484 901 HD13 LEU 126 HD13 LEU 126 -2.828 4.449 10.272 902 HD21 LEU 126 HD21 LEU 126 -3.474 4.639 13.270 903 HD22 LEU 126 HD22 LEU 126 -5.181 5.036 13.075 904 HD23 LEU 126 HD23 LEU 126 -3.976 5.800 12.040 905 HA PRO 127 HA PRO 127 -10.656 3.443 10.134 906 HB2 PRO 127 HB2 PRO 127 -11.059 5.280 12.134 907 HB3 PRO 127 HB3 PRO 127 -11.260 3.554 12.339 908 HG2 PRO 127 HG2 PRO 127 -8.971 5.280 13.081 909 HG3 PRO 127 HG3 PRO 127 -9.635 3.870 13.934 910 HD2 PRO 127 HD2 PRO 127 -7.382 3.698 12.535 911 HD3 PRO 127 HD3 PRO 127 -8.548 2.375 12.549 912 H ALA 128 H ALA 128 -12.087 5.465 10.080 913 HA ALA 128 HA ALA 128 -10.956 7.365 8.364 914 HB1 ALA 128 HB1 ALA 128 -13.335 6.762 8.290 915 HB2 ALA 128 HB2 ALA 128 -13.120 8.499 8.504 916 HB3 ALA 128 HB3 ALA 128 -13.552 7.486 9.882 917 H ASN 129 H ASN 129 -11.380 7.040 11.737 918 HA ASN 129 HA ASN 129 -9.745 9.235 12.430 919 HB2 ASN 129 HB2 ASN 129 -12.653 9.657 12.563 920 HB3 ASN 129 HB3 ASN 129 -11.847 9.917 14.107 921 HD21 ASN 129 HD21 ASN 129 -12.048 10.931 10.772 922 HD22 ASN 129 HD22 ASN 129 -11.298 12.472 10.992 923 HA PRO 130 HA PRO 130 -9.181 5.874 15.056 924 HB2 PRO 130 HB2 PRO 130 -6.607 6.979 15.774 925 HB3 PRO 130 HB3 PRO 130 -6.989 5.510 14.866 926 HG2 PRO 130 HG2 PRO 130 -5.936 7.748 13.692 927 HG3 PRO 130 HG3 PRO 130 -6.885 6.538 12.827 928 HD2 PRO 130 HD2 PRO 130 -7.673 9.216 13.850 929 HD3 PRO 130 HD3 PRO 130 -8.159 8.367 12.368 930 H ASN 131 H ASN 131 -8.620 5.390 17.149 931 HA ASN 131 HA ASN 131 -9.002 7.475 19.121 932 HB2 ASN 131 HB2 ASN 131 -10.696 5.443 18.615 933 HB3 ASN 131 HB3 ASN 131 -9.613 4.701 19.778 934 HD21 ASN 131 HD21 ASN 131 -11.961 7.123 19.174 935 HD22 ASN 131 HD22 ASN 131 -12.280 7.523 20.811 936 H TRP 132 H TRP 132 -6.668 7.599 18.715 937 HA TRP 132 HA TRP 132 -4.866 5.566 19.284 938 HB2 TRP 132 HB2 TRP 132 -4.231 8.477 19.734 939 HB3 TRP 132 HB3 TRP 132 -3.143 7.200 19.210 940 HD1 TRP 132 HD1 TRP 132 -3.551 6.303 16.629 941 HE1 TRP 132 HE1 TRP 132 -4.287 7.628 14.547 942 HE3 TRP 132 HE3 TRP 132 -5.645 10.364 18.926 943 HZ2 TRP 132 HZ2 TRP 132 -5.581 10.013 13.959 944 HZ3 TRP 132 HZ3 TRP 132 -6.617 12.133 17.514 945 HH2 TRP 132 HH2 TRP 132 -6.585 11.963 15.078 946 H GLN 133 H GLN 133 -6.987 6.441 21.363 947 HA GLN 133 HA GLN 133 -5.528 7.093 23.699 948 HB2 GLN 133 HB2 GLN 133 -8.402 6.416 23.167 949 HB3 GLN 133 HB3 GLN 133 -7.764 6.862 24.720 950 HG2 GLN 133 HG2 GLN 133 -8.622 8.876 23.973 951 HG3 GLN 133 HG3 GLN 133 -6.927 9.000 23.505 952 HE21 GLN 133 HE21 GLN 133 -6.388 8.461 21.284 953 HE22 GLN 133 HE22 GLN 133 -7.529 8.711 20.021 954 H ASN 134 H ASN 134 -4.826 4.682 22.480 955 HA ASN 134 HA ASN 134 -3.960 2.683 23.005 956 HB2 ASN 134 HB2 ASN 134 -5.115 3.295 25.723 957 HB3 ASN 134 HB3 ASN 134 -4.285 1.781 25.368 958 HD21 ASN 134 HD21 ASN 134 -3.924 5.278 25.284 959 HD22 ASN 134 HD22 ASN 134 -2.220 5.290 25.534 960 H GLY 135 H GLY 135 -4.623 0.834 22.293 961 HA2 GLY 135 HA2 GLY 135 -6.562 -0.839 23.003 962 HA3 GLY 135 HA3 GLY 135 -7.475 0.399 22.153 963 H PHE 136 H PHE 136 -5.930 1.026 20.017 964 HA PHE 136 HA PHE 136 -5.057 -1.395 18.687 965 HB2 PHE 136 HB2 PHE 136 -6.557 -0.694 16.652 966 HB3 PHE 136 HB3 PHE 136 -7.213 -1.703 17.926 967 HD1 PHE 136 HD1 PHE 136 -6.805 2.019 18.201 968 HD2 PHE 136 HD2 PHE 136 -9.470 -1.250 17.568 969 HE1 PHE 136 HE1 PHE 136 -8.707 3.532 18.388 970 HE2 PHE 136 HE2 PHE 136 -11.381 0.275 17.787 971 HZ PHE 136 HZ PHE 136 -11.003 2.671 18.197 972 H SER 137 H SER 137 -5.211 1.975 18.937 973 HA SER 137 HA SER 137 -3.968 3.711 18.223 974 HB2 SER 137 HB2 SER 137 -1.977 2.238 18.636 975 HB3 SER 137 HB3 SER 137 -2.096 1.678 16.973 976 HG SER 137 HG SER 137 -2.008 4.428 17.387 977 H GLY 138 H GLY 138 -5.962 2.104 16.808 978 HA2 GLY 138 HA2 GLY 138 -7.313 2.492 15.016 979 HA3 GLY 138 HA3 GLY 138 -6.182 3.712 14.473 980 H ARG 139 H ARG 139 -4.126 1.337 14.871 981 HA ARG 139 HA ARG 139 -4.200 0.663 12.080 982 HB2 ARG 139 HB2 ARG 139 -2.142 -0.768 12.692 983 HB3 ARG 139 HB3 ARG 139 -2.011 0.977 12.825 984 HG2 ARG 139 HG2 ARG 139 -1.044 0.389 14.793 985 HG3 ARG 139 HG3 ARG 139 -2.716 0.466 15.329 986 HD2 ARG 139 HD2 ARG 139 -2.878 -1.989 14.925 987 HD3 ARG 139 HD3 ARG 139 -1.149 -1.994 14.583 988 HE ARG 139 HE ARG 139 -2.418 -1.613 17.183 989 HH11 ARG 139 HH11 ARG 139 0.570 -1.674 15.304 990 HH12 ARG 139 HH12 ARG 139 1.608 -1.835 16.768 991 HH21 ARG 139 HH21 ARG 139 0.665 -1.903 18.845 992 HH22 ARG 139 HH22 ARG 139 -1.123 -1.798 19.038 993 H ILE 140 H ILE 140 -5.061 -1.041 11.124 994 HA ILE 140 HA ILE 140 -5.571 -3.419 12.706 995 HB ILE 140 HB ILE 140 -7.564 -3.158 10.667 996 HG12 ILE 140 HG12 ILE 140 -8.887 -1.484 12.240 997 HG13 ILE 140 HG13 ILE 140 -7.264 -0.906 12.600 998 HG21 ILE 140 HG21 ILE 140 -7.614 -4.793 12.456 999 HG22 ILE 140 HG22 ILE 140 -9.053 -3.772 12.493 1000 HG23 ILE 140 HG23 ILE 140 -7.746 -3.497 13.645 1001 HD11 ILE 140 HD11 ILE 140 -8.337 -1.148 9.808 1002 HD12 ILE 140 HD12 ILE 140 -6.887 -0.302 10.346 1003 HD13 ILE 140 HD13 ILE 140 -8.482 0.315 10.782 1004 H ASP 141 H ASP 141 -6.582 -5.135 10.949 1005 HA ASP 141 HA ASP 141 -4.269 -5.870 9.466 1006 HB2 ASP 141 HB2 ASP 141 -5.581 -7.958 8.959 1007 HB3 ASP 141 HB3 ASP 141 -5.313 -7.619 10.662 1008 HA PRO 142 HA PRO 142 -5.781 -4.361 5.477 1009 HB2 PRO 142 HB2 PRO 142 -3.709 -5.795 4.089 1010 HB3 PRO 142 HB3 PRO 142 -3.804 -4.067 4.428 1011 HG2 PRO 142 HG2 PRO 142 -1.960 -5.773 5.544 1012 HG3 PRO 142 HG3 PRO 142 -2.439 -4.211 6.228 1013 HD2 PRO 142 HD2 PRO 142 -3.259 -6.956 7.026 1014 HD3 PRO 142 HD3 PRO 142 -3.011 -5.505 8.017 1015 H THR 143 H THR 143 -5.825 -7.530 6.536 1016 HA THR 143 HA THR 143 -6.107 -9.196 4.394 1017 HB THR 143 HB THR 143 -7.774 -10.372 6.099 1018 HG1 THR 143 HG1 THR 143 -6.777 -9.718 8.245 1019 HG21 THR 143 HG21 THR 143 -5.618 -11.249 5.373 1020 HG22 THR 143 HG22 THR 143 -5.820 -11.438 7.115 1021 HG23 THR 143 HG23 THR 143 -4.797 -10.149 6.481 1022 H GLY 144 H GLY 144 -8.312 -6.822 5.444 1023 HA2 GLY 144 HA2 GLY 144 -10.754 -7.970 4.504 1024 HA3 GLY 144 HA3 GLY 144 -10.484 -6.274 4.877 1025 H TYR 145 H TYR 145 -8.227 -6.068 3.025 1026 HA TYR 145 HA TYR 145 -9.738 -5.851 0.572 1027 HB2 TYR 145 HB2 TYR 145 -7.196 -4.451 1.382 1028 HB3 TYR 145 HB3 TYR 145 -8.046 -4.211 -0.137 1029 HD1 TYR 145 HD1 TYR 145 -8.433 -3.891 3.531 1030 HD2 TYR 145 HD2 TYR 145 -9.746 -2.618 -0.305 1031 HE1 TYR 145 HE1 TYR 145 -9.796 -2.116 4.587 1032 HE2 TYR 145 HE2 TYR 145 -11.109 -0.851 0.729 1033 HH TYR 145 HH TYR 145 -12.150 -0.342 2.864 1034 H ILE 146 H ILE 146 -7.335 -7.679 1.981 1035 HA ILE 146 HA ILE 146 -6.037 -8.367 -0.501 1036 HB ILE 146 HB ILE 146 -5.350 -9.432 2.228 1037 HG12 ILE 146 HG12 ILE 146 -5.097 -7.008 2.320 1038 HG13 ILE 146 HG13 ILE 146 -3.514 -7.765 2.322 1039 HG21 ILE 146 HG21 ILE 146 -4.453 -10.779 0.400 1040 HG22 ILE 146 HG22 ILE 146 -3.160 -9.970 1.285 1041 HG23 ILE 146 HG23 ILE 146 -3.675 -9.350 -0.282 1042 HD11 ILE 146 HD11 ILE 146 -4.831 -6.416 -0.038 1043 HD12 ILE 146 HD12 ILE 146 -3.240 -7.177 -0.046 1044 HD13 ILE 146 HD13 ILE 146 -3.531 -5.754 0.954 1045 H ALA 147 H ALA 147 -8.602 -9.383 1.335 1046 HA ALA 147 HA ALA 147 -8.520 -12.181 0.877 1047 HB1 ALA 147 HB1 ALA 147 -10.799 -10.402 1.658 1048 HB2 ALA 147 HB2 ALA 147 -9.742 -11.287 2.758 1049 HB3 ALA 147 HB3 ALA 147 -10.830 -12.164 1.682 1050 H ASN 148 H ASN 148 -9.575 -9.455 -0.901 1051 HA ASN 148 HA ASN 148 -11.013 -11.043 -2.805 1052 HB2 ASN 148 HB2 ASN 148 -10.805 -8.084 -3.028 1053 HB3 ASN 148 HB3 ASN 148 -12.163 -9.118 -3.341 1054 HD21 ASN 148 HD21 ASN 148 -10.349 -7.524 -0.916 1055 HD22 ASN 148 HD22 ASN 148 -11.542 -7.565 0.329 1056 H ALA 149 H ALA 149 -8.086 -10.635 -2.231 1057 HA ALA 149 HA ALA 149 -7.158 -9.665 -4.726 1058 HB1 ALA 149 HB1 ALA 149 -5.080 -9.343 -3.637 1059 HB2 ALA 149 HB2 ALA 149 -5.529 -10.460 -2.349 1060 HB3 ALA 149 HB3 ALA 149 -6.332 -8.899 -2.477 1061 HA PRO 150 HA PRO 150 -6.001 -13.509 -6.648 1062 HB2 PRO 150 HB2 PRO 150 -3.312 -13.032 -7.202 1063 HB3 PRO 150 HB3 PRO 150 -4.681 -12.582 -8.227 1064 HG2 PRO 150 HG2 PRO 150 -3.163 -10.931 -6.291 1065 HG3 PRO 150 HG3 PRO 150 -3.864 -10.483 -7.854 1066 HD2 PRO 150 HD2 PRO 150 -5.041 -9.751 -5.574 1067 HD3 PRO 150 HD3 PRO 150 -5.997 -10.239 -6.984 1068 H VAL 151 H VAL 151 -4.075 -15.186 -6.680 1069 HA VAL 151 HA VAL 151 -3.429 -15.842 -3.918 1070 HB VAL 151 HB VAL 151 -4.089 -17.710 -6.133 1071 HG11 VAL 151 HG11 VAL 151 -3.714 -19.538 -4.695 1072 HG12 VAL 151 HG12 VAL 151 -3.592 -18.486 -3.284 1073 HG13 VAL 151 HG13 VAL 151 -2.309 -18.477 -4.503 1074 HG21 VAL 151 HG21 VAL 151 -6.043 -16.566 -5.189 1075 HG22 VAL 151 HG22 VAL 151 -5.597 -17.170 -3.593 1076 HG23 VAL 151 HG23 VAL 151 -6.062 -18.299 -4.865 1077 H PHE 152 H PHE 152 -1.456 -16.246 -3.453 1078 HA PHE 152 HA PHE 152 0.628 -16.304 -5.497 1079 HB2 PHE 152 HB2 PHE 152 0.874 -14.609 -3.745 1080 HB3 PHE 152 HB3 PHE 152 0.729 -15.833 -2.494 1081 HD1 PHE 152 HD1 PHE 152 2.884 -14.486 -5.120 1082 HD2 PHE 152 HD2 PHE 152 2.574 -17.163 -1.856 1083 HE1 PHE 152 HE1 PHE 152 5.330 -14.773 -5.149 1084 HE2 PHE 152 HE2 PHE 152 5.024 -17.470 -1.860 1085 HZ PHE 152 HZ PHE 152 6.404 -16.273 -3.515 1086 H ASN 153 H ASN 153 0.643 -18.385 -6.201 1087 HA ASN 153 HA ASN 153 1.184 -20.576 -6.341 1088 HB2 ASN 153 HB2 ASN 153 2.685 -19.783 -3.891 1089 HB3 ASN 153 HB3 ASN 153 2.567 -21.497 -4.281 1090 HD21 ASN 153 HD21 ASN 153 3.537 -18.364 -5.552 1091 HD22 ASN 153 HD22 ASN 153 4.735 -18.969 -6.639 1092 H GLY 154 H GLY 154 -0.396 -19.618 -3.372 1093 HA2 GLY 154 HA2 GLY 154 -2.498 -20.711 -2.813 1094 HA3 GLY 154 HA3 GLY 154 -1.765 -22.237 -3.294 1095 H THR 155 H THR 155 -1.139 -19.549 -1.054 1096 HA THR 155 HA THR 155 0.070 -21.327 0.868 1097 HB THR 155 HB THR 155 0.494 -19.089 2.024 1098 HG1 THR 155 HG1 THR 155 0.490 -17.336 0.379 1099 HG21 THR 155 HG21 THR 155 1.706 -19.575 -0.686 1100 HG22 THR 155 HG22 THR 155 2.234 -20.317 0.825 1101 HG23 THR 155 HG23 THR 155 2.410 -18.577 0.587 1102 H THR 156 H THR 156 -1.393 -22.325 2.042 1103 HA THR 156 HA THR 156 -3.753 -20.962 3.074 1104 HB THR 156 HB THR 156 -4.270 -23.253 4.067 1105 HG1 THR 156 HG1 THR 156 -1.819 -23.728 2.915 1106 HG21 THR 156 HG21 THR 156 -5.341 -22.430 2.020 1107 HG22 THR 156 HG22 THR 156 -5.050 -24.168 1.937 1108 HG23 THR 156 HG23 THR 156 -3.997 -23.055 1.064 1109 HA PRO 157 HA PRO 157 -1.533 -20.388 6.946 1110 HB2 PRO 157 HB2 PRO 157 -3.661 -18.992 8.168 1111 HB3 PRO 157 HB3 PRO 157 -2.246 -18.290 7.379 1112 HG2 PRO 157 HG2 PRO 157 -4.881 -18.123 6.469 1113 HG3 PRO 157 HG3 PRO 157 -3.422 -17.734 5.539 1114 HD2 PRO 157 HD2 PRO 157 -5.112 -20.168 5.459 1115 HD3 PRO 157 HD3 PRO 157 -4.152 -19.407 4.181 1116 H THR 158 H THR 158 -4.899 -21.259 7.015 1117 HA THR 158 HA THR 158 -4.504 -23.450 8.762 1118 HB THR 158 HB THR 158 -4.550 -21.771 10.480 1119 HG1 THR 158 HG1 THR 158 -5.800 -22.956 11.692 1120 HG21 THR 158 HG21 THR 158 -6.071 -20.071 10.813 1121 HG22 THR 158 HG22 THR 158 -7.316 -20.870 9.858 1122 HG23 THR 158 HG23 THR 158 -5.947 -20.106 9.054 1123 H GLU 159 H GLU 159 -7.105 -21.237 8.003 1124 HA GLU 159 HA GLU 159 -8.982 -23.286 7.405 1125 HB2 GLU 159 HB2 GLU 159 -9.041 -20.299 7.255 1126 HB3 GLU 159 HB3 GLU 159 -10.339 -21.242 6.537 1127 HG2 GLU 159 HG2 GLU 159 -10.808 -22.268 8.691 1128 HG3 GLU 159 HG3 GLU 159 -9.488 -21.358 9.421 Start of MODEL 9 1 H1 MET 1 H1 MET 1 -5.975 -32.760 -22.667 2 H2 MET 1 H2 MET 1 -7.256 -33.063 -21.604 3 H3 MET 1 H3 MET 1 -5.777 -32.499 -21.007 4 HA MET 1 HA MET 1 -7.598 -31.006 -22.803 5 HB2 MET 1 HB2 MET 1 -7.095 -30.881 -19.836 6 HB3 MET 1 HB3 MET 1 -7.716 -29.492 -20.717 7 HG2 MET 1 HG2 MET 1 -9.643 -30.796 -21.438 8 HG3 MET 1 HG3 MET 1 -9.017 -32.202 -20.580 9 HE1 MET 1 HE1 MET 1 -12.149 -31.067 -18.467 10 HE2 MET 1 HE2 MET 1 -11.459 -32.334 -19.483 11 HE3 MET 1 HE3 MET 1 -11.988 -30.815 -20.205 12 H ARG 2 H ARG 2 -6.889 -29.053 -23.524 13 HA ARG 2 HA ARG 2 -4.031 -28.487 -23.126 14 HB2 ARG 2 HB2 ARG 2 -4.203 -27.218 -25.297 15 HB3 ARG 2 HB3 ARG 2 -4.427 -28.952 -25.424 16 HG2 ARG 2 HG2 ARG 2 -6.352 -28.614 -26.491 17 HG3 ARG 2 HG3 ARG 2 -6.994 -27.790 -25.070 18 HD2 ARG 2 HD2 ARG 2 -7.211 -26.251 -26.834 19 HD3 ARG 2 HD3 ARG 2 -5.804 -25.712 -25.921 20 HE ARG 2 HE ARG 2 -5.061 -27.441 -28.057 21 HH11 ARG 2 HH11 ARG 2 -6.027 -24.115 -27.372 22 HH12 ARG 2 HH12 ARG 2 -5.177 -23.464 -28.821 23 HH21 ARG 2 HH21 ARG 2 -3.994 -26.637 -29.887 24 HH22 ARG 2 HH22 ARG 2 -4.046 -24.868 -30.217 25 H GLY 3 H GLY 3 -7.200 -26.899 -23.404 26 HA2 GLY 3 HA2 GLY 3 -7.688 -25.208 -21.664 27 HA3 GLY 3 HA3 GLY 3 -6.071 -24.582 -21.952 28 H SER 4 H SER 4 -8.561 -23.146 -22.080 29 HA SER 4 HA SER 4 -8.621 -22.413 -24.936 30 HB2 SER 4 HB2 SER 4 -10.809 -22.166 -22.858 31 HB3 SER 4 HB3 SER 4 -10.914 -21.546 -24.506 32 HG SER 4 HG SER 4 -10.928 -24.191 -23.587 33 H HIS 5 H HIS 5 -8.109 -20.391 -25.488 34 HA HIS 5 HA HIS 5 -7.607 -18.459 -23.325 35 HB2 HIS 5 HB2 HIS 5 -6.018 -17.376 -24.988 36 HB3 HIS 5 HB3 HIS 5 -5.527 -18.941 -24.357 37 HD1 HIS 5 HD1 HIS 5 -6.490 -17.194 -27.499 38 HD2 HIS 5 HD2 HIS 5 -5.538 -21.044 -26.257 39 HE1 HIS 5 HE1 HIS 5 -6.093 -18.503 -29.610 40 HE2 HIS 5 HE2 HIS 5 -5.517 -20.830 -28.835 41 H HIS 6 H HIS 6 -8.891 -16.774 -23.201 42 HA HIS 6 HA HIS 6 -10.091 -15.664 -25.644 43 HB2 HIS 6 HB2 HIS 6 -11.511 -16.372 -23.078 44 HB3 HIS 6 HB3 HIS 6 -12.169 -15.207 -24.223 45 HD1 HIS 6 HD1 HIS 6 -12.384 -16.283 -26.784 46 HD2 HIS 6 HD2 HIS 6 -12.348 -18.895 -23.551 47 HE1 HIS 6 HE1 HIS 6 -13.383 -18.426 -27.640 48 HE2 HIS 6 HE2 HIS 6 -13.353 -19.993 -25.667 49 H HIS 7 H HIS 7 -10.290 -13.467 -25.711 50 HA HIS 7 HA HIS 7 -9.384 -11.942 -23.361 51 HB2 HIS 7 HB2 HIS 7 -8.525 -11.609 -26.237 52 HB3 HIS 7 HB3 HIS 7 -8.298 -10.351 -25.027 53 HD1 HIS 7 HD1 HIS 7 -6.398 -10.651 -23.357 54 HD2 HIS 7 HD2 HIS 7 -6.897 -13.909 -25.887 55 HE1 HIS 7 HE1 HIS 7 -4.369 -12.094 -23.003 56 HE2 HIS 7 HE2 HIS 7 -4.693 -14.062 -24.544 57 H HIS 8 H HIS 8 -10.962 -10.679 -22.680 58 HA HIS 8 HA HIS 8 -12.597 -9.221 -24.633 59 HB2 HIS 8 HB2 HIS 8 -13.598 -11.401 -23.297 60 HB3 HIS 8 HB3 HIS 8 -14.090 -10.075 -22.248 61 HD1 HIS 8 HD1 HIS 8 -14.528 -11.360 -25.762 62 HD2 HIS 8 HD2 HIS 8 -16.173 -8.531 -23.200 63 HE1 HIS 8 HE1 HIS 8 -16.598 -10.528 -26.921 64 HE2 HIS 8 HE2 HIS 8 -17.580 -8.817 -25.352 65 H HIS 9 H HIS 9 -11.620 -9.551 -21.231 66 HA HIS 9 HA HIS 9 -11.956 -6.638 -20.912 67 HB2 HIS 9 HB2 HIS 9 -12.447 -8.905 -19.015 68 HB3 HIS 9 HB3 HIS 9 -12.019 -7.318 -18.386 69 HD1 HIS 9 HD1 HIS 9 -14.750 -9.127 -20.215 70 HD2 HIS 9 HD2 HIS 9 -14.019 -5.395 -18.538 71 HE1 HIS 9 HE1 HIS 9 -16.976 -7.957 -20.183 72 HE2 HIS 9 HE2 HIS 9 -16.510 -5.700 -19.163 73 H HIS 10 H HIS 10 -10.394 -5.486 -19.786 74 HA HIS 10 HA HIS 10 -7.737 -6.748 -19.723 75 HB2 HIS 10 HB2 HIS 10 -8.630 -3.867 -19.910 76 HB3 HIS 10 HB3 HIS 10 -6.958 -4.322 -19.600 77 HD1 HIS 10 HD1 HIS 10 -9.602 -4.474 -22.272 78 HD2 HIS 10 HD2 HIS 10 -5.533 -5.181 -21.814 79 HE1 HIS 10 HE1 HIS 10 -8.711 -4.809 -24.600 80 HE2 HIS 10 HE2 HIS 10 -6.246 -5.235 -24.300 81 H GLY 11 H GLY 11 -6.482 -6.770 -17.894 82 HA2 GLY 11 HA2 GLY 11 -6.329 -5.388 -15.655 83 HA3 GLY 11 HA3 GLY 11 -7.862 -6.201 -15.375 84 H SER 12 H SER 12 -4.615 -7.082 -16.556 85 HA SER 12 HA SER 12 -4.765 -9.633 -15.133 86 HB2 SER 12 HB2 SER 12 -3.176 -8.560 -17.383 87 HB3 SER 12 HB3 SER 12 -2.328 -9.665 -16.291 88 HG SER 12 HG SER 12 -4.864 -10.259 -17.424 89 H ALA 13 H ALA 13 -2.853 -10.414 -13.985 90 HA ALA 13 HA ALA 13 -0.912 -8.585 -13.081 91 HB1 ALA 13 HB1 ALA 13 -2.958 -9.611 -11.120 92 HB2 ALA 13 HB2 ALA 13 -2.593 -7.928 -11.500 93 HB3 ALA 13 HB3 ALA 13 -1.414 -8.912 -10.633 94 H THR 14 H THR 14 0.877 -9.740 -13.253 95 HA THR 14 HA THR 14 0.824 -12.596 -12.968 96 HB THR 14 HB THR 14 1.904 -11.662 -14.941 97 HG1 THR 14 HG1 THR 14 4.133 -12.680 -13.660 98 HG21 THR 14 HG21 THR 14 3.908 -10.446 -13.031 99 HG22 THR 14 HG22 THR 14 2.785 -9.568 -14.069 100 HG23 THR 14 HG23 THR 14 4.088 -10.517 -14.785 101 H TYR 15 H TYR 15 1.070 -10.307 -10.750 102 HA TYR 15 HA TYR 15 3.256 -11.447 -9.272 103 HB2 TYR 15 HB2 TYR 15 2.246 -8.811 -9.552 104 HB3 TYR 15 HB3 TYR 15 2.276 -9.278 -7.856 105 HD1 TYR 15 HD1 TYR 15 4.516 -10.324 -7.007 106 HD2 TYR 15 HD2 TYR 15 4.179 -7.993 -10.550 107 HE1 TYR 15 HE1 TYR 15 6.931 -9.863 -6.924 108 HE2 TYR 15 HE2 TYR 15 6.592 -7.529 -10.480 109 HH TYR 15 HH TYR 15 8.410 -7.471 -8.800 110 H THR 16 H THR 16 3.090 -12.438 -7.461 111 HA THR 16 HA THR 16 0.426 -13.234 -6.685 112 HB THR 16 HB THR 16 1.570 -15.004 -5.338 113 HG1 THR 16 HG1 THR 16 3.941 -14.343 -6.726 114 HG21 THR 16 HG21 THR 16 2.392 -16.304 -7.315 115 HG22 THR 16 HG22 THR 16 2.178 -14.848 -8.287 116 HG23 THR 16 HG23 THR 16 0.785 -15.606 -7.516 117 H ARG 17 H ARG 17 0.432 -13.905 -4.152 118 HA ARG 17 HA ARG 17 0.412 -11.475 -2.712 119 HB2 ARG 17 HB2 ARG 17 -0.935 -13.895 -2.625 120 HB3 ARG 17 HB3 ARG 17 0.015 -13.893 -1.150 121 HG2 ARG 17 HG2 ARG 17 -1.291 -12.353 -0.176 122 HG3 ARG 17 HG3 ARG 17 -1.437 -11.393 -1.647 123 HD2 ARG 17 HD2 ARG 17 -3.576 -12.407 -0.817 124 HD3 ARG 17 HD3 ARG 17 -3.172 -12.779 -2.489 125 HE ARG 17 HE ARG 17 -2.187 -14.915 -1.248 126 HH11 ARG 17 HH11 ARG 17 -5.303 -13.303 -0.845 127 HH12 ARG 17 HH12 ARG 17 -6.141 -14.821 -0.361 128 HH21 ARG 17 HH21 ARG 17 -4.989 -16.784 -0.240 129 HH22 ARG 17 HH22 ARG 17 -3.230 -16.835 -0.628 130 HA PRO 18 HA PRO 18 4.663 -12.122 -1.102 131 HB2 PRO 18 HB2 PRO 18 4.123 -9.584 0.293 132 HB3 PRO 18 HB3 PRO 18 5.428 -9.985 -0.835 133 HG2 PRO 18 HG2 PRO 18 3.443 -8.335 -1.539 134 HG3 PRO 18 HG3 PRO 18 4.186 -9.456 -2.697 135 HD2 PRO 18 HD2 PRO 18 1.570 -9.682 -1.272 136 HD3 PRO 18 HD3 PRO 18 1.993 -10.110 -2.944 137 H LEU 19 H LEU 19 1.717 -11.404 0.607 138 HA LEU 19 HA LEU 19 2.674 -12.775 2.981 139 HB2 LEU 19 HB2 LEU 19 1.978 -10.048 2.842 140 HB3 LEU 19 HB3 LEU 19 0.739 -10.856 3.735 141 HG LEU 19 HG LEU 19 2.490 -9.770 5.112 142 HD11 LEU 19 HD11 LEU 19 1.978 -12.732 5.341 143 HD12 LEU 19 HD12 LEU 19 1.209 -11.401 6.218 144 HD13 LEU 19 HD13 LEU 19 2.884 -11.842 6.566 145 HD21 LEU 19 HD21 LEU 19 4.383 -10.442 3.557 146 HD22 LEU 19 HD22 LEU 19 4.292 -12.039 4.302 147 HD23 LEU 19 HD23 LEU 19 4.678 -10.627 5.286 148 H ASP 20 H ASP 20 0.632 -12.728 4.424 149 HA ASP 20 HA ASP 20 -1.671 -13.733 3.006 150 HB2 ASP 20 HB2 ASP 20 0.025 -15.175 4.744 151 HB3 ASP 20 HB3 ASP 20 -1.547 -14.989 5.505 152 H THR 21 H THR 21 -0.243 -11.950 5.489 153 HA THR 21 HA THR 21 -2.506 -10.449 6.090 154 HB THR 21 HB THR 21 -3.067 -12.567 7.295 155 HG1 THR 21 HG1 THR 21 -2.831 -10.689 9.333 156 HG21 THR 21 HG21 THR 21 -1.988 -12.997 9.486 157 HG22 THR 21 HG22 THR 21 -0.770 -11.783 9.098 158 HG23 THR 21 HG23 THR 21 -0.895 -13.249 8.125 159 H GLY 22 H GLY 22 -1.943 -9.476 8.500 160 HA2 GLY 22 HA2 GLY 22 0.680 -8.932 9.249 161 HA3 GLY 22 HA3 GLY 22 0.136 -7.643 8.183 162 H ASN 23 H ASN 23 0.272 -8.680 11.365 163 HA ASN 23 HA ASN 23 -1.395 -6.539 12.290 164 HB2 ASN 23 HB2 ASN 23 -2.624 -8.132 13.889 165 HB3 ASN 23 HB3 ASN 23 -3.162 -8.091 12.217 166 HD21 ASN 23 HD21 ASN 23 -2.344 -9.765 10.790 167 HD22 ASN 23 HD22 ASN 23 -2.010 -11.333 11.425 168 H ILE 24 H ILE 24 -0.555 -5.542 13.811 169 HA ILE 24 HA ILE 24 1.485 -6.860 15.437 170 HB ILE 24 HB ILE 24 1.195 -4.002 15.775 171 HG12 ILE 24 HG12 ILE 24 2.654 -3.641 13.624 172 HG13 ILE 24 HG13 ILE 24 1.881 -5.129 13.095 173 HG21 ILE 24 HG21 ILE 24 3.030 -5.632 16.610 174 HG22 ILE 24 HG22 ILE 24 3.471 -3.999 16.113 175 HG23 ILE 24 HG23 ILE 24 3.728 -5.350 15.016 176 HD11 ILE 24 HD11 ILE 24 0.456 -3.575 12.226 177 HD12 ILE 24 HD12 ILE 24 0.698 -2.454 13.565 178 HD13 ILE 24 HD13 ILE 24 -0.304 -3.897 13.791 179 H THR 25 H THR 25 -0.677 -7.697 16.137 180 HA THR 25 HA THR 25 -1.770 -6.175 18.392 181 HB THR 25 HB THR 25 -3.460 -6.936 16.863 182 HG1 THR 25 HG1 THR 25 -3.980 -7.055 19.107 183 HG21 THR 25 HG21 THR 25 -3.858 -9.168 16.188 184 HG22 THR 25 HG22 THR 25 -2.707 -9.806 17.362 185 HG23 THR 25 HG23 THR 25 -2.129 -8.895 15.966 186 H THR 26 H THR 26 0.005 -9.019 17.576 187 HA THR 26 HA THR 26 0.113 -9.823 20.408 188 HB THR 26 HB THR 26 0.801 -11.697 18.164 189 HG1 THR 26 HG1 THR 26 -1.306 -12.260 17.956 190 HG21 THR 26 HG21 THR 26 -0.211 -12.132 20.980 191 HG22 THR 26 HG22 THR 26 1.435 -12.401 20.406 192 HG23 THR 26 HG23 THR 26 0.118 -13.410 19.807 193 H GLY 27 H GLY 27 2.078 -10.291 17.543 194 HA2 GLY 27 HA2 GLY 27 4.348 -8.871 18.546 195 HA3 GLY 27 HA3 GLY 27 4.557 -10.609 18.709 196 H PHE 28 H PHE 28 5.295 -8.081 16.796 197 HA PHE 28 HA PHE 28 4.813 -9.182 14.229 198 HB2 PHE 28 HB2 PHE 28 5.371 -6.659 15.145 199 HB3 PHE 28 HB3 PHE 28 6.840 -7.106 14.285 200 HD1 PHE 28 HD1 PHE 28 3.113 -7.197 13.830 201 HD2 PHE 28 HD2 PHE 28 6.933 -6.778 12.018 202 HE1 PHE 28 HE1 PHE 28 2.038 -6.769 11.658 203 HE2 PHE 28 HE2 PHE 28 5.871 -6.334 9.853 204 HZ PHE 28 HZ PHE 28 3.418 -6.340 9.675 205 H ASN 29 H ASN 29 6.334 -9.573 12.611 206 HA ASN 29 HA ASN 29 7.911 -11.719 13.152 207 HB2 ASN 29 HB2 ASN 29 7.643 -9.913 10.807 208 HB3 ASN 29 HB3 ASN 29 8.679 -11.319 10.755 209 HD21 ASN 29 HD21 ASN 29 5.561 -10.113 10.528 210 HD22 ASN 29 HD22 ASN 29 4.730 -11.602 10.293 211 H GLY 30 H GLY 30 8.884 -9.485 14.698 212 HA2 GLY 30 HA2 GLY 30 11.140 -9.398 15.557 213 HA3 GLY 30 HA3 GLY 30 11.727 -9.689 13.923 214 H TYR 31 H TYR 31 9.250 -7.686 13.507 215 HA TYR 31 HA TYR 31 10.978 -5.278 13.551 216 HB2 TYR 31 HB2 TYR 31 8.305 -5.451 12.158 217 HB3 TYR 31 HB3 TYR 31 9.608 -4.320 11.870 218 HD1 TYR 31 HD1 TYR 31 11.223 -4.737 10.223 219 HD2 TYR 31 HD2 TYR 31 8.654 -7.903 11.446 220 HE1 TYR 31 HE1 TYR 31 12.039 -6.120 8.363 221 HE2 TYR 31 HE2 TYR 31 9.466 -9.287 9.587 222 HH TYR 31 HH TYR 31 10.507 -8.917 7.338 223 HA PRO 32 HA PRO 32 8.090 -4.557 17.115 224 HB2 PRO 32 HB2 PRO 32 10.273 -3.259 18.495 225 HB3 PRO 32 HB3 PRO 32 9.459 -4.771 18.907 226 HG2 PRO 32 HG2 PRO 32 12.049 -4.650 18.070 227 HG3 PRO 32 HG3 PRO 32 11.001 -6.063 17.836 228 HD2 PRO 32 HD2 PRO 32 11.731 -3.916 15.884 229 HD3 PRO 32 HD3 PRO 32 11.593 -5.670 15.639 230 H GLY 33 H GLY 33 6.878 -2.787 17.455 231 HA2 GLY 33 HA2 GLY 33 6.454 -0.482 17.781 232 HA3 GLY 33 HA3 GLY 33 8.009 -0.112 17.056 233 H HIS 34 H HIS 34 6.462 -2.334 15.144 234 HA HIS 34 HA HIS 34 5.982 -0.503 13.054 235 HB2 HIS 34 HB2 HIS 34 6.883 -2.953 12.979 236 HB3 HIS 34 HB3 HIS 34 5.183 -3.400 13.013 237 HD1 HIS 34 HD1 HIS 34 4.508 -4.004 10.702 238 HD2 HIS 34 HD2 HIS 34 7.091 -0.769 10.738 239 HE1 HIS 34 HE1 HIS 34 4.725 -3.222 8.310 240 H VAL 35 H VAL 35 4.070 0.232 12.309 241 HA VAL 35 HA VAL 35 1.679 -0.374 13.900 242 HB VAL 35 HB VAL 35 1.013 1.805 12.351 243 HG11 VAL 35 HG11 VAL 35 1.625 3.057 14.604 244 HG12 VAL 35 HG12 VAL 35 1.809 1.404 15.187 245 HG13 VAL 35 HG13 VAL 35 0.265 1.940 14.514 246 HG21 VAL 35 HG21 VAL 35 3.852 2.192 13.282 247 HG22 VAL 35 HG22 VAL 35 2.791 3.464 12.677 248 HG23 VAL 35 HG23 VAL 35 3.294 2.154 11.609 249 H GLY 36 H GLY 36 3.040 -0.734 10.774 250 HA2 GLY 36 HA2 GLY 36 0.411 -1.539 9.701 251 HA3 GLY 36 HA3 GLY 36 1.661 -0.788 8.717 252 H VAL 37 H VAL 37 1.736 -2.485 7.305 253 HA VAL 37 HA VAL 37 3.157 -4.842 8.292 254 HB VAL 37 HB VAL 37 0.824 -5.502 7.946 255 HG11 VAL 37 HG11 VAL 37 -0.059 -4.086 6.331 256 HG12 VAL 37 HG12 VAL 37 0.018 -5.650 5.520 257 HG13 VAL 37 HG13 VAL 37 1.239 -4.424 5.193 258 HG21 VAL 37 HG21 VAL 37 2.316 -7.287 7.637 259 HG22 VAL 37 HG22 VAL 37 2.847 -6.686 6.068 260 HG23 VAL 37 HG23 VAL 37 1.228 -7.363 6.249 261 H ASP 38 H ASP 38 4.662 -5.782 6.836 262 HA ASP 38 HA ASP 38 5.310 -4.119 4.493 263 HB2 ASP 38 HB2 ASP 38 7.227 -5.197 6.572 264 HB3 ASP 38 HB3 ASP 38 7.738 -4.503 5.033 265 H TYR 39 H TYR 39 5.827 -5.031 2.691 266 HA TYR 39 HA TYR 39 6.028 -7.970 2.548 267 HB2 TYR 39 HB2 TYR 39 4.795 -6.319 0.358 268 HB3 TYR 39 HB3 TYR 39 4.674 -8.037 0.624 269 HD1 TYR 39 HD1 TYR 39 3.638 -4.786 2.052 270 HD2 TYR 39 HD2 TYR 39 2.721 -8.915 1.657 271 HE1 TYR 39 HE1 TYR 39 1.439 -4.389 3.034 272 HE2 TYR 39 HE2 TYR 39 0.509 -8.519 2.653 273 HH TYR 39 HH TYR 39 -0.570 -6.868 4.136 274 H ALA 40 H ALA 40 8.067 -8.340 2.023 275 HA ALA 40 HA ALA 40 9.896 -6.698 0.793 276 HB1 ALA 40 HB1 ALA 40 9.897 -9.703 0.722 277 HB2 ALA 40 HB2 ALA 40 10.478 -8.712 2.060 278 HB3 ALA 40 HB3 ALA 40 11.293 -8.648 0.498 279 H VAL 41 H VAL 41 9.589 -5.704 -1.082 280 HA VAL 41 HA VAL 41 9.359 -7.297 -3.486 281 HB VAL 41 HB VAL 41 7.011 -6.747 -2.949 282 HG11 VAL 41 HG11 VAL 41 7.917 -3.883 -3.091 283 HG12 VAL 41 HG12 VAL 41 7.110 -4.710 -1.758 284 HG13 VAL 41 HG13 VAL 41 6.231 -4.375 -3.250 285 HG21 VAL 41 HG21 VAL 41 7.548 -7.059 -5.257 286 HG22 VAL 41 HG22 VAL 41 8.108 -5.394 -5.407 287 HG23 VAL 41 HG23 VAL 41 6.398 -5.727 -5.132 288 HA PRO 42 HA PRO 42 12.839 -4.573 -4.455 289 HB2 PRO 42 HB2 PRO 42 12.014 -5.298 -7.232 290 HB3 PRO 42 HB3 PRO 42 13.619 -5.332 -6.486 291 HG2 PRO 42 HG2 PRO 42 12.288 -7.585 -6.867 292 HG3 PRO 42 HG3 PRO 42 13.231 -7.326 -5.387 293 HD2 PRO 42 HD2 PRO 42 10.281 -7.269 -5.773 294 HD3 PRO 42 HD3 PRO 42 11.235 -7.791 -4.371 295 H VAL 43 H VAL 43 13.224 -2.719 -4.990 296 HA VAL 43 HA VAL 43 11.355 -0.706 -5.207 297 HB VAL 43 HB VAL 43 13.434 -0.353 -4.163 298 HG11 VAL 43 HG11 VAL 43 15.603 -0.318 -5.366 299 HG12 VAL 43 HG12 VAL 43 14.780 -1.045 -6.747 300 HG13 VAL 43 HG13 VAL 43 14.855 -1.907 -5.210 301 HG21 VAL 43 HG21 VAL 43 12.422 1.523 -5.737 302 HG22 VAL 43 HG22 VAL 43 13.958 1.320 -6.568 303 HG23 VAL 43 HG23 VAL 43 13.935 1.782 -4.868 304 H GLY 44 H GLY 44 10.549 0.518 -6.826 305 HA2 GLY 44 HA2 GLY 44 10.680 1.530 -8.979 306 HA3 GLY 44 HA3 GLY 44 11.648 0.171 -9.490 307 H THR 45 H THR 45 9.154 -1.117 -7.770 308 HA THR 45 HA THR 45 7.753 -1.876 -10.144 309 HB THR 45 HB THR 45 6.992 -2.760 -7.381 310 HG1 THR 45 HG1 THR 45 9.301 -3.372 -8.825 311 HG21 THR 45 HG21 THR 45 6.902 -4.135 -10.075 312 HG22 THR 45 HG22 THR 45 5.522 -3.459 -9.210 313 HG23 THR 45 HG23 THR 45 6.384 -4.849 -8.548 314 HA PRO 46 HA PRO 46 4.712 1.401 -9.651 315 HB2 PRO 46 HB2 PRO 46 2.895 -0.354 -11.203 316 HB3 PRO 46 HB3 PRO 46 3.414 1.303 -11.539 317 HG2 PRO 46 HG2 PRO 46 4.349 -0.740 -12.970 318 HG3 PRO 46 HG3 PRO 46 5.376 0.644 -12.547 319 HD2 PRO 46 HD2 PRO 46 5.319 -2.094 -11.358 320 HD3 PRO 46 HD3 PRO 46 6.699 -1.030 -11.694 321 H VAL 47 H VAL 47 3.475 1.747 -7.966 322 HA VAL 47 HA VAL 47 2.039 -0.387 -6.693 323 HB VAL 47 HB VAL 47 2.479 2.362 -5.543 324 HG11 VAL 47 HG11 VAL 47 1.851 -0.273 -4.208 325 HG12 VAL 47 HG12 VAL 47 0.715 1.049 -4.475 326 HG13 VAL 47 HG13 VAL 47 2.084 1.272 -3.388 327 HG21 VAL 47 HG21 VAL 47 4.266 -0.036 -5.435 328 HG22 VAL 47 HG22 VAL 47 4.283 1.184 -4.167 329 HG23 VAL 47 HG23 VAL 47 4.682 1.631 -5.825 330 H ARG 48 H ARG 48 0.088 -0.584 -6.889 331 HA ARG 48 HA ARG 48 -1.497 1.528 -7.986 332 HB2 ARG 48 HB2 ARG 48 -2.052 -1.428 -7.863 333 HB3 ARG 48 HB3 ARG 48 -3.175 -0.247 -8.520 334 HG2 ARG 48 HG2 ARG 48 -2.171 -0.285 -10.495 335 HG3 ARG 48 HG3 ARG 48 -0.583 -0.012 -9.768 336 HD2 ARG 48 HD2 ARG 48 -0.319 -2.364 -9.339 337 HD3 ARG 48 HD3 ARG 48 -1.971 -2.686 -9.865 338 HE ARG 48 HE ARG 48 -0.385 -1.443 -11.897 339 HH11 ARG 48 HH11 ARG 48 -0.717 -5.480 -11.872 340 HH12 ARG 48 HH12 ARG 48 -1.166 -4.542 -10.401 341 HH21 ARG 48 HH21 ARG 48 0.033 -4.404 -13.737 342 HH22 ARG 48 HH22 ARG 48 0.183 -2.608 -13.757 343 H ALA 49 H ALA 49 -3.576 1.990 -7.264 344 HA ALA 49 HA ALA 49 -3.715 2.110 -4.446 345 HB1 ALA 49 HB1 ALA 49 -5.742 2.931 -6.519 346 HB2 ALA 49 HB2 ALA 49 -4.508 3.961 -5.795 347 HB3 ALA 49 HB3 ALA 49 -5.821 3.330 -4.803 348 H VAL 50 H VAL 50 -4.499 0.608 -3.147 349 HA VAL 50 HA VAL 50 -5.746 -1.722 -4.036 350 HB VAL 50 HB VAL 50 -5.665 -0.733 -1.236 351 HG11 VAL 50 HG11 VAL 50 -5.899 -3.563 -2.223 352 HG12 VAL 50 HG12 VAL 50 -7.218 -2.616 -1.534 353 HG13 VAL 50 HG13 VAL 50 -5.826 -3.045 -0.539 354 HG21 VAL 50 HG21 VAL 50 -3.681 -2.421 -2.728 355 HG22 VAL 50 HG22 VAL 50 -3.634 -2.108 -0.995 356 HG23 VAL 50 HG23 VAL 50 -3.434 -0.781 -2.136 357 H ALA 51 H ALA 51 -7.164 1.282 -3.381 358 HA ALA 51 HA ALA 51 -9.720 0.503 -4.181 359 HB1 ALA 51 HB1 ALA 51 -10.175 -0.391 -2.069 360 HB2 ALA 51 HB2 ALA 51 -10.856 1.236 -1.995 361 HB3 ALA 51 HB3 ALA 51 -9.294 0.897 -1.249 362 H ASN 52 H ASN 52 -10.975 2.211 -4.705 363 HA ASN 52 HA ASN 52 -9.805 4.643 -5.241 364 HB2 ASN 52 HB2 ASN 52 -12.243 5.333 -5.660 365 HB3 ASN 52 HB3 ASN 52 -11.566 4.067 -6.620 366 HD21 ASN 52 HD21 ASN 52 -12.720 3.801 -3.360 367 HD22 ASN 52 HD22 ASN 52 -14.028 2.730 -3.696 368 H GLY 53 H GLY 53 -10.379 6.771 -4.521 369 HA2 GLY 53 HA2 GLY 53 -11.918 7.512 -2.373 370 HA3 GLY 53 HA3 GLY 53 -10.406 6.983 -1.659 371 H THR 54 H THR 54 -9.180 8.651 -1.135 372 HA THR 54 HA THR 54 -8.682 10.785 -2.947 373 HB THR 54 HB THR 54 -9.565 11.316 -0.171 374 HG1 THR 54 HG1 THR 54 -11.256 10.529 -1.660 375 HG21 THR 54 HG21 THR 54 -9.156 13.201 -2.495 376 HG22 THR 54 HG22 THR 54 -8.116 13.067 -1.077 377 HG23 THR 54 HG23 THR 54 -9.765 13.670 -0.906 378 H VAL 55 H VAL 55 -6.680 11.678 -2.633 379 HA VAL 55 HA VAL 55 -4.821 10.252 -0.996 380 HB VAL 55 HB VAL 55 -4.218 12.626 -2.759 381 HG11 VAL 55 HG11 VAL 55 -2.427 11.897 -1.237 382 HG12 VAL 55 HG12 VAL 55 -1.991 11.695 -2.934 383 HG13 VAL 55 HG13 VAL 55 -2.475 10.295 -1.974 384 HG21 VAL 55 HG21 VAL 55 -5.415 11.025 -4.142 385 HG22 VAL 55 HG22 VAL 55 -4.322 9.740 -3.630 386 HG23 VAL 55 HG23 VAL 55 -3.715 11.081 -4.598 387 H LYS 56 H LYS 56 -4.658 10.869 0.994 388 HA LYS 56 HA LYS 56 -5.144 13.575 1.866 389 HB2 LYS 56 HB2 LYS 56 -4.451 11.526 3.893 390 HB3 LYS 56 HB3 LYS 56 -5.626 12.821 3.980 391 HG2 LYS 56 HG2 LYS 56 -5.932 10.105 2.741 392 HG3 LYS 56 HG3 LYS 56 -6.840 10.807 4.069 393 HD2 LYS 56 HD2 LYS 56 -6.931 12.079 1.368 394 HD3 LYS 56 HD3 LYS 56 -7.894 10.633 1.673 395 HE2 LYS 56 HE2 LYS 56 -9.353 12.424 2.114 396 HE3 LYS 56 HE3 LYS 56 -8.824 11.881 3.705 397 HZ1 LYS 56 HZ1 LYS 56 -7.723 14.204 2.213 398 HZ2 LYS 56 HZ2 LYS 56 -7.213 13.686 3.741 399 HZ3 LYS 56 HZ3 LYS 56 -8.780 14.287 3.532 400 H PHE 57 H PHE 57 -2.604 11.563 1.121 401 HA PHE 57 HA PHE 57 -0.649 13.492 1.889 402 HB2 PHE 57 HB2 PHE 57 -0.970 11.767 3.857 403 HB3 PHE 57 HB3 PHE 57 -0.049 10.700 2.800 404 HD1 PHE 57 HD1 PHE 57 2.265 11.220 2.210 405 HD2 PHE 57 HD2 PHE 57 0.082 13.604 4.978 406 HE1 PHE 57 HE1 PHE 57 4.364 12.242 2.976 407 HE2 PHE 57 HE2 PHE 57 2.181 14.629 5.754 408 HZ PHE 57 HZ PHE 57 4.326 13.950 4.751 409 H ALA 58 H ALA 58 1.106 13.416 0.661 410 HA ALA 58 HA ALA 58 1.675 11.277 -1.135 411 HB1 ALA 58 HB1 ALA 58 0.130 12.468 -2.524 412 HB2 ALA 58 HB2 ALA 58 1.749 12.826 -3.119 413 HB3 ALA 58 HB3 ALA 58 0.889 14.012 -2.138 414 H GLY 59 H GLY 59 3.529 11.054 -0.050 415 HA2 GLY 59 HA2 GLY 59 5.408 13.269 0.189 416 HA3 GLY 59 HA3 GLY 59 5.574 11.674 0.910 417 H ASN 60 H ASN 60 6.004 13.599 -1.944 418 HA ASN 60 HA ASN 60 7.013 11.592 -3.664 419 HB2 ASN 60 HB2 ASN 60 7.116 14.600 -3.766 420 HB3 ASN 60 HB3 ASN 60 7.802 13.582 -5.026 421 HD21 ASN 60 HD21 ASN 60 4.864 13.213 -3.129 422 HD22 ASN 60 HD22 ASN 60 3.803 13.205 -4.471 423 H GLY 61 H GLY 61 8.795 10.699 -3.736 424 HA2 GLY 61 HA2 GLY 61 11.036 11.402 -2.053 425 HA3 GLY 61 HA3 GLY 61 10.905 9.985 -3.077 426 H ALA 62 H ALA 62 10.131 12.499 -5.020 427 HA ALA 62 HA ALA 62 12.598 12.412 -6.400 428 HB1 ALA 62 HB1 ALA 62 10.213 14.150 -6.926 429 HB2 ALA 62 HB2 ALA 62 10.436 12.516 -7.552 430 HB3 ALA 62 HB3 ALA 62 11.527 13.809 -8.052 431 H ASN 63 H ASN 63 11.084 14.670 -4.264 432 HA ASN 63 HA ASN 63 13.445 16.325 -4.306 433 HB2 ASN 63 HB2 ASN 63 11.234 17.137 -5.657 434 HB3 ASN 63 HB3 ASN 63 11.026 17.880 -4.085 435 HD21 ASN 63 HD21 ASN 63 12.636 17.916 -7.027 436 HD22 ASN 63 HD22 ASN 63 13.659 19.268 -6.734 437 H HIS 64 H HIS 64 12.254 14.380 -2.389 438 HA HIS 64 HA HIS 64 11.235 15.901 -0.284 439 HB2 HIS 64 HB2 HIS 64 11.195 13.803 0.952 440 HB3 HIS 64 HB3 HIS 64 10.416 13.667 -0.596 441 HD1 HIS 64 HD1 HIS 64 13.747 13.386 -1.590 442 HD2 HIS 64 HD2 HIS 64 11.255 10.898 0.617 443 HE1 HIS 64 HE1 HIS 64 14.789 11.100 -1.721 444 HE2 HIS 64 HE2 HIS 64 13.266 9.611 -0.378 445 HA PRO 65 HA PRO 65 15.291 17.021 1.440 446 HB2 PRO 65 HB2 PRO 65 13.555 18.218 3.530 447 HB3 PRO 65 HB3 PRO 65 14.821 18.991 2.552 448 HG2 PRO 65 HG2 PRO 65 12.309 19.545 2.083 449 HG3 PRO 65 HG3 PRO 65 13.415 19.246 0.719 450 HD2 PRO 65 HD2 PRO 65 11.482 17.332 2.012 451 HD3 PRO 65 HD3 PRO 65 11.712 17.741 0.311 452 H TRP 66 H TRP 66 16.366 16.629 3.416 453 HA TRP 66 HA TRP 66 15.239 14.409 4.897 454 HB2 TRP 66 HB2 TRP 66 18.042 15.513 4.958 455 HB3 TRP 66 HB3 TRP 66 17.457 14.137 5.883 456 HD1 TRP 66 HD1 TRP 66 17.930 15.146 2.164 457 HE1 TRP 66 HE1 TRP 66 18.450 13.015 0.819 458 HE3 TRP 66 HE3 TRP 66 17.462 11.670 5.901 459 HZ2 TRP 66 HZ2 TRP 66 18.640 10.239 1.272 460 HZ3 TRP 66 HZ3 TRP 66 17.829 9.300 5.354 461 HH2 TRP 66 HH2 TRP 66 18.405 8.601 3.087 462 H MET 67 H MET 67 14.901 17.521 4.957 463 HA MET 67 HA MET 67 15.640 18.255 7.591 464 HB2 MET 67 HB2 MET 67 13.959 19.575 5.485 465 HB3 MET 67 HB3 MET 67 14.124 20.269 7.090 466 HG2 MET 67 HG2 MET 67 15.659 21.353 5.615 467 HG3 MET 67 HG3 MET 67 16.569 20.366 6.756 468 HE1 MET 67 HE1 MET 67 18.672 20.733 5.068 469 HE2 MET 67 HE2 MET 67 17.629 21.615 3.952 470 HE3 MET 67 HE3 MET 67 18.620 20.279 3.364 471 H LEU 68 H LEU 68 12.653 17.387 5.970 472 HA LEU 68 HA LEU 68 11.558 16.871 8.634 473 HB2 LEU 68 HB2 LEU 68 9.338 17.487 7.893 474 HB3 LEU 68 HB3 LEU 68 10.445 18.815 7.660 475 HG LEU 68 HG LEU 68 10.510 17.757 5.185 476 HD11 LEU 68 HD11 LEU 68 7.720 17.202 6.236 477 HD12 LEU 68 HD12 LEU 68 8.896 15.989 5.732 478 HD13 LEU 68 HD13 LEU 68 8.228 17.112 4.549 479 HD21 LEU 68 HD21 LEU 68 8.849 19.483 4.590 480 HD22 LEU 68 HD22 LEU 68 10.074 20.079 5.709 481 HD23 LEU 68 HD23 LEU 68 8.463 19.679 6.300 482 H TRP 69 H TRP 69 12.994 15.263 6.315 483 HA TRP 69 HA TRP 69 11.019 13.085 6.436 484 HB2 TRP 69 HB2 TRP 69 12.759 13.402 4.009 485 HB3 TRP 69 HB3 TRP 69 11.287 12.458 4.185 486 HD1 TRP 69 HD1 TRP 69 12.103 16.250 4.504 487 HE1 TRP 69 HE1 TRP 69 10.308 17.574 3.267 488 HE3 TRP 69 HE3 TRP 69 9.273 12.358 2.775 489 HZ2 TRP 69 HZ2 TRP 69 8.023 17.064 1.711 490 HZ3 TRP 69 HZ3 TRP 69 7.307 12.880 1.407 491 HH2 TRP 69 HH2 TRP 69 6.690 15.182 0.885 492 H MET 70 H MET 70 11.734 11.024 6.654 493 HA MET 70 HA MET 70 14.583 10.448 6.668 494 HB2 MET 70 HB2 MET 70 14.461 9.340 8.914 495 HB3 MET 70 HB3 MET 70 14.342 11.089 8.962 496 HG2 MET 70 HG2 MET 70 11.937 9.286 9.079 497 HG3 MET 70 HG3 MET 70 12.818 9.812 10.511 498 HE1 MET 70 HE1 MET 70 9.794 10.325 10.403 499 HE2 MET 70 HE2 MET 70 9.668 12.028 10.842 500 HE3 MET 70 HE3 MET 70 10.817 10.984 11.680 501 H ALA 71 H ALA 71 11.260 9.393 6.736 502 HA ALA 71 HA ALA 71 11.884 6.585 6.384 503 HB1 ALA 71 HB1 ALA 71 9.955 7.274 7.722 504 HB2 ALA 71 HB2 ALA 71 9.483 6.249 6.366 505 HB3 ALA 71 HB3 ALA 71 9.226 7.993 6.287 506 H GLY 72 H GLY 72 11.347 9.291 4.378 507 HA2 GLY 72 HA2 GLY 72 11.876 9.302 2.072 508 HA3 GLY 72 HA3 GLY 72 11.536 7.586 2.010 509 H ASN 73 H ASN 73 9.978 7.275 0.594 510 HA ASN 73 HA ASN 73 7.938 9.186 0.041 511 HB2 ASN 73 HB2 ASN 73 8.536 6.450 -1.049 512 HB3 ASN 73 HB3 ASN 73 7.144 7.395 -1.563 513 HD21 ASN 73 HD21 ASN 73 10.655 7.398 -1.376 514 HD22 ASN 73 HD22 ASN 73 10.905 8.406 -2.754 515 H ALA 74 H ALA 74 5.781 9.048 0.436 516 HA ALA 74 HA ALA 74 4.622 6.728 1.638 517 HB1 ALA 74 HB1 ALA 74 4.781 9.295 3.203 518 HB2 ALA 74 HB2 ALA 74 5.521 7.750 3.627 519 HB3 ALA 74 HB3 ALA 74 3.766 7.919 3.636 520 H VAL 75 H VAL 75 2.366 6.664 1.559 521 HA VAL 75 HA VAL 75 0.995 8.944 0.357 522 HB VAL 75 HB VAL 75 0.265 6.262 -0.741 523 HG11 VAL 75 HG11 VAL 75 -0.591 7.473 -2.559 524 HG12 VAL 75 HG12 VAL 75 0.352 8.908 -2.157 525 HG13 VAL 75 HG13 VAL 75 -0.999 8.425 -1.129 526 HG21 VAL 75 HG21 VAL 75 2.460 7.886 -1.995 527 HG22 VAL 75 HG22 VAL 75 1.817 6.343 -2.553 528 HG23 VAL 75 HG23 VAL 75 2.737 6.428 -1.049 529 H LEU 76 H LEU 76 -0.738 9.346 1.505 530 HA LEU 76 HA LEU 76 -2.134 7.127 2.780 531 HB2 LEU 76 HB2 LEU 76 -1.019 9.279 4.057 532 HB3 LEU 76 HB3 LEU 76 -2.685 9.759 3.910 533 HG LEU 76 HG LEU 76 -2.566 7.064 4.886 534 HD11 LEU 76 HD11 LEU 76 -0.926 9.049 6.455 535 HD12 LEU 76 HD12 LEU 76 -0.316 7.606 5.644 536 HD13 LEU 76 HD13 LEU 76 -1.422 7.449 7.008 537 HD21 LEU 76 HD21 LEU 76 -3.436 9.685 6.095 538 HD22 LEU 76 HD22 LEU 76 -3.733 8.106 6.819 539 HD23 LEU 76 HD23 LEU 76 -4.446 8.508 5.256 540 H ILE 77 H ILE 77 -4.072 6.922 2.357 541 HA ILE 77 HA ILE 77 -5.601 8.859 0.899 542 HB ILE 77 HB ILE 77 -4.876 6.120 -0.050 543 HG12 ILE 77 HG12 ILE 77 -5.047 8.435 -1.873 544 HG13 ILE 77 HG13 ILE 77 -3.763 8.456 -0.667 545 HG21 ILE 77 HG21 ILE 77 -6.567 6.112 -1.752 546 HG22 ILE 77 HG22 ILE 77 -7.124 7.713 -1.266 547 HG23 ILE 77 HG23 ILE 77 -7.361 6.334 -0.193 548 HD11 ILE 77 HD11 ILE 77 -4.215 6.246 -2.659 549 HD12 ILE 77 HD12 ILE 77 -2.878 6.382 -1.516 550 HD13 ILE 77 HD13 ILE 77 -3.038 7.548 -2.830 551 H GLN 78 H GLN 78 -7.766 8.559 1.023 552 HA GLN 78 HA GLN 78 -8.769 6.959 3.182 553 HB2 GLN 78 HB2 GLN 78 -9.245 9.329 3.348 554 HB3 GLN 78 HB3 GLN 78 -9.962 9.333 1.749 555 HG2 GLN 78 HG2 GLN 78 -11.429 7.424 3.010 556 HG3 GLN 78 HG3 GLN 78 -11.128 8.557 4.314 557 HE21 GLN 78 HE21 GLN 78 -12.475 8.036 1.238 558 HE22 GLN 78 HE22 GLN 78 -13.516 9.401 1.188 559 H HIS 79 H HIS 79 -9.619 5.150 2.637 560 HA HIS 79 HA HIS 79 -10.221 4.349 0.011 561 HB2 HIS 79 HB2 HIS 79 -10.399 3.070 2.671 562 HB3 HIS 79 HB3 HIS 79 -11.253 2.325 1.325 563 HD1 HIS 79 HD1 HIS 79 -8.952 3.160 -0.758 564 HD2 HIS 79 HD2 HIS 79 -8.484 1.008 2.763 565 HE1 HIS 79 HE1 HIS 79 -6.798 1.877 -1.034 566 HE2 HIS 79 HE2 HIS 79 -6.552 0.561 1.100 567 H ALA 80 H ALA 80 -12.280 2.810 -0.078 568 HA ALA 80 HA ALA 80 -14.327 4.552 -0.708 569 HB1 ALA 80 HB1 ALA 80 -15.530 2.685 -1.534 570 HB2 ALA 80 HB2 ALA 80 -14.609 1.582 -0.513 571 HB3 ALA 80 HB3 ALA 80 -13.818 2.406 -1.858 572 H ASP 81 H ASP 81 -13.703 3.041 2.251 573 HA ASP 81 HA ASP 81 -16.442 3.308 3.148 574 HB2 ASP 81 HB2 ASP 81 -14.427 1.411 3.713 575 HB3 ASP 81 HB3 ASP 81 -14.917 2.193 5.204 576 H GLY 82 H GLY 82 -13.516 4.876 3.172 577 HA2 GLY 82 HA2 GLY 82 -13.439 7.152 3.947 578 HA3 GLY 82 HA3 GLY 82 -14.429 6.670 5.313 579 H MET 83 H MET 83 -12.447 4.160 5.045 580 HA MET 83 HA MET 83 -10.861 4.811 7.211 581 HB2 MET 83 HB2 MET 83 -9.735 2.613 6.574 582 HB3 MET 83 HB3 MET 83 -11.407 2.574 7.029 583 HG2 MET 83 HG2 MET 83 -11.719 2.777 4.401 584 HG3 MET 83 HG3 MET 83 -10.128 2.019 4.428 585 HE1 MET 83 HE1 MET 83 -11.007 -0.018 3.078 586 HE2 MET 83 HE2 MET 83 -12.646 0.615 3.009 587 HE3 MET 83 HE3 MET 83 -12.364 -1.036 3.557 588 H HIS 84 H HIS 84 -8.383 4.484 7.170 589 HA HIS 84 HA HIS 84 -7.411 5.985 4.891 590 HB2 HIS 84 HB2 HIS 84 -6.506 6.048 7.759 591 HB3 HIS 84 HB3 HIS 84 -5.523 6.707 6.459 592 HD1 HIS 84 HD1 HIS 84 -6.076 9.036 5.673 593 HD2 HIS 84 HD2 HIS 84 -8.987 7.448 8.171 594 HE1 HIS 84 HE1 HIS 84 -7.627 10.947 6.202 595 HE2 HIS 84 HE2 HIS 84 -9.387 9.959 7.705 596 H THR 85 H THR 85 -5.457 5.364 3.887 597 HA THR 85 HA THR 85 -4.193 2.946 4.871 598 HB THR 85 HB THR 85 -4.118 2.673 2.137 599 HG1 THR 85 HG1 THR 85 -5.831 4.224 1.961 600 HG21 THR 85 HG21 THR 85 -5.597 0.746 2.511 601 HG22 THR 85 HG22 THR 85 -6.014 1.389 4.098 602 HG23 THR 85 HG23 THR 85 -4.361 0.871 3.760 603 H GLY 86 H GLY 86 -2.112 3.158 4.896 604 HA2 GLY 86 HA2 GLY 86 -0.857 5.324 3.371 605 HA3 GLY 86 HA3 GLY 86 -0.193 4.576 4.818 606 H TYR 87 H TYR 87 1.125 4.979 2.334 607 HA TYR 87 HA TYR 87 1.904 2.273 1.692 608 HB2 TYR 87 HB2 TYR 87 1.582 4.463 -0.393 609 HB3 TYR 87 HB3 TYR 87 2.062 2.801 -0.689 610 HD1 TYR 87 HD1 TYR 87 0.452 1.329 -1.513 611 HD2 TYR 87 HD2 TYR 87 -0.869 4.728 0.704 612 HE1 TYR 87 HE1 TYR 87 -1.903 0.751 -2.009 613 HE2 TYR 87 HE2 TYR 87 -3.199 4.138 0.220 614 HH TYR 87 HH TYR 87 -4.118 1.137 -1.069 615 H ALA 88 H ALA 88 3.799 2.393 2.823 616 HA ALA 88 HA ALA 88 5.499 4.744 2.314 617 HB1 ALA 88 HB1 ALA 88 6.536 4.358 4.503 618 HB2 ALA 88 HB2 ALA 88 5.433 3.013 4.778 619 HB3 ALA 88 HB3 ALA 88 4.801 4.647 4.624 620 H HIS 89 H HIS 89 7.859 4.346 2.662 621 HA HIS 89 HA HIS 89 9.816 3.483 1.959 622 HB2 HIS 89 HB2 HIS 89 8.369 0.890 2.503 623 HB3 HIS 89 HB3 HIS 89 10.026 0.920 1.908 624 HD1 HIS 89 HD1 HIS 89 11.594 2.657 3.506 625 HD2 HIS 89 HD2 HIS 89 8.297 0.782 5.203 626 HE1 HIS 89 HE1 HIS 89 11.968 2.753 5.989 627 HE2 HIS 89 HE2 HIS 89 9.966 1.605 6.997 628 H LEU 90 H LEU 90 8.123 4.433 0.044 629 HA LEU 90 HA LEU 90 8.474 2.738 -2.280 630 HB2 LEU 90 HB2 LEU 90 6.975 5.326 -2.244 631 HB3 LEU 90 HB3 LEU 90 6.815 3.997 -3.365 632 HG LEU 90 HG LEU 90 5.981 3.813 -0.466 633 HD11 LEU 90 HD11 LEU 90 4.747 5.578 -1.726 634 HD12 LEU 90 HD12 LEU 90 3.742 4.255 -1.143 635 HD13 LEU 90 HD13 LEU 90 4.205 4.324 -2.841 636 HD21 LEU 90 HD21 LEU 90 6.218 1.649 -1.221 637 HD22 LEU 90 HD22 LEU 90 5.693 2.049 -2.852 638 HD23 LEU 90 HD23 LEU 90 4.515 1.980 -1.545 639 H SER 91 H SER 91 9.072 3.991 -4.346 640 HA SER 91 HA SER 91 11.376 5.619 -3.734 641 HB2 SER 91 HB2 SER 91 11.640 3.482 -5.072 642 HB3 SER 91 HB3 SER 91 10.790 4.305 -6.372 643 HG SER 91 HG SER 91 13.366 4.454 -5.724 644 H LYS 92 H LYS 92 8.251 5.844 -5.038 645 HA LYS 92 HA LYS 92 8.504 8.566 -5.644 646 HB2 LYS 92 HB2 LYS 92 9.166 6.825 -7.776 647 HB3 LYS 92 HB3 LYS 92 7.592 7.513 -8.136 648 HG2 LYS 92 HG2 LYS 92 8.398 9.687 -8.151 649 HG3 LYS 92 HG3 LYS 92 9.879 9.227 -7.309 650 HD2 LYS 92 HD2 LYS 92 10.674 8.038 -9.239 651 HD3 LYS 92 HD3 LYS 92 9.128 8.264 -10.063 652 HE2 LYS 92 HE2 LYS 92 9.499 10.608 -10.274 653 HE3 LYS 92 HE3 LYS 92 10.888 10.551 -9.191 654 HZ1 LYS 92 HZ1 LYS 92 10.734 9.297 -11.879 655 HZ2 LYS 92 HZ2 LYS 92 12.067 9.231 -10.840 656 HZ3 LYS 92 HZ3 LYS 92 11.578 10.712 -11.494 657 H ILE 93 H ILE 93 6.595 9.473 -6.499 658 HA ILE 93 HA ILE 93 4.175 7.960 -6.037 659 HB ILE 93 HB ILE 93 5.096 10.403 -4.771 660 HG12 ILE 93 HG12 ILE 93 3.102 9.647 -3.216 661 HG13 ILE 93 HG13 ILE 93 3.318 8.143 -4.103 662 HG21 ILE 93 HG21 ILE 93 2.232 10.364 -5.554 663 HG22 ILE 93 HG22 ILE 93 3.467 11.410 -6.247 664 HG23 ILE 93 HG23 ILE 93 3.038 11.559 -4.543 665 HD11 ILE 93 HD11 ILE 93 4.649 7.913 -2.185 666 HD12 ILE 93 HD12 ILE 93 5.270 9.556 -2.316 667 HD13 ILE 93 HD13 ILE 93 5.787 8.325 -3.466 668 H SER 94 H SER 94 2.427 8.467 -7.253 669 HA SER 94 HA SER 94 2.877 10.075 -9.629 670 HB2 SER 94 HB2 SER 94 2.329 7.521 -9.701 671 HB3 SER 94 HB3 SER 94 0.693 8.075 -9.335 672 HG SER 94 HG SER 94 0.824 9.391 -11.224 673 H VAL 95 H VAL 95 1.358 10.064 -6.700 674 HA VAL 95 HA VAL 95 -0.954 11.429 -7.606 675 HB VAL 95 HB VAL 95 -1.512 11.103 -5.041 676 HG11 VAL 95 HG11 VAL 95 -2.820 9.151 -5.668 677 HG12 VAL 95 HG12 VAL 95 -1.854 8.975 -7.132 678 HG13 VAL 95 HG13 VAL 95 -2.886 10.389 -6.921 679 HG21 VAL 95 HG21 VAL 95 0.422 8.902 -5.669 680 HG22 VAL 95 HG22 VAL 95 -0.835 8.730 -4.447 681 HG23 VAL 95 HG23 VAL 95 0.396 9.978 -4.270 682 H SER 96 H SER 96 -1.710 12.831 -5.485 683 HA SER 96 HA SER 96 0.301 14.572 -4.517 684 HB2 SER 96 HB2 SER 96 -1.804 15.671 -6.401 685 HB3 SER 96 HB3 SER 96 -0.653 16.636 -5.476 686 HG SER 96 HG SER 96 -0.319 15.358 -7.839 687 H THR 97 H THR 97 -0.369 15.680 -2.760 688 HA THR 97 HA THR 97 -2.367 14.636 -1.184 689 HB THR 97 HB THR 97 -1.358 17.453 -0.873 690 HG1 THR 97 HG1 THR 97 0.234 15.940 0.491 691 HG21 THR 97 HG21 THR 97 -1.640 17.129 1.460 692 HG22 THR 97 HG22 THR 97 -1.847 15.390 1.268 693 HG23 THR 97 HG23 THR 97 -3.106 16.493 0.713 694 H ASP 98 H ASP 98 -4.506 14.892 -1.089 695 HA ASP 98 HA ASP 98 -6.570 15.877 -1.028 696 HB2 ASP 98 HB2 ASP 98 -5.224 18.164 -0.982 697 HB3 ASP 98 HB3 ASP 98 -5.811 18.280 -2.639 698 H SER 99 H SER 99 -4.779 14.941 -3.662 699 HA SER 99 HA SER 99 -6.724 15.386 -5.695 700 HB2 SER 99 HB2 SER 99 -4.325 13.556 -5.673 701 HB3 SER 99 HB3 SER 99 -5.256 14.016 -7.099 702 HG SER 99 HG SER 99 -3.828 15.810 -5.423 703 H THR 100 H THR 100 -7.980 13.764 -6.711 704 HA THR 100 HA THR 100 -8.875 11.704 -4.965 705 HB THR 100 HB THR 100 -10.424 11.174 -6.935 706 HG1 THR 100 HG1 THR 100 -10.709 13.062 -8.302 707 HG21 THR 100 HG21 THR 100 -10.579 13.803 -5.478 708 HG22 THR 100 HG22 THR 100 -11.152 12.240 -4.890 709 HG23 THR 100 HG23 THR 100 -11.934 13.003 -6.277 710 H VAL 101 H VAL 101 -8.851 9.520 -5.339 711 HA VAL 101 HA VAL 101 -7.123 8.603 -7.451 712 HB VAL 101 HB VAL 101 -6.801 6.682 -5.608 713 HG11 VAL 101 HG11 VAL 101 -5.127 9.141 -5.992 714 HG12 VAL 101 HG12 VAL 101 -5.030 7.633 -6.905 715 HG13 VAL 101 HG13 VAL 101 -4.575 7.665 -5.200 716 HG21 VAL 101 HG21 VAL 101 -6.321 7.637 -3.450 717 HG22 VAL 101 HG22 VAL 101 -7.999 7.953 -3.881 718 HG23 VAL 101 HG23 VAL 101 -6.795 9.233 -4.020 719 H LYS 102 H LYS 102 -7.308 6.192 -7.762 720 HA LYS 102 HA LYS 102 -9.896 5.090 -7.366 721 HB2 LYS 102 HB2 LYS 102 -9.750 6.360 -9.556 722 HB3 LYS 102 HB3 LYS 102 -8.631 5.112 -10.023 723 HG2 LYS 102 HG2 LYS 102 -10.928 3.795 -9.061 724 HG3 LYS 102 HG3 LYS 102 -11.495 5.097 -10.103 725 HD2 LYS 102 HD2 LYS 102 -9.427 3.998 -11.563 726 HD3 LYS 102 HD3 LYS 102 -10.165 2.591 -10.796 727 HE2 LYS 102 HE2 LYS 102 -12.354 3.291 -11.654 728 HE3 LYS 102 HE3 LYS 102 -11.599 4.680 -12.433 729 HZ1 LYS 102 HZ1 LYS 102 -10.240 3.104 -13.728 730 HZ2 LYS 102 HZ2 LYS 102 -11.896 2.942 -14.031 731 HZ3 LYS 102 HZ3 LYS 102 -11.104 1.818 -13.048 732 H GLN 103 H GLN 103 -9.970 2.924 -7.420 733 HA GLN 103 HA GLN 103 -7.811 1.520 -6.479 734 HB2 GLN 103 HB2 GLN 103 -10.323 1.002 -6.331 735 HB3 GLN 103 HB3 GLN 103 -10.112 0.220 -7.883 736 HG2 GLN 103 HG2 GLN 103 -8.275 -0.615 -5.726 737 HG3 GLN 103 HG3 GLN 103 -9.960 -1.106 -5.582 738 HE21 GLN 103 HE21 GLN 103 -8.608 -0.630 -8.681 739 HE22 GLN 103 HE22 GLN 103 -8.461 -2.271 -9.099 740 H GLY 104 H GLY 104 -6.357 0.206 -7.331 741 HA2 GLY 104 HA2 GLY 104 -5.046 -0.924 -8.829 742 HA3 GLY 104 HA3 GLY 104 -6.284 -0.695 -10.005 743 H GLN 105 H GLN 105 -5.861 2.318 -9.101 744 HA GLN 105 HA GLN 105 -4.327 3.058 -11.361 745 HB2 GLN 105 HB2 GLN 105 -6.194 4.388 -10.395 746 HB3 GLN 105 HB3 GLN 105 -5.195 4.723 -8.998 747 HG2 GLN 105 HG2 GLN 105 -3.701 6.047 -10.316 748 HG3 GLN 105 HG3 GLN 105 -4.520 5.569 -11.808 749 HE21 GLN 105 HE21 GLN 105 -4.970 7.230 -8.741 750 HE22 GLN 105 HE22 GLN 105 -6.226 8.279 -9.278 751 H ILE 106 H ILE 106 -2.326 3.808 -11.522 752 HA ILE 106 HA ILE 106 -0.500 2.888 -9.629 753 HB ILE 106 HB ILE 106 -0.060 4.414 -12.123 754 HG12 ILE 106 HG12 ILE 106 0.788 1.588 -11.588 755 HG13 ILE 106 HG13 ILE 106 -0.868 1.946 -12.060 756 HG21 ILE 106 HG21 ILE 106 2.022 3.277 -10.267 757 HG22 ILE 106 HG22 ILE 106 1.791 4.977 -10.677 758 HG23 ILE 106 HG23 ILE 106 2.358 3.843 -11.903 759 HD11 ILE 106 HD11 ILE 106 0.313 1.303 -14.008 760 HD12 ILE 106 HD12 ILE 106 1.639 2.408 -13.648 761 HD13 ILE 106 HD13 ILE 106 0.060 3.046 -14.113 762 H ILE 107 H ILE 107 -0.513 3.851 -7.793 763 HA ILE 107 HA ILE 107 -0.618 6.684 -7.539 764 HB ILE 107 HB ILE 107 -0.547 6.021 -5.040 765 HG12 ILE 107 HG12 ILE 107 -1.829 3.480 -5.807 766 HG13 ILE 107 HG13 ILE 107 -0.078 3.522 -5.985 767 HG21 ILE 107 HG21 ILE 107 -2.482 6.965 -6.173 768 HG22 ILE 107 HG22 ILE 107 -2.970 5.708 -5.040 769 HG23 ILE 107 HG23 ILE 107 -2.917 5.364 -6.769 770 HD11 ILE 107 HD11 ILE 107 0.212 4.013 -3.672 771 HD12 ILE 107 HD12 ILE 107 -0.883 2.636 -3.809 772 HD13 ILE 107 HD13 ILE 107 -1.522 4.240 -3.449 773 H GLY 108 H GLY 108 1.873 4.489 -7.879 774 HA2 GLY 108 HA2 GLY 108 3.931 6.261 -7.611 775 HA3 GLY 108 HA3 GLY 108 3.749 5.523 -6.027 776 H TYR 109 H TYR 109 5.854 4.776 -6.386 777 HA TYR 109 HA TYR 109 6.023 2.212 -7.656 778 HB2 TYR 109 HB2 TYR 109 8.246 4.254 -7.874 779 HB3 TYR 109 HB3 TYR 109 8.237 2.639 -8.567 780 HD1 TYR 109 HD1 TYR 109 7.303 2.249 -10.718 781 HD2 TYR 109 HD2 TYR 109 6.697 5.982 -8.784 782 HE1 TYR 109 HE1 TYR 109 6.403 3.176 -12.812 783 HE2 TYR 109 HE2 TYR 109 5.792 6.927 -10.870 784 HH TYR 109 HH TYR 109 5.896 6.512 -13.274 785 H THR 110 H THR 110 7.153 0.762 -6.474 786 HA THR 110 HA THR 110 7.517 1.152 -3.733 787 HB THR 110 HB THR 110 8.903 -1.071 -4.082 788 HG1 THR 110 HG1 THR 110 8.409 -0.473 -6.541 789 HG21 THR 110 HG21 THR 110 5.942 -0.681 -4.274 790 HG22 THR 110 HG22 THR 110 6.893 -1.165 -2.875 791 HG23 THR 110 HG23 THR 110 6.659 -2.287 -4.215 792 H GLY 111 H GLY 111 9.438 1.178 -2.392 793 HA2 GLY 111 HA2 GLY 111 12.016 1.322 -3.695 794 HA3 GLY 111 HA3 GLY 111 11.455 2.856 -3.067 795 H ALA 112 H ALA 112 13.371 2.778 -1.840 796 HA ALA 112 HA ALA 112 12.902 1.697 0.752 797 HB1 ALA 112 HB1 ALA 112 15.217 0.843 -0.944 798 HB2 ALA 112 HB2 ALA 112 14.245 -0.109 0.171 799 HB3 ALA 112 HB3 ALA 112 15.448 1.007 0.796 800 H THR 113 H THR 113 12.550 4.206 0.175 801 HA THR 113 HA THR 113 14.924 5.826 0.284 802 HB THR 113 HB THR 113 13.240 7.726 0.436 803 HG1 THR 113 HG1 THR 113 11.373 5.684 -0.223 804 HG21 THR 113 HG21 THR 113 14.265 7.015 -1.681 805 HG22 THR 113 HG22 THR 113 12.592 7.522 -1.915 806 HG23 THR 113 HG23 THR 113 12.998 5.804 -1.886 807 H GLY 114 H GLY 114 13.493 4.127 2.666 808 HA2 GLY 114 HA2 GLY 114 13.940 6.204 4.722 809 HA3 GLY 114 HA3 GLY 114 12.894 4.805 4.929 810 H GLN 115 H GLN 115 14.161 4.493 6.926 811 HA GLN 115 HA GLN 115 16.899 3.535 6.549 812 HB2 GLN 115 HB2 GLN 115 15.223 4.049 9.009 813 HB3 GLN 115 HB3 GLN 115 16.791 3.260 9.087 814 HG2 GLN 115 HG2 GLN 115 17.820 5.246 8.068 815 HG3 GLN 115 HG3 GLN 115 16.244 6.036 8.059 816 HE21 GLN 115 HE21 GLN 115 18.876 4.902 10.031 817 HE22 GLN 115 HE22 GLN 115 18.435 5.756 11.467 818 H VAL 116 H VAL 116 16.622 1.640 5.437 819 HA VAL 116 HA VAL 116 15.836 -0.666 7.000 820 HB VAL 116 HB VAL 116 14.506 -1.624 5.025 821 HG11 VAL 116 HG11 VAL 116 13.585 0.403 6.990 822 HG12 VAL 116 HG12 VAL 116 13.182 -1.309 6.856 823 HG13 VAL 116 HG13 VAL 116 12.442 -0.138 5.765 824 HG21 VAL 116 HG21 VAL 116 15.047 0.088 3.355 825 HG22 VAL 116 HG22 VAL 116 14.220 1.305 4.327 826 HG23 VAL 116 HG23 VAL 116 13.306 -0.023 3.613 827 H THR 117 H THR 117 16.510 -2.711 6.004 828 HA THR 117 HA THR 117 19.040 -2.365 4.632 829 HB THR 117 HB THR 117 19.060 -3.862 6.520 830 HG1 THR 117 HG1 THR 117 20.518 -4.778 5.292 831 HG21 THR 117 HG21 THR 117 16.752 -4.646 6.540 832 HG22 THR 117 HG22 THR 117 17.859 -6.019 6.522 833 HG23 THR 117 HG23 THR 117 17.020 -5.541 5.045 834 H GLY 118 H GLY 118 15.921 -2.732 3.535 835 HA2 GLY 118 HA2 GLY 118 16.815 -3.346 0.885 836 HA3 GLY 118 HA3 GLY 118 15.922 -4.677 1.594 837 HA PRO 119 HA PRO 119 12.920 -1.409 -0.172 838 HB2 PRO 119 HB2 PRO 119 12.650 -2.783 -2.692 839 HB3 PRO 119 HB3 PRO 119 13.251 -1.152 -2.400 840 HG2 PRO 119 HG2 PRO 119 14.819 -3.177 -3.325 841 HG3 PRO 119 HG3 PRO 119 15.433 -1.792 -2.399 842 HD2 PRO 119 HD2 PRO 119 14.801 -4.563 -1.454 843 HD3 PRO 119 HD3 PRO 119 16.186 -3.522 -1.062 844 H HIS 120 H HIS 120 10.754 -1.695 0.122 845 HA HIS 120 HA HIS 120 9.428 -4.075 -0.550 846 HB2 HIS 120 HB2 HIS 120 8.733 -4.753 1.739 847 HB3 HIS 120 HB3 HIS 120 10.461 -4.920 1.484 848 HD1 HIS 120 HD1 HIS 120 12.009 -3.603 2.978 849 HD2 HIS 120 HD2 HIS 120 8.000 -2.667 3.540 850 HE1 HIS 120 HE1 HIS 120 11.932 -2.229 5.078 851 HE2 HIS 120 HE2 HIS 120 9.497 -1.659 5.397 852 H LEU 121 H LEU 121 7.284 -3.873 1.138 853 HA LEU 121 HA LEU 121 6.125 -1.350 0.423 854 HB2 LEU 121 HB2 LEU 121 5.198 -2.750 -1.151 855 HB3 LEU 121 HB3 LEU 121 5.123 -4.111 -0.071 856 HG LEU 121 HG LEU 121 3.215 -2.891 1.102 857 HD11 LEU 121 HD11 LEU 121 3.279 -1.246 -1.430 858 HD12 LEU 121 HD12 LEU 121 3.624 -0.653 0.195 859 HD13 LEU 121 HD13 LEU 121 2.005 -1.223 -0.210 860 HD21 LEU 121 HD21 LEU 121 1.578 -3.639 -0.538 861 HD22 LEU 121 HD22 LEU 121 2.891 -4.805 -0.379 862 HD23 LEU 121 HD23 LEU 121 2.837 -3.723 -1.770 863 H HIS 122 H HIS 122 5.145 -0.333 1.938 864 HA HIS 122 HA HIS 122 4.497 -1.682 4.386 865 HB2 HIS 122 HB2 HIS 122 6.181 -0.088 4.931 866 HB3 HIS 122 HB3 HIS 122 5.442 1.140 3.915 867 HD2 HIS 122 HD2 HIS 122 3.036 2.285 5.035 868 HE1 HIS 122 HE1 HIS 122 3.886 0.926 8.946 869 HE2 HIS 122 HE2 HIS 122 2.426 2.441 7.546 870 H PHE 123 H PHE 123 2.427 -2.027 4.564 871 HA PHE 123 HA PHE 123 0.539 -0.058 3.493 872 HB2 PHE 123 HB2 PHE 123 0.619 -2.320 2.328 873 HB3 PHE 123 HB3 PHE 123 0.029 -3.027 3.824 874 HD1 PHE 123 HD1 PHE 123 -0.847 -0.707 1.080 875 HD2 PHE 123 HD2 PHE 123 -2.253 -3.019 4.368 876 HE1 PHE 123 HE1 PHE 123 -3.166 -0.326 0.355 877 HE2 PHE 123 HE2 PHE 123 -4.571 -2.645 3.645 878 HZ PHE 123 HZ PHE 123 -5.030 -1.301 1.635 879 H GLU 124 H GLU 124 -0.271 1.026 5.137 880 HA GLU 124 HA GLU 124 -1.053 -0.314 7.561 881 HB2 GLU 124 HB2 GLU 124 0.836 1.496 7.562 882 HB3 GLU 124 HB3 GLU 124 -0.498 2.631 7.405 883 HG2 GLU 124 HG2 GLU 124 -1.461 1.728 9.491 884 HG3 GLU 124 HG3 GLU 124 -0.056 0.679 9.654 885 H MET 125 H MET 125 -3.126 -0.276 7.979 886 HA MET 125 HA MET 125 -4.900 1.522 6.619 887 HB2 MET 125 HB2 MET 125 -5.590 -0.424 5.702 888 HB3 MET 125 HB3 MET 125 -4.917 -1.346 7.003 889 HG2 MET 125 HG2 MET 125 -7.281 -1.698 6.939 890 HG3 MET 125 HG3 MET 125 -6.863 -0.809 8.396 891 HE1 MET 125 HE1 MET 125 -9.320 0.092 8.861 892 HE2 MET 125 HE2 MET 125 -9.727 -1.047 7.578 893 HE3 MET 125 HE3 MET 125 -10.378 0.591 7.542 894 H LEU 126 H LEU 126 -6.362 2.498 7.745 895 HA LEU 126 HA LEU 126 -6.611 2.080 10.591 896 HB2 LEU 126 HB2 LEU 126 -5.459 4.473 9.215 897 HB3 LEU 126 HB3 LEU 126 -6.451 4.763 10.623 898 HG LEU 126 HG LEU 126 -4.783 2.941 11.661 899 HD11 LEU 126 HD11 LEU 126 -3.551 2.695 9.538 900 HD12 LEU 126 HD12 LEU 126 -2.534 3.275 10.858 901 HD13 LEU 126 HD13 LEU 126 -3.107 4.399 9.625 902 HD21 LEU 126 HD21 LEU 126 -4.243 5.885 11.340 903 HD22 LEU 126 HD22 LEU 126 -3.504 4.836 12.550 904 HD23 LEU 126 HD23 LEU 126 -5.242 5.125 12.578 905 HA PRO 127 HA PRO 127 -10.922 3.405 10.060 906 HB2 PRO 127 HB2 PRO 127 -11.163 5.382 11.950 907 HB3 PRO 127 HB3 PRO 127 -11.361 3.678 12.295 908 HG2 PRO 127 HG2 PRO 127 -9.011 5.423 12.737 909 HG3 PRO 127 HG3 PRO 127 -9.618 4.087 13.740 910 HD2 PRO 127 HD2 PRO 127 -7.479 3.782 12.192 911 HD3 PRO 127 HD3 PRO 127 -8.654 2.480 12.387 912 H ALA 128 H ALA 128 -12.319 5.454 9.959 913 HA ALA 128 HA ALA 128 -11.245 7.209 8.063 914 HB1 ALA 128 HB1 ALA 128 -13.630 6.650 8.120 915 HB2 ALA 128 HB2 ALA 128 -13.383 8.394 8.229 916 HB3 ALA 128 HB3 ALA 128 -13.768 7.463 9.680 917 H ASN 129 H ASN 129 -11.485 7.122 11.469 918 HA ASN 129 HA ASN 129 -9.793 9.352 11.896 919 HB2 ASN 129 HB2 ASN 129 -12.670 9.588 12.837 920 HB3 ASN 129 HB3 ASN 129 -11.355 10.553 13.499 921 HD21 ASN 129 HD21 ASN 129 -10.139 11.869 11.922 922 HD22 ASN 129 HD22 ASN 129 -11.014 12.584 10.618 923 HA PRO 130 HA PRO 130 -9.013 6.148 14.674 924 HB2 PRO 130 HB2 PRO 130 -6.371 7.287 15.044 925 HB3 PRO 130 HB3 PRO 130 -6.840 5.738 14.327 926 HG2 PRO 130 HG2 PRO 130 -5.905 7.838 12.840 927 HG3 PRO 130 HG3 PRO 130 -6.942 6.564 12.195 928 HD2 PRO 130 HD2 PRO 130 -7.606 9.342 13.013 929 HD3 PRO 130 HD3 PRO 130 -8.253 8.353 11.689 930 H ASN 131 H ASN 131 -8.251 5.833 16.749 931 HA ASN 131 HA ASN 131 -8.453 8.086 18.554 932 HB2 ASN 131 HB2 ASN 131 -10.161 6.013 18.402 933 HB3 ASN 131 HB3 ASN 131 -8.960 5.383 19.514 934 HD21 ASN 131 HD21 ASN 131 -11.392 7.723 18.934 935 HD22 ASN 131 HD22 ASN 131 -11.548 8.276 20.550 936 H TRP 132 H TRP 132 -6.178 8.189 17.911 937 HA TRP 132 HA TRP 132 -4.293 6.234 18.495 938 HB2 TRP 132 HB2 TRP 132 -3.681 9.183 18.602 939 HB3 TRP 132 HB3 TRP 132 -2.613 7.875 18.118 940 HD1 TRP 132 HD1 TRP 132 -3.237 6.702 15.689 941 HE1 TRP 132 HE1 TRP 132 -4.163 7.802 13.553 942 HE3 TRP 132 HE3 TRP 132 -5.170 10.976 17.731 943 HZ2 TRP 132 HZ2 TRP 132 -5.524 10.114 12.837 944 HZ3 TRP 132 HZ3 TRP 132 -6.279 12.588 16.232 945 HH2 TRP 132 HH2 TRP 132 -6.452 12.166 13.831 946 H GLN 133 H GLN 133 -6.234 7.289 20.663 947 HA GLN 133 HA GLN 133 -4.592 8.176 22.786 948 HB2 GLN 133 HB2 GLN 133 -7.487 7.420 22.570 949 HB3 GLN 133 HB3 GLN 133 -6.732 8.012 24.018 950 HG2 GLN 133 HG2 GLN 133 -7.681 9.941 23.168 951 HG3 GLN 133 HG3 GLN 133 -6.032 10.037 22.549 952 HE21 GLN 133 HE21 GLN 133 -5.674 9.290 20.343 953 HE22 GLN 133 HE22 GLN 133 -6.921 9.419 19.167 954 H ASN 134 H ASN 134 -3.990 5.650 21.722 955 HA ASN 134 HA ASN 134 -3.018 3.733 22.349 956 HB2 ASN 134 HB2 ASN 134 -3.897 4.594 25.103 957 HB3 ASN 134 HB3 ASN 134 -3.066 3.068 24.808 958 HD21 ASN 134 HD21 ASN 134 -2.816 6.545 24.343 959 HD22 ASN 134 HD22 ASN 134 -1.097 6.614 24.402 960 H GLY 135 H GLY 135 -3.696 1.812 21.901 961 HA2 GLY 135 HA2 GLY 135 -5.508 0.184 22.971 962 HA3 GLY 135 HA3 GLY 135 -6.535 1.308 22.095 963 H PHE 136 H PHE 136 -5.226 1.735 19.757 964 HA PHE 136 HA PHE 136 -4.389 -0.781 18.595 965 HB2 PHE 136 HB2 PHE 136 -6.127 -0.371 16.676 966 HB3 PHE 136 HB3 PHE 136 -6.589 -1.265 18.108 967 HD1 PHE 136 HD1 PHE 136 -6.370 2.478 18.009 968 HD2 PHE 136 HD2 PHE 136 -8.898 -0.958 17.895 969 HE1 PHE 136 HE1 PHE 136 -8.331 3.908 18.248 970 HE2 PHE 136 HE2 PHE 136 -10.863 0.490 18.163 971 HZ PHE 136 HZ PHE 136 -10.584 2.926 18.339 972 H SER 137 H SER 137 -4.683 2.578 18.528 973 HA SER 137 HA SER 137 -3.621 4.276 17.514 974 HB2 SER 137 HB2 SER 137 -1.525 2.928 17.825 975 HB3 SER 137 HB3 SER 137 -1.796 2.220 16.238 976 HG SER 137 HG SER 137 -1.244 4.917 16.879 977 H GLY 138 H GLY 138 -5.696 2.477 16.492 978 HA2 GLY 138 HA2 GLY 138 -7.255 2.652 14.842 979 HA3 GLY 138 HA3 GLY 138 -6.258 3.868 14.079 980 H ARG 139 H ARG 139 -4.084 1.552 14.442 981 HA ARG 139 HA ARG 139 -4.472 0.700 11.712 982 HB2 ARG 139 HB2 ARG 139 -2.261 -0.545 12.078 983 HB3 ARG 139 HB3 ARG 139 -2.239 1.208 12.081 984 HG2 ARG 139 HG2 ARG 139 -0.870 0.695 13.846 985 HG3 ARG 139 HG3 ARG 139 -2.408 0.956 14.657 986 HD2 ARG 139 HD2 ARG 139 -2.774 -1.440 14.765 987 HD3 ARG 139 HD3 ARG 139 -1.285 -1.728 13.875 988 HE ARG 139 HE ARG 139 -0.214 -0.536 15.880 989 HH11 ARG 139 HH11 ARG 139 -3.065 -2.608 16.093 990 HH12 ARG 139 HH12 ARG 139 -2.719 -3.079 17.797 991 HH21 ARG 139 HH21 ARG 139 -0.889 -2.247 18.871 992 HH22 ARG 139 HH22 ARG 139 0.228 -1.114 18.028 993 H ILE 140 H ILE 140 -5.310 -1.125 10.989 994 HA ILE 140 HA ILE 140 -5.391 -3.418 12.777 995 HB ILE 140 HB ILE 140 -7.651 -3.413 10.984 996 HG12 ILE 140 HG12 ILE 140 -8.815 -1.861 12.879 997 HG13 ILE 140 HG13 ILE 140 -7.237 -1.090 12.765 998 HG21 ILE 140 HG21 ILE 140 -8.823 -4.162 12.983 999 HG22 ILE 140 HG22 ILE 140 -7.408 -3.766 13.957 1000 HG23 ILE 140 HG23 ILE 140 -7.317 -5.048 12.750 1001 HD11 ILE 140 HD11 ILE 140 -8.933 -1.643 10.358 1002 HD12 ILE 140 HD12 ILE 140 -7.549 -0.560 10.505 1003 HD13 ILE 140 HD13 ILE 140 -9.068 -0.160 11.304 1004 H ASP 141 H ASP 141 -6.527 -5.322 11.235 1005 HA ASP 141 HA ASP 141 -4.314 -6.216 9.743 1006 HB2 ASP 141 HB2 ASP 141 -7.035 -7.329 10.304 1007 HB3 ASP 141 HB3 ASP 141 -5.930 -8.150 9.209 1008 HA PRO 142 HA PRO 142 -5.650 -4.879 5.604 1009 HB2 PRO 142 HB2 PRO 142 -3.658 -6.466 4.335 1010 HB3 PRO 142 HB3 PRO 142 -3.612 -4.735 4.665 1011 HG2 PRO 142 HG2 PRO 142 -1.990 -6.649 5.849 1012 HG3 PRO 142 HG3 PRO 142 -2.241 -4.994 6.428 1013 HD2 PRO 142 HD2 PRO 142 -3.383 -7.538 7.423 1014 HD3 PRO 142 HD3 PRO 142 -3.019 -6.032 8.288 1015 H THR 143 H THR 143 -6.053 -7.898 6.882 1016 HA THR 143 HA THR 143 -6.311 -9.738 4.890 1017 HB THR 143 HB THR 143 -8.187 -10.641 6.466 1018 HG1 THR 143 HG1 THR 143 -8.608 -9.373 8.085 1019 HG21 THR 143 HG21 THR 143 -5.315 -10.366 7.318 1020 HG22 THR 143 HG22 THR 143 -5.973 -11.620 6.267 1021 HG23 THR 143 HG23 THR 143 -6.458 -11.544 7.960 1022 H GLY 144 H GLY 144 -8.362 -7.080 5.503 1023 HA2 GLY 144 HA2 GLY 144 -10.758 -8.061 4.274 1024 HA3 GLY 144 HA3 GLY 144 -10.391 -6.380 4.636 1025 H TYR 145 H TYR 145 -7.854 -6.543 3.138 1026 HA TYR 145 HA TYR 145 -8.927 -6.203 0.476 1027 HB2 TYR 145 HB2 TYR 145 -6.201 -5.298 1.354 1028 HB3 TYR 145 HB3 TYR 145 -7.142 -4.736 -0.017 1029 HD1 TYR 145 HD1 TYR 145 -8.731 -2.958 0.226 1030 HD2 TYR 145 HD2 TYR 145 -6.801 -4.600 3.639 1031 HE1 TYR 145 HE1 TYR 145 -9.544 -1.074 1.587 1032 HE2 TYR 145 HE2 TYR 145 -7.606 -2.730 5.005 1033 HH TYR 145 HH TYR 145 -10.023 -0.727 4.157 1034 H ILE 146 H ILE 146 -7.162 -8.412 2.250 1035 HA ILE 146 HA ILE 146 -5.591 -9.322 0.012 1036 HB ILE 146 HB ILE 146 -5.491 -10.423 2.813 1037 HG12 ILE 146 HG12 ILE 146 -4.923 -8.082 3.024 1038 HG13 ILE 146 HG13 ILE 146 -3.451 -9.026 3.174 1039 HG21 ILE 146 HG21 ILE 146 -3.502 -10.615 0.556 1040 HG22 ILE 146 HG22 ILE 146 -4.497 -11.919 1.209 1041 HG23 ILE 146 HG23 ILE 146 -3.228 -11.198 2.199 1042 HD11 ILE 146 HD11 ILE 146 -4.316 -7.511 0.711 1043 HD12 ILE 146 HD12 ILE 146 -2.817 -8.420 0.897 1044 HD13 ILE 146 HD13 ILE 146 -3.105 -6.982 1.879 1045 H ALA 147 H ALA 147 -8.507 -9.932 1.503 1046 HA ALA 147 HA ALA 147 -8.781 -12.710 1.024 1047 HB1 ALA 147 HB1 ALA 147 -10.095 -11.556 2.713 1048 HB2 ALA 147 HB2 ALA 147 -11.126 -12.367 1.534 1049 HB3 ALA 147 HB3 ALA 147 -10.884 -10.624 1.441 1050 H ASN 148 H ASN 148 -9.233 -9.883 -0.882 1051 HA ASN 148 HA ASN 148 -10.577 -11.335 -2.960 1052 HB2 ASN 148 HB2 ASN 148 -10.177 -8.417 -3.199 1053 HB3 ASN 148 HB3 ASN 148 -11.592 -9.371 -3.522 1054 HD21 ASN 148 HD21 ASN 148 -9.759 -7.812 -1.086 1055 HD22 ASN 148 HD22 ASN 148 -11.003 -7.713 0.104 1056 H ALA 149 H ALA 149 -7.704 -11.203 -2.090 1057 HA ALA 149 HA ALA 149 -6.465 -10.149 -4.396 1058 HB1 ALA 149 HB1 ALA 149 -5.784 -9.803 -1.957 1059 HB2 ALA 149 HB2 ALA 149 -4.513 -10.052 -3.157 1060 HB3 ALA 149 HB3 ALA 149 -5.017 -11.381 -2.114 1061 HA PRO 150 HA PRO 150 -5.552 -13.839 -6.714 1062 HB2 PRO 150 HB2 PRO 150 -2.676 -13.060 -6.548 1063 HB3 PRO 150 HB3 PRO 150 -3.661 -13.438 -7.971 1064 HG2 PRO 150 HG2 PRO 150 -3.069 -10.939 -7.450 1065 HG3 PRO 150 HG3 PRO 150 -4.711 -11.377 -7.965 1066 HD2 PRO 150 HD2 PRO 150 -3.723 -10.727 -5.213 1067 HD3 PRO 150 HD3 PRO 150 -5.234 -10.248 -6.001 1068 H VAL 151 H VAL 151 -3.873 -15.656 -6.893 1069 HA VAL 151 HA VAL 151 -3.624 -16.910 -4.295 1070 HB VAL 151 HB VAL 151 -3.644 -18.131 -7.004 1071 HG11 VAL 151 HG11 VAL 151 -3.566 -20.279 -6.013 1072 HG12 VAL 151 HG12 VAL 151 -3.761 -19.601 -4.396 1073 HG13 VAL 151 HG13 VAL 151 -2.258 -19.333 -5.289 1074 HG21 VAL 151 HG21 VAL 151 -5.831 -18.981 -6.493 1075 HG22 VAL 151 HG22 VAL 151 -5.830 -17.233 -6.251 1076 HG23 VAL 151 HG23 VAL 151 -5.739 -18.317 -4.862 1077 H PHE 152 H PHE 152 -1.801 -17.354 -3.497 1078 HA PHE 152 HA PHE 152 0.700 -17.071 -5.013 1079 HB2 PHE 152 HB2 PHE 152 0.654 -15.488 -3.213 1080 HB3 PHE 152 HB3 PHE 152 0.038 -16.675 -2.078 1081 HD1 PHE 152 HD1 PHE 152 3.030 -15.423 -3.795 1082 HD2 PHE 152 HD2 PHE 152 1.505 -18.225 -0.987 1083 HE1 PHE 152 HE1 PHE 152 5.318 -15.891 -3.034 1084 HE2 PHE 152 HE2 PHE 152 3.793 -18.698 -0.212 1085 HZ PHE 152 HZ PHE 152 5.704 -17.532 -1.238 1086 H ASN 153 H ASN 153 1.122 -19.017 -5.796 1087 HA ASN 153 HA ASN 153 1.940 -21.124 -5.923 1088 HB2 ASN 153 HB2 ASN 153 2.191 -20.671 -3.007 1089 HB3 ASN 153 HB3 ASN 153 2.196 -22.350 -3.540 1090 HD21 ASN 153 HD21 ASN 153 3.775 -19.243 -3.884 1091 HD22 ASN 153 HD22 ASN 153 5.294 -19.860 -4.429 1092 H GLY 154 H GLY 154 -0.750 -20.722 -3.662 1093 HA2 GLY 154 HA2 GLY 154 -2.853 -21.819 -4.461 1094 HA3 GLY 154 HA3 GLY 154 -1.879 -23.267 -4.666 1095 H THR 155 H THR 155 -3.381 -21.119 -2.352 1096 HA THR 155 HA THR 155 -2.678 -22.791 -0.110 1097 HB THR 155 HB THR 155 -3.968 -20.968 1.117 1098 HG1 THR 155 HG1 THR 155 -3.925 -19.923 -1.492 1099 HG21 THR 155 HG21 THR 155 -1.479 -20.237 -0.407 1100 HG22 THR 155 HG22 THR 155 -1.541 -21.064 1.150 1101 HG23 THR 155 HG23 THR 155 -2.076 -19.388 1.019 1102 H THR 156 H THR 156 -3.897 -24.536 -0.041 1103 HA THR 156 HA THR 156 -6.800 -24.352 -0.397 1104 HB THR 156 HB THR 156 -6.665 -26.911 -0.274 1105 HG1 THR 156 HG1 THR 156 -4.188 -27.121 -1.206 1106 HG21 THR 156 HG21 THR 156 -5.983 -27.109 -2.627 1107 HG22 THR 156 HG22 THR 156 -5.309 -25.480 -2.563 1108 HG23 THR 156 HG23 THR 156 -7.045 -25.724 -2.371 1109 HA PRO 157 HA PRO 157 -7.153 -24.800 4.041 1110 HB2 PRO 157 HB2 PRO 157 -9.957 -25.141 4.028 1111 HB3 PRO 157 HB3 PRO 157 -9.073 -23.632 4.275 1112 HG2 PRO 157 HG2 PRO 157 -10.677 -24.241 2.075 1113 HG3 PRO 157 HG3 PRO 157 -9.505 -22.915 2.181 1114 HD2 PRO 157 HD2 PRO 157 -9.239 -25.564 0.867 1115 HD3 PRO 157 HD3 PRO 157 -8.528 -24.002 0.432 1116 H THR 158 H THR 158 -9.016 -26.983 2.077 1117 HA THR 158 HA THR 158 -8.109 -29.300 3.417 1118 HB THR 158 HB THR 158 -9.797 -28.737 5.036 1119 HG1 THR 158 HG1 THR 158 -9.759 -30.896 4.829 1120 HG21 THR 158 HG21 THR 158 -11.954 -28.858 2.960 1121 HG22 THR 158 HG22 THR 158 -11.249 -27.347 3.528 1122 HG23 THR 158 HG23 THR 158 -12.104 -28.398 4.656 1123 H GLU 159 H GLU 159 -10.969 -28.331 1.651 1124 HA GLU 159 HA GLU 159 -10.809 -30.501 -0.195 1125 HB2 GLU 159 HB2 GLU 159 -12.677 -28.198 0.174 1126 HB3 GLU 159 HB3 GLU 159 -12.746 -29.149 -1.303 1127 HG2 GLU 159 HG2 GLU 159 -13.175 -31.160 -0.014 1128 HG3 GLU 159 HG3 GLU 159 -13.051 -30.241 1.485 Start of MODEL 10 1 H1 MET 1 H1 MET 1 -0.566 -20.267 -33.318 2 H2 MET 1 H2 MET 1 -0.207 -20.994 -34.802 3 H3 MET 1 H3 MET 1 -1.800 -20.978 -34.232 4 HA MET 1 HA MET 1 -0.215 -18.593 -34.989 5 HB2 MET 1 HB2 MET 1 -2.361 -20.152 -36.418 6 HB3 MET 1 HB3 MET 1 -2.038 -18.466 -36.801 7 HG2 MET 1 HG2 MET 1 0.257 -19.022 -37.383 8 HG3 MET 1 HG3 MET 1 -0.036 -20.709 -36.964 9 HE1 MET 1 HE1 MET 1 0.292 -20.728 -40.890 10 HE2 MET 1 HE2 MET 1 0.978 -21.299 -39.368 11 HE3 MET 1 HE3 MET 1 1.122 -19.600 -39.819 12 H ARG 2 H ARG 2 -0.992 -16.701 -34.329 13 HA ARG 2 HA ARG 2 -3.367 -16.679 -32.636 14 HB2 ARG 2 HB2 ARG 2 -1.106 -14.745 -33.081 15 HB3 ARG 2 HB3 ARG 2 -2.564 -14.262 -32.224 16 HG2 ARG 2 HG2 ARG 2 -2.192 -15.964 -30.552 17 HG3 ARG 2 HG3 ARG 2 -0.790 -16.565 -31.438 18 HD2 ARG 2 HD2 ARG 2 0.350 -14.440 -31.099 19 HD3 ARG 2 HD3 ARG 2 -1.061 -13.804 -30.253 20 HE ARG 2 HE ARG 2 -0.420 -16.045 -28.854 21 HH11 ARG 2 HH11 ARG 2 1.401 -13.174 -29.803 22 HH12 ARG 2 HH12 ARG 2 2.474 -13.254 -28.358 23 HH21 ARG 2 HH21 ARG 2 0.923 -16.160 -27.033 24 HH22 ARG 2 HH22 ARG 2 2.207 -14.915 -26.819 25 H GLY 3 H GLY 3 -5.186 -15.515 -33.001 26 HA2 GLY 3 HA2 GLY 3 -5.605 -13.435 -34.783 27 HA3 GLY 3 HA3 GLY 3 -5.890 -14.914 -35.691 28 H SER 4 H SER 4 -6.877 -13.072 -32.850 29 HA SER 4 HA SER 4 -9.453 -14.502 -32.859 30 HB2 SER 4 HB2 SER 4 -9.663 -13.703 -30.487 31 HB3 SER 4 HB3 SER 4 -8.325 -14.821 -30.755 32 HG SER 4 HG SER 4 -7.183 -12.608 -31.133 33 H HIS 5 H HIS 5 -11.369 -13.348 -32.704 34 HA HIS 5 HA HIS 5 -11.185 -10.536 -33.534 35 HB2 HIS 5 HB2 HIS 5 -13.370 -12.595 -33.856 36 HB3 HIS 5 HB3 HIS 5 -13.613 -10.887 -34.204 37 HD1 HIS 5 HD1 HIS 5 -12.441 -9.926 -36.307 38 HD2 HIS 5 HD2 HIS 5 -11.870 -14.004 -35.747 39 HE1 HIS 5 HE1 HIS 5 -11.497 -10.777 -38.477 40 HE2 HIS 5 HE2 HIS 5 -11.160 -13.249 -38.116 41 H HIS 6 H HIS 6 -12.879 -12.682 -31.274 42 HA HIS 6 HA HIS 6 -13.788 -10.335 -29.750 43 HB2 HIS 6 HB2 HIS 6 -14.806 -13.167 -29.905 44 HB3 HIS 6 HB3 HIS 6 -15.275 -12.083 -28.599 45 HD1 HIS 6 HD1 HIS 6 -16.801 -10.070 -29.219 46 HD2 HIS 6 HD2 HIS 6 -16.006 -12.664 -32.368 47 HE1 HIS 6 HE1 HIS 6 -18.454 -9.472 -31.017 48 HE2 HIS 6 HE2 HIS 6 -17.955 -11.054 -32.915 49 H HIS 7 H HIS 7 -13.486 -10.237 -27.513 50 HA HIS 7 HA HIS 7 -11.238 -11.857 -26.531 51 HB2 HIS 7 HB2 HIS 7 -12.220 -9.105 -25.787 52 HB3 HIS 7 HB3 HIS 7 -11.061 -9.988 -24.800 53 HD1 HIS 7 HD1 HIS 7 -8.680 -10.338 -25.798 54 HD2 HIS 7 HD2 HIS 7 -11.204 -8.005 -28.133 55 HE1 HIS 7 HE1 HIS 7 -7.190 -9.221 -27.487 56 HE2 HIS 7 HE2 HIS 7 -8.738 -7.813 -28.891 57 H HIS 8 H HIS 8 -11.261 -12.734 -24.458 58 HA HIS 8 HA HIS 8 -13.873 -12.851 -23.106 59 HB2 HIS 8 HB2 HIS 8 -12.044 -15.137 -23.828 60 HB3 HIS 8 HB3 HIS 8 -13.242 -15.273 -22.546 61 HD1 HIS 8 HD1 HIS 8 -12.895 -15.107 -26.255 62 HD2 HIS 8 HD2 HIS 8 -15.916 -15.385 -23.415 63 HE1 HIS 8 HE1 HIS 8 -14.970 -15.716 -27.538 64 HE2 HIS 8 HE2 HIS 8 -16.787 -15.879 -25.799 65 H HIS 9 H HIS 9 -13.810 -13.202 -20.849 66 HA HIS 9 HA HIS 9 -11.326 -12.275 -19.610 67 HB2 HIS 9 HB2 HIS 9 -14.187 -12.353 -18.664 68 HB3 HIS 9 HB3 HIS 9 -12.851 -11.999 -17.575 69 HD1 HIS 9 HD1 HIS 9 -12.026 -9.636 -17.525 70 HD2 HIS 9 HD2 HIS 9 -14.492 -10.387 -20.786 71 HE1 HIS 9 HE1 HIS 9 -12.427 -7.397 -18.595 72 HE2 HIS 9 HE2 HIS 9 -13.921 -7.873 -20.567 73 H HIS 10 H HIS 10 -10.346 -13.305 -17.896 74 HA HIS 10 HA HIS 10 -11.290 -15.989 -17.145 75 HB2 HIS 10 HB2 HIS 10 -8.585 -15.264 -18.260 76 HB3 HIS 10 HB3 HIS 10 -8.778 -16.650 -17.191 77 HD1 HIS 10 HD1 HIS 10 -9.915 -18.729 -18.144 78 HD2 HIS 10 HD2 HIS 10 -9.772 -15.547 -20.815 79 HE1 HIS 10 HE1 HIS 10 -10.585 -19.689 -20.371 80 HE2 HIS 10 HE2 HIS 10 -10.491 -17.746 -21.972 81 H GLY 11 H GLY 11 -10.528 -16.729 -15.100 82 HA2 GLY 11 HA2 GLY 11 -9.851 -14.519 -13.287 83 HA3 GLY 11 HA3 GLY 11 -10.585 -16.044 -12.818 84 H SER 12 H SER 12 -7.620 -15.040 -14.526 85 HA SER 12 HA SER 12 -6.088 -17.103 -13.135 86 HB2 SER 12 HB2 SER 12 -5.722 -15.478 -15.576 87 HB3 SER 12 HB3 SER 12 -4.255 -15.813 -14.643 88 HG SER 12 HG SER 12 -4.616 -17.465 -16.153 89 H ALA 13 H ALA 13 -3.951 -16.580 -12.274 90 HA ALA 13 HA ALA 13 -3.319 -13.908 -11.646 91 HB1 ALA 13 HB1 ALA 13 -3.214 -14.344 -9.133 92 HB2 ALA 13 HB2 ALA 13 -4.233 -15.749 -9.451 93 HB3 ALA 13 HB3 ALA 13 -4.821 -14.130 -9.827 94 H THR 14 H THR 14 -1.304 -14.025 -12.392 95 HA THR 14 HA THR 14 0.380 -16.280 -11.806 96 HB THR 14 HB THR 14 0.294 -15.480 -14.108 97 HG1 THR 14 HG1 THR 14 2.231 -16.333 -13.990 98 HG21 THR 14 HG21 THR 14 1.341 -13.365 -14.781 99 HG22 THR 14 HG22 THR 14 1.577 -12.940 -13.086 100 HG23 THR 14 HG23 THR 14 -0.055 -13.085 -13.739 101 H TYR 15 H TYR 15 -0.276 -13.434 -10.261 102 HA TYR 15 HA TYR 15 2.394 -12.897 -9.391 103 HB2 TYR 15 HB2 TYR 15 0.008 -11.361 -9.656 104 HB3 TYR 15 HB3 TYR 15 0.728 -11.153 -8.068 105 HD1 TYR 15 HD1 TYR 15 3.287 -10.616 -8.045 106 HD2 TYR 15 HD2 TYR 15 0.786 -10.098 -11.448 107 HE1 TYR 15 HE1 TYR 15 4.926 -9.053 -9.003 108 HE2 TYR 15 HE2 TYR 15 2.420 -8.536 -12.416 109 HH TYR 15 HH TYR 15 5.568 -8.211 -11.246 110 H THR 16 H THR 16 3.215 -13.238 -7.569 111 HA THR 16 HA THR 16 1.837 -14.971 -5.746 112 HB THR 16 HB THR 16 4.144 -14.973 -4.586 113 HG1 THR 16 HG1 THR 16 5.756 -14.420 -6.366 114 HG21 THR 16 HG21 THR 16 3.304 -16.817 -5.972 115 HG22 THR 16 HG22 THR 16 5.035 -16.575 -6.202 116 HG23 THR 16 HG23 THR 16 3.895 -15.993 -7.415 117 H ARG 17 H ARG 17 1.650 -14.629 -3.486 118 HA ARG 17 HA ARG 17 1.393 -11.884 -2.709 119 HB2 ARG 17 HB2 ARG 17 -0.113 -14.197 -2.224 120 HB3 ARG 17 HB3 ARG 17 0.580 -13.747 -0.672 121 HG2 ARG 17 HG2 ARG 17 -1.371 -12.562 -0.617 122 HG3 ARG 17 HG3 ARG 17 -0.304 -11.360 -1.341 123 HD2 ARG 17 HD2 ARG 17 -2.220 -13.183 -2.793 124 HD3 ARG 17 HD3 ARG 17 -2.400 -11.454 -2.544 125 HE ARG 17 HE ARG 17 -0.562 -12.768 -4.397 126 HH11 ARG 17 HH11 ARG 17 -1.876 -9.761 -3.086 127 HH12 ARG 17 HH12 ARG 17 -1.215 -8.767 -4.435 128 HH21 ARG 17 HH21 ARG 17 -0.023 -9.749 -6.111 129 HH22 ARG 17 HH22 ARG 17 0.268 -11.527 -6.103 130 HA PRO 18 HA PRO 18 5.415 -12.166 -0.567 131 HB2 PRO 18 HB2 PRO 18 4.462 -9.569 0.507 132 HB3 PRO 18 HB3 PRO 18 6.003 -9.965 -0.270 133 HG2 PRO 18 HG2 PRO 18 4.164 -8.560 -1.571 134 HG3 PRO 18 HG3 PRO 18 5.144 -9.783 -2.407 135 HD2 PRO 18 HD2 PRO 18 2.302 -9.934 -1.514 136 HD3 PRO 18 HD3 PRO 18 3.071 -10.600 -2.970 137 H LEU 19 H LEU 19 2.325 -11.308 0.894 138 HA LEU 19 HA LEU 19 3.114 -12.587 3.383 139 HB2 LEU 19 HB2 LEU 19 2.449 -9.862 3.060 140 HB3 LEU 19 HB3 LEU 19 1.158 -10.621 3.926 141 HG LEU 19 HG LEU 19 2.822 -9.479 5.345 142 HD11 LEU 19 HD11 LEU 19 2.373 -12.447 5.673 143 HD12 LEU 19 HD12 LEU 19 1.485 -11.109 6.419 144 HD13 LEU 19 HD13 LEU 19 3.145 -11.460 6.916 145 HD21 LEU 19 HD21 LEU 19 4.804 -10.168 3.932 146 HD22 LEU 19 HD22 LEU 19 4.683 -11.752 4.699 147 HD23 LEU 19 HD23 LEU 19 5.004 -10.321 5.678 148 H ASP 20 H ASP 20 0.985 -12.448 4.698 149 HA ASP 20 HA ASP 20 -1.232 -13.501 3.181 150 HB2 ASP 20 HB2 ASP 20 0.345 -14.900 5.060 151 HB3 ASP 20 HB3 ASP 20 -1.265 -14.674 5.727 152 H THR 21 H THR 21 0.063 -11.671 5.689 153 HA THR 21 HA THR 21 -2.178 -10.101 6.124 154 HB THR 21 HB THR 21 -2.905 -12.169 7.317 155 HG1 THR 21 HG1 THR 21 -3.195 -9.697 8.009 156 HG21 THR 21 HG21 THR 21 -0.876 -12.981 8.302 157 HG22 THR 21 HG22 THR 21 -1.977 -12.561 9.614 158 HG23 THR 21 HG23 THR 21 -0.646 -11.480 9.199 159 H GLY 22 H GLY 22 -1.728 -9.102 8.552 160 HA2 GLY 22 HA2 GLY 22 0.889 -8.694 9.438 161 HA3 GLY 22 HA3 GLY 22 0.451 -7.379 8.355 162 H ASN 23 H ASN 23 0.407 -8.424 11.535 163 HA ASN 23 HA ASN 23 -1.241 -6.240 12.376 164 HB2 ASN 23 HB2 ASN 23 -2.585 -7.804 13.918 165 HB3 ASN 23 HB3 ASN 23 -3.052 -7.718 12.227 166 HD21 ASN 23 HD21 ASN 23 -2.268 -9.409 10.808 167 HD22 ASN 23 HD22 ASN 23 -2.011 -10.995 11.434 168 H ILE 24 H ILE 24 -0.495 -5.256 13.925 169 HA ILE 24 HA ILE 24 1.416 -6.565 15.697 170 HB ILE 24 HB ILE 24 1.088 -3.683 15.904 171 HG12 ILE 24 HG12 ILE 24 2.794 -3.379 13.969 172 HG13 ILE 24 HG13 ILE 24 2.220 -4.949 13.429 173 HG21 ILE 24 HG21 ILE 24 3.371 -5.593 16.016 174 HG22 ILE 24 HG22 ILE 24 2.740 -4.548 17.285 175 HG23 ILE 24 HG23 ILE 24 3.646 -3.856 15.940 176 HD11 ILE 24 HD11 ILE 24 0.920 -2.329 13.307 177 HD12 ILE 24 HD12 ILE 24 -0.120 -3.681 13.790 178 HD13 ILE 24 HD13 ILE 24 0.755 -3.741 12.257 179 H THR 25 H THR 25 -0.781 -7.388 16.248 180 HA THR 25 HA THR 25 -2.115 -5.826 18.337 181 HB THR 25 HB THR 25 -3.634 -6.759 16.744 182 HG1 THR 25 HG1 THR 25 -4.492 -8.573 18.416 183 HG21 THR 25 HG21 THR 25 -2.119 -8.625 15.984 184 HG22 THR 25 HG22 THR 25 -3.826 -9.046 16.129 185 HG23 THR 25 HG23 THR 25 -2.686 -9.547 17.379 186 H THR 26 H THR 26 -0.144 -8.614 17.834 187 HA THR 26 HA THR 26 -0.176 -9.206 20.721 188 HB THR 26 HB THR 26 0.723 -11.206 18.665 189 HG1 THR 26 HG1 THR 26 -1.698 -10.265 18.728 190 HG21 THR 26 HG21 THR 26 1.294 -11.745 20.948 191 HG22 THR 26 HG22 THR 26 -0.006 -12.815 20.420 192 HG23 THR 26 HG23 THR 26 -0.362 -11.447 21.475 193 H GLY 27 H GLY 27 1.963 -9.775 18.002 194 HA2 GLY 27 HA2 GLY 27 4.095 -8.153 18.997 195 HA3 GLY 27 HA3 GLY 27 4.393 -9.857 19.311 196 H PHE 28 H PHE 28 5.121 -7.454 17.229 197 HA PHE 28 HA PHE 28 4.778 -8.732 14.733 198 HB2 PHE 28 HB2 PHE 28 5.358 -6.161 15.492 199 HB3 PHE 28 HB3 PHE 28 6.859 -6.707 14.755 200 HD1 PHE 28 HD1 PHE 28 7.090 -6.383 12.508 201 HD2 PHE 28 HD2 PHE 28 3.169 -6.896 14.064 202 HE1 PHE 28 HE1 PHE 28 6.168 -6.047 10.261 203 HE2 PHE 28 HE2 PHE 28 2.236 -6.561 11.812 204 HZ PHE 28 HZ PHE 28 3.736 -6.140 9.910 205 H ASN 29 H ASN 29 6.363 -9.270 13.219 206 HA ASN 29 HA ASN 29 7.883 -11.388 14.008 207 HB2 ASN 29 HB2 ASN 29 7.680 -9.801 11.510 208 HB3 ASN 29 HB3 ASN 29 8.749 -11.179 11.605 209 HD21 ASN 29 HD21 ASN 29 5.596 -10.073 11.248 210 HD22 ASN 29 HD22 ASN 29 4.813 -11.596 11.095 211 H GLY 30 H GLY 30 8.813 -9.036 15.385 212 HA2 GLY 30 HA2 GLY 30 11.032 -8.897 16.331 213 HA3 GLY 30 HA3 GLY 30 11.684 -9.326 14.753 214 H TYR 31 H TYR 31 9.253 -7.338 14.068 215 HA TYR 31 HA TYR 31 11.010 -4.948 14.014 216 HB2 TYR 31 HB2 TYR 31 8.418 -5.157 12.490 217 HB3 TYR 31 HB3 TYR 31 9.792 -4.127 12.170 218 HD1 TYR 31 HD1 TYR 31 8.747 -7.723 12.094 219 HD2 TYR 31 HD2 TYR 31 11.372 -4.736 10.573 220 HE1 TYR 31 HE1 TYR 31 9.567 -9.309 10.405 221 HE2 TYR 31 HE2 TYR 31 12.199 -6.320 8.886 222 HH TYR 31 HH TYR 31 12.350 -8.733 8.541 223 HA PRO 32 HA PRO 32 7.937 -3.928 17.339 224 HB2 PRO 32 HB2 PRO 32 10.054 -2.565 18.754 225 HB3 PRO 32 HB3 PRO 32 9.201 -4.042 19.215 226 HG2 PRO 32 HG2 PRO 32 11.838 -3.989 18.519 227 HG3 PRO 32 HG3 PRO 32 10.792 -5.410 18.331 228 HD2 PRO 32 HD2 PRO 32 11.648 -3.417 16.272 229 HD3 PRO 32 HD3 PRO 32 11.503 -5.184 16.146 230 H GLY 33 H GLY 33 6.750 -2.122 17.513 231 HA2 GLY 33 HA2 GLY 33 6.386 0.219 17.686 232 HA3 GLY 33 HA3 GLY 33 7.953 0.499 16.949 233 H HIS 34 H HIS 34 6.387 -1.826 15.182 234 HA HIS 34 HA HIS 34 5.891 -0.086 13.000 235 HB2 HIS 34 HB2 HIS 34 6.909 -2.496 13.019 236 HB3 HIS 34 HB3 HIS 34 5.232 -3.019 13.050 237 HD1 HIS 34 HD1 HIS 34 4.661 -3.768 10.747 238 HD2 HIS 34 HD2 HIS 34 7.007 -0.355 10.703 239 HE1 HIS 34 HE1 HIS 34 4.851 -3.043 8.333 240 H VAL 35 H VAL 35 3.934 0.554 12.245 241 HA VAL 35 HA VAL 35 1.573 -0.149 13.843 242 HB VAL 35 HB VAL 35 0.777 1.933 12.232 243 HG11 VAL 35 HG11 VAL 35 1.598 1.690 15.074 244 HG12 VAL 35 HG12 VAL 35 0.033 2.135 14.379 245 HG13 VAL 35 HG13 VAL 35 1.346 3.309 14.427 246 HG21 VAL 35 HG21 VAL 35 3.068 2.345 11.475 247 HG22 VAL 35 HG22 VAL 35 3.577 2.570 13.148 248 HG23 VAL 35 HG23 VAL 35 2.440 3.700 12.415 249 H GLY 36 H GLY 36 2.972 -0.475 10.733 250 HA2 GLY 36 HA2 GLY 36 0.416 -1.471 9.649 251 HA3 GLY 36 HA3 GLY 36 1.628 -0.659 8.666 252 H VAL 37 H VAL 37 1.842 -2.362 7.284 253 HA VAL 37 HA VAL 37 3.379 -4.624 8.326 254 HB VAL 37 HB VAL 37 1.066 -5.363 7.954 255 HG11 VAL 37 HG11 VAL 37 1.416 -4.037 5.388 256 HG12 VAL 37 HG12 VAL 37 -0.062 -4.435 6.269 257 HG13 VAL 37 HG13 VAL 37 0.718 -5.653 5.254 258 HG21 VAL 37 HG21 VAL 37 3.193 -6.557 6.201 259 HG22 VAL 37 HG22 VAL 37 1.602 -7.292 6.386 260 HG23 VAL 37 HG23 VAL 37 2.649 -7.090 7.791 261 H ASP 38 H ASP 38 4.900 -5.555 6.821 262 HA ASP 38 HA ASP 38 5.482 -3.877 4.473 263 HB2 ASP 38 HB2 ASP 38 7.472 -4.820 6.554 264 HB3 ASP 38 HB3 ASP 38 7.924 -4.091 5.015 265 H TYR 39 H TYR 39 5.937 -4.839 2.669 266 HA TYR 39 HA TYR 39 6.256 -7.767 2.650 267 HB2 TYR 39 HB2 TYR 39 5.015 -6.216 0.388 268 HB3 TYR 39 HB3 TYR 39 4.943 -7.932 0.694 269 HD1 TYR 39 HD1 TYR 39 3.838 -4.701 2.142 270 HD2 TYR 39 HD2 TYR 39 2.950 -8.823 1.611 271 HE1 TYR 39 HE1 TYR 39 1.622 -4.348 3.096 272 HE2 TYR 39 HE2 TYR 39 0.724 -8.472 2.573 273 HH TYR 39 HH TYR 39 -0.609 -5.404 3.032 274 H ALA 40 H ALA 40 8.292 -8.146 2.155 275 HA ALA 40 HA ALA 40 10.057 -6.547 0.733 276 HB1 ALA 40 HB1 ALA 40 10.133 -9.533 1.135 277 HB2 ALA 40 HB2 ALA 40 10.855 -8.309 2.181 278 HB3 ALA 40 HB3 ALA 40 11.483 -8.559 0.552 279 H VAL 41 H VAL 41 9.587 -5.811 -1.240 280 HA VAL 41 HA VAL 41 9.291 -7.690 -3.411 281 HB VAL 41 HB VAL 41 6.969 -7.121 -2.760 282 HG11 VAL 41 HG11 VAL 41 7.813 -4.298 -3.337 283 HG12 VAL 41 HG12 VAL 41 7.051 -4.948 -1.885 284 HG13 VAL 41 HG13 VAL 41 6.126 -4.811 -3.381 285 HG21 VAL 41 HG21 VAL 41 6.142 -6.519 -4.987 286 HG22 VAL 41 HG22 VAL 41 7.418 -7.733 -5.060 287 HG23 VAL 41 HG23 VAL 41 7.777 -6.054 -5.462 288 HA PRO 42 HA PRO 42 12.458 -5.096 -5.233 289 HB2 PRO 42 HB2 PRO 42 11.007 -5.753 -7.759 290 HB3 PRO 42 HB3 PRO 42 12.736 -5.864 -7.392 291 HG2 PRO 42 HG2 PRO 42 11.246 -8.053 -7.452 292 HG3 PRO 42 HG3 PRO 42 12.516 -7.846 -6.229 293 HD2 PRO 42 HD2 PRO 42 9.564 -7.669 -5.919 294 HD3 PRO 42 HD3 PRO 42 10.795 -8.207 -4.762 295 H VAL 43 H VAL 43 12.793 -3.222 -5.672 296 HA VAL 43 HA VAL 43 10.901 -1.179 -5.610 297 HB VAL 43 HB VAL 43 13.012 -0.879 -4.615 298 HG11 VAL 43 HG11 VAL 43 15.148 -0.848 -5.852 299 HG12 VAL 43 HG12 VAL 43 14.287 -1.461 -7.264 300 HG13 VAL 43 HG13 VAL 43 14.362 -2.425 -5.788 301 HG21 VAL 43 HG21 VAL 43 12.002 1.059 -6.195 302 HG22 VAL 43 HG22 VAL 43 13.605 0.886 -6.914 303 HG23 VAL 43 HG23 VAL 43 13.450 1.283 -5.201 304 H GLY 44 H GLY 44 10.169 0.262 -7.140 305 HA2 GLY 44 HA2 GLY 44 10.223 1.344 -9.244 306 HA3 GLY 44 HA3 GLY 44 11.125 -0.015 -9.865 307 H THR 45 H THR 45 8.663 -1.296 -8.094 308 HA THR 45 HA THR 45 7.148 -1.917 -10.432 309 HB THR 45 HB THR 45 6.447 -2.870 -7.680 310 HG1 THR 45 HG1 THR 45 8.132 -4.484 -9.173 311 HG21 THR 45 HG21 THR 45 6.262 -4.194 -10.395 312 HG22 THR 45 HG22 THR 45 4.922 -3.427 -9.541 313 HG23 THR 45 HG23 THR 45 5.687 -4.870 -8.871 314 HA PRO 46 HA PRO 46 4.255 1.439 -9.683 315 HB2 PRO 46 HB2 PRO 46 2.334 -0.142 -11.284 316 HB3 PRO 46 HB3 PRO 46 2.929 1.501 -11.546 317 HG2 PRO 46 HG2 PRO 46 3.724 -0.517 -13.102 318 HG3 PRO 46 HG3 PRO 46 4.820 0.805 -12.652 319 HD2 PRO 46 HD2 PRO 46 4.687 -1.982 -11.589 320 HD3 PRO 46 HD3 PRO 46 6.098 -0.955 -11.913 321 H VAL 47 H VAL 47 3.092 1.703 -7.933 322 HA VAL 47 HA VAL 47 1.596 -0.459 -6.779 323 HB VAL 47 HB VAL 47 2.175 2.160 -5.417 324 HG11 VAL 47 HG11 VAL 47 1.674 -0.572 -4.230 325 HG12 VAL 47 HG12 VAL 47 0.428 0.651 -4.469 326 HG13 VAL 47 HG13 VAL 47 1.770 0.963 -3.368 327 HG21 VAL 47 HG21 VAL 47 3.940 -0.272 -5.564 328 HG22 VAL 47 HG22 VAL 47 4.036 0.881 -4.237 329 HG23 VAL 47 HG23 VAL 47 4.358 1.411 -5.887 330 H ARG 48 H ARG 48 -0.386 -0.523 -6.979 331 HA ARG 48 HA ARG 48 -1.806 1.785 -7.884 332 HB2 ARG 48 HB2 ARG 48 -2.628 -1.109 -8.015 333 HB3 ARG 48 HB3 ARG 48 -3.585 0.229 -8.633 334 HG2 ARG 48 HG2 ARG 48 -2.610 -0.442 -10.565 335 HG3 ARG 48 HG3 ARG 48 -1.374 0.694 -10.017 336 HD2 ARG 48 HD2 ARG 48 -0.129 -1.184 -9.016 337 HD3 ARG 48 HD3 ARG 48 -1.348 -2.299 -9.628 338 HE ARG 48 HE ARG 48 0.001 -0.607 -11.578 339 HH11 ARG 48 HH11 ARG 48 0.601 -4.610 -11.418 340 HH12 ARG 48 HH12 ARG 48 -0.279 -3.787 -10.079 341 HH21 ARG 48 HH21 ARG 48 1.377 -3.404 -13.194 342 HH22 ARG 48 HH22 ARG 48 1.116 -1.623 -13.271 343 H ALA 49 H ALA 49 -3.908 2.264 -7.187 344 HA ALA 49 HA ALA 49 -4.060 2.288 -4.368 345 HB1 ALA 49 HB1 ALA 49 -6.106 3.231 -6.371 346 HB2 ALA 49 HB2 ALA 49 -4.763 4.195 -5.755 347 HB3 ALA 49 HB3 ALA 49 -6.039 3.659 -4.661 348 H VAL 50 H VAL 50 -4.994 0.857 -3.097 349 HA VAL 50 HA VAL 50 -6.330 -1.403 -4.050 350 HB VAL 50 HB VAL 50 -6.174 -0.411 -1.255 351 HG11 VAL 50 HG11 VAL 50 -6.603 -2.724 -0.539 352 HG12 VAL 50 HG12 VAL 50 -6.889 -3.171 -2.222 353 HG13 VAL 50 HG13 VAL 50 -7.972 -2.037 -1.415 354 HG21 VAL 50 HG21 VAL 50 -4.393 -2.206 -1.081 355 HG22 VAL 50 HG22 VAL 50 -3.977 -0.757 -1.996 356 HG23 VAL 50 HG23 VAL 50 -4.418 -2.237 -2.845 357 H ALA 51 H ALA 51 -7.588 1.665 -3.343 358 HA ALA 51 HA ALA 51 -10.171 1.042 -4.202 359 HB1 ALA 51 HB1 ALA 51 -11.296 1.788 -2.022 360 HB2 ALA 51 HB2 ALA 51 -9.761 1.371 -1.258 361 HB3 ALA 51 HB3 ALA 51 -10.686 0.134 -2.108 362 H ASN 52 H ASN 52 -11.313 2.833 -4.726 363 HA ASN 52 HA ASN 52 -10.001 5.207 -5.175 364 HB2 ASN 52 HB2 ASN 52 -12.395 6.053 -5.589 365 HB3 ASN 52 HB3 ASN 52 -11.784 4.783 -6.587 366 HD21 ASN 52 HD21 ASN 52 -12.978 4.470 -3.349 367 HD22 ASN 52 HD22 ASN 52 -14.345 3.491 -3.734 368 H GLY 53 H GLY 53 -10.502 7.357 -4.395 369 HA2 GLY 53 HA2 GLY 53 -11.989 8.081 -2.207 370 HA3 GLY 53 HA3 GLY 53 -10.500 7.453 -1.523 371 H THR 54 H THR 54 -9.162 9.020 -0.965 372 HA THR 54 HA THR 54 -8.618 11.230 -2.668 373 HB THR 54 HB THR 54 -9.375 11.631 0.165 374 HG1 THR 54 HG1 THR 54 -11.180 11.003 -1.207 375 HG21 THR 54 HG21 THR 54 -9.457 14.017 -0.378 376 HG22 THR 54 HG22 THR 54 -9.049 13.653 -2.054 377 HG23 THR 54 HG23 THR 54 -7.871 13.355 -0.777 378 H VAL 55 H VAL 55 -6.574 12.020 -2.371 379 HA VAL 55 HA VAL 55 -4.731 10.447 -0.849 380 HB VAL 55 HB VAL 55 -4.066 12.834 -2.568 381 HG11 VAL 55 HG11 VAL 55 -2.258 12.017 -1.145 382 HG12 VAL 55 HG12 VAL 55 -1.900 11.764 -2.854 383 HG13 VAL 55 HG13 VAL 55 -2.426 10.409 -1.852 384 HG21 VAL 55 HG21 VAL 55 -3.669 11.303 -4.454 385 HG22 VAL 55 HG22 VAL 55 -5.363 11.343 -3.972 386 HG23 VAL 55 HG23 VAL 55 -4.346 9.980 -3.504 387 H LYS 56 H LYS 56 -4.452 11.008 1.149 388 HA LYS 56 HA LYS 56 -4.793 13.706 2.103 389 HB2 LYS 56 HB2 LYS 56 -4.054 11.695 4.116 390 HB3 LYS 56 HB3 LYS 56 -5.308 12.915 4.170 391 HG2 LYS 56 HG2 LYS 56 -5.461 10.201 2.884 392 HG3 LYS 56 HG3 LYS 56 -6.306 10.745 4.325 393 HD2 LYS 56 HD2 LYS 56 -6.713 12.171 1.735 394 HD3 LYS 56 HD3 LYS 56 -7.541 10.639 2.016 395 HE2 LYS 56 HE2 LYS 56 -8.476 11.602 4.123 396 HE3 LYS 56 HE3 LYS 56 -7.756 13.149 3.682 397 HZ1 LYS 56 HZ1 LYS 56 -9.782 11.676 2.087 398 HZ2 LYS 56 HZ2 LYS 56 -9.102 13.170 1.680 399 HZ3 LYS 56 HZ3 LYS 56 -10.086 13.034 3.048 400 H PHE 57 H PHE 57 -2.375 11.614 1.199 401 HA PHE 57 HA PHE 57 -0.317 13.451 1.917 402 HB2 PHE 57 HB2 PHE 57 -0.621 11.683 3.858 403 HB3 PHE 57 HB3 PHE 57 0.250 10.632 2.744 404 HD1 PHE 57 HD1 PHE 57 0.484 13.498 4.968 405 HD2 PHE 57 HD2 PHE 57 2.555 11.127 2.103 406 HE1 PHE 57 HE1 PHE 57 2.615 14.493 5.687 407 HE2 PHE 57 HE2 PHE 57 4.687 12.116 2.819 408 HZ PHE 57 HZ PHE 57 4.721 13.802 4.614 409 H ALA 58 H ALA 58 1.363 13.355 0.625 410 HA ALA 58 HA ALA 58 1.832 11.250 -1.231 411 HB1 ALA 58 HB1 ALA 58 0.237 12.444 -2.546 412 HB2 ALA 58 HB2 ALA 58 1.827 12.847 -3.191 413 HB3 ALA 58 HB3 ALA 58 0.981 13.992 -2.150 414 H GLY 59 H GLY 59 3.740 11.014 -0.246 415 HA2 GLY 59 HA2 GLY 59 5.624 13.235 -0.079 416 HA3 GLY 59 HA3 GLY 59 5.812 11.650 0.659 417 H ASN 60 H ASN 60 6.203 13.558 -2.192 418 HA ASN 60 HA ASN 60 7.088 11.547 -3.969 419 HB2 ASN 60 HB2 ASN 60 7.329 14.551 -4.021 420 HB3 ASN 60 HB3 ASN 60 7.921 13.522 -5.320 421 HD21 ASN 60 HD21 ASN 60 5.032 13.188 -3.349 422 HD22 ASN 60 HD22 ASN 60 3.930 13.295 -4.655 423 H GLY 61 H GLY 61 8.839 10.585 -4.114 424 HA2 GLY 61 HA2 GLY 61 11.150 11.165 -2.474 425 HA3 GLY 61 HA3 GLY 61 10.941 9.779 -3.527 426 H ALA 62 H ALA 62 10.198 12.373 -5.376 427 HA ALA 62 HA ALA 62 12.633 12.247 -6.823 428 HB1 ALA 62 HB1 ALA 62 10.267 14.023 -7.298 429 HB2 ALA 62 HB2 ALA 62 10.434 12.378 -7.916 430 HB3 ALA 62 HB3 ALA 62 11.544 13.639 -8.453 431 H ASN 63 H ASN 63 11.194 14.501 -4.632 432 HA ASN 63 HA ASN 63 13.561 16.147 -4.743 433 HB2 ASN 63 HB2 ASN 63 11.231 16.964 -5.940 434 HB3 ASN 63 HB3 ASN 63 11.225 17.762 -4.381 435 HD21 ASN 63 HD21 ASN 63 12.489 17.649 -7.484 436 HD22 ASN 63 HD22 ASN 63 13.595 18.962 -7.351 437 H HIS 64 H HIS 64 12.458 14.187 -2.821 438 HA HIS 64 HA HIS 64 11.523 15.663 -0.642 439 HB2 HIS 64 HB2 HIS 64 11.581 13.515 0.550 440 HB3 HIS 64 HB3 HIS 64 10.676 13.447 -0.932 441 HD1 HIS 64 HD1 HIS 64 11.451 10.823 0.153 442 HD2 HIS 64 HD2 HIS 64 14.050 12.971 -2.279 443 HE1 HIS 64 HE1 HIS 64 13.055 9.130 -0.781 444 HE2 HIS 64 HE2 HIS 64 14.617 10.449 -2.251 445 HA PRO 65 HA PRO 65 15.681 16.729 0.904 446 HB2 PRO 65 HB2 PRO 65 14.038 17.894 3.092 447 HB3 PRO 65 HB3 PRO 65 15.292 18.671 2.101 448 HG2 PRO 65 HG2 PRO 65 12.788 19.296 1.710 449 HG3 PRO 65 HG3 PRO 65 13.843 18.990 0.308 450 HD2 PRO 65 HD2 PRO 65 11.904 17.106 1.633 451 HD3 PRO 65 HD3 PRO 65 12.085 17.537 -0.069 452 H TRP 66 H TRP 66 16.829 16.249 2.825 453 HA TRP 66 HA TRP 66 15.703 13.995 4.254 454 HB2 TRP 66 HB2 TRP 66 18.538 15.015 4.271 455 HB3 TRP 66 HB3 TRP 66 17.941 13.589 5.109 456 HD1 TRP 66 HD1 TRP 66 18.377 14.872 1.476 457 HE1 TRP 66 HE1 TRP 66 18.744 12.839 -0.058 458 HE3 TRP 66 HE3 TRP 66 17.783 11.123 4.919 459 HZ2 TRP 66 HZ2 TRP 66 18.777 10.028 0.158 460 HZ3 TRP 66 HZ3 TRP 66 17.997 8.792 4.164 461 HH2 TRP 66 HH2 TRP 66 18.484 8.257 1.833 462 H MET 67 H MET 67 15.425 17.094 4.473 463 HA MET 67 HA MET 67 16.306 17.680 7.107 464 HB2 MET 67 HB2 MET 67 14.552 19.172 5.175 465 HB3 MET 67 HB3 MET 67 14.911 19.782 6.785 466 HG2 MET 67 HG2 MET 67 17.265 19.887 6.261 467 HG3 MET 67 HG3 MET 67 16.973 19.165 4.680 468 HE1 MET 67 HE1 MET 67 18.195 21.139 3.359 469 HE2 MET 67 HE2 MET 67 18.638 21.746 4.955 470 HE3 MET 67 HE3 MET 67 17.942 22.839 3.759 471 H LEU 68 H LEU 68 13.232 16.994 5.558 472 HA LEU 68 HA LEU 68 12.219 16.393 8.241 473 HB2 LEU 68 HB2 LEU 68 9.997 17.101 7.612 474 HB3 LEU 68 HB3 LEU 68 11.132 18.407 7.390 475 HG LEU 68 HG LEU 68 11.071 17.437 4.874 476 HD11 LEU 68 HD11 LEU 68 8.306 16.950 6.023 477 HD12 LEU 68 HD12 LEU 68 9.412 15.715 5.417 478 HD13 LEU 68 HD13 LEU 68 8.736 16.911 4.312 479 HD21 LEU 68 HD21 LEU 68 9.472 19.254 4.408 480 HD22 LEU 68 HD22 LEU 68 10.756 19.753 5.508 481 HD23 LEU 68 HD23 LEU 68 9.147 19.395 6.135 482 H TRP 69 H TRP 69 13.518 14.862 5.799 483 HA TRP 69 HA TRP 69 11.518 12.716 5.928 484 HB2 TRP 69 HB2 TRP 69 13.156 13.089 3.434 485 HB3 TRP 69 HB3 TRP 69 11.667 12.178 3.641 486 HD1 TRP 69 HD1 TRP 69 12.606 15.933 4.060 487 HE1 TRP 69 HE1 TRP 69 10.799 17.356 2.959 488 HE3 TRP 69 HE3 TRP 69 9.565 12.197 2.328 489 HZ2 TRP 69 HZ2 TRP 69 8.429 16.979 1.501 490 HZ3 TRP 69 HZ3 TRP 69 7.554 12.837 1.080 491 HH2 TRP 69 HH2 TRP 69 6.993 15.175 0.674 492 H MET 70 H MET 70 12.233 10.700 6.256 493 HA MET 70 HA MET 70 15.093 10.118 6.160 494 HB2 MET 70 HB2 MET 70 13.390 10.055 8.632 495 HB3 MET 70 HB3 MET 70 14.732 8.932 8.462 496 HG2 MET 70 HG2 MET 70 15.052 11.905 8.178 497 HG3 MET 70 HG3 MET 70 15.200 11.066 9.720 498 HE1 MET 70 HE1 MET 70 17.711 12.805 8.796 499 HE2 MET 70 HE2 MET 70 18.938 11.622 9.248 500 HE3 MET 70 HE3 MET 70 17.500 11.827 10.248 501 H ALA 71 H ALA 71 11.798 9.153 6.020 502 HA ALA 71 HA ALA 71 12.439 6.313 5.774 503 HB1 ALA 71 HB1 ALA 71 10.543 6.974 7.193 504 HB2 ALA 71 HB2 ALA 71 10.063 5.915 5.867 505 HB3 ALA 71 HB3 ALA 71 9.745 7.646 5.771 506 H GLY 72 H GLY 72 11.464 9.026 3.872 507 HA2 GLY 72 HA2 GLY 72 12.043 9.052 1.515 508 HA3 GLY 72 HA3 GLY 72 11.625 7.351 1.451 509 H ASN 73 H ASN 73 9.987 7.151 0.113 510 HA ASN 73 HA ASN 73 7.996 9.135 -0.294 511 HB2 ASN 73 HB2 ASN 73 8.420 6.376 -1.391 512 HB3 ASN 73 HB3 ASN 73 7.031 7.362 -1.829 513 HD21 ASN 73 HD21 ASN 73 10.531 7.210 -1.864 514 HD22 ASN 73 HD22 ASN 73 10.747 8.219 -3.248 515 H ALA 74 H ALA 74 5.830 9.042 0.150 516 HA ALA 74 HA ALA 74 4.704 6.813 1.539 517 HB1 ALA 74 HB1 ALA 74 3.917 8.116 3.473 518 HB2 ALA 74 HB2 ALA 74 4.868 9.488 2.904 519 HB3 ALA 74 HB3 ALA 74 5.676 8.005 3.410 520 H VAL 75 H VAL 75 2.473 6.711 1.492 521 HA VAL 75 HA VAL 75 1.030 8.917 0.248 522 HB VAL 75 HB VAL 75 0.311 6.197 -0.755 523 HG11 VAL 75 HG11 VAL 75 0.315 8.836 -2.194 524 HG12 VAL 75 HG12 VAL 75 -1.016 8.286 -1.178 525 HG13 VAL 75 HG13 VAL 75 -0.565 7.366 -2.614 526 HG21 VAL 75 HG21 VAL 75 1.813 6.264 -2.619 527 HG22 VAL 75 HG22 VAL 75 2.763 6.361 -1.136 528 HG23 VAL 75 HG23 VAL 75 2.469 7.810 -2.088 529 H LEU 76 H LEU 76 -0.671 9.328 1.415 530 HA LEU 76 HA LEU 76 -2.034 7.139 2.785 531 HB2 LEU 76 HB2 LEU 76 -0.780 9.198 4.036 532 HB3 LEU 76 HB3 LEU 76 -2.398 9.820 3.923 533 HG LEU 76 HG LEU 76 -2.144 7.064 4.975 534 HD11 LEU 76 HD11 LEU 76 -1.204 9.451 6.558 535 HD12 LEU 76 HD12 LEU 76 -0.210 8.095 6.022 536 HD13 LEU 76 HD13 LEU 76 -1.493 7.836 7.205 537 HD21 LEU 76 HD21 LEU 76 -3.726 9.532 5.675 538 HD22 LEU 76 HD22 LEU 76 -3.770 8.054 6.632 539 HD23 LEU 76 HD23 LEU 76 -4.309 8.031 4.952 540 H ILE 77 H ILE 77 -3.992 6.974 2.399 541 HA ILE 77 HA ILE 77 -5.530 8.973 1.039 542 HB ILE 77 HB ILE 77 -4.832 6.283 -0.050 543 HG12 ILE 77 HG12 ILE 77 -5.046 8.714 -1.726 544 HG13 ILE 77 HG13 ILE 77 -3.703 8.609 -0.591 545 HG21 ILE 77 HG21 ILE 77 -6.559 6.395 -1.741 546 HG22 ILE 77 HG22 ILE 77 -7.131 7.932 -1.091 547 HG23 ILE 77 HG23 ILE 77 -7.305 6.455 -0.143 548 HD11 ILE 77 HD11 ILE 77 -2.864 6.652 -1.650 549 HD12 ILE 77 HD12 ILE 77 -3.196 7.841 -2.911 550 HD13 ILE 77 HD13 ILE 77 -4.311 6.501 -2.646 551 H GLN 78 H GLN 78 -7.693 8.682 1.169 552 HA GLN 78 HA GLN 78 -8.704 6.981 3.248 553 HB2 GLN 78 HB2 GLN 78 -9.143 9.359 3.537 554 HB3 GLN 78 HB3 GLN 78 -9.888 9.438 1.952 555 HG2 GLN 78 HG2 GLN 78 -11.371 7.505 3.101 556 HG3 GLN 78 HG3 GLN 78 -10.998 8.495 4.501 557 HE21 GLN 78 HE21 GLN 78 -12.461 8.315 1.439 558 HE22 GLN 78 HE22 GLN 78 -13.453 9.714 1.556 559 H HIS 79 H HIS 79 -9.568 5.199 2.583 560 HA HIS 79 HA HIS 79 -10.211 4.616 -0.090 561 HB2 HIS 79 HB2 HIS 79 -10.315 3.107 2.448 562 HB3 HIS 79 HB3 HIS 79 -11.251 2.499 1.085 563 HD1 HIS 79 HD1 HIS 79 -8.903 3.630 -0.921 564 HD2 HIS 79 HD2 HIS 79 -8.585 0.844 2.136 565 HE1 HIS 79 HE1 HIS 79 -6.819 2.307 -1.429 566 HE2 HIS 79 HE2 HIS 79 -6.660 0.612 0.428 567 H ALA 80 H ALA 80 -12.245 3.131 -0.332 568 HA ALA 80 HA ALA 80 -14.320 4.894 -0.752 569 HB1 ALA 80 HB1 ALA 80 -14.590 1.914 -0.787 570 HB2 ALA 80 HB2 ALA 80 -13.826 2.842 -2.078 571 HB3 ALA 80 HB3 ALA 80 -15.531 3.092 -1.702 572 H ASP 81 H ASP 81 -13.610 3.142 2.042 573 HA ASP 81 HA ASP 81 -16.318 3.244 3.042 574 HB2 ASP 81 HB2 ASP 81 -14.187 1.437 3.407 575 HB3 ASP 81 HB3 ASP 81 -14.639 2.104 4.964 576 H GLY 82 H GLY 82 -13.423 4.898 3.109 577 HA2 GLY 82 HA2 GLY 82 -13.386 7.135 3.982 578 HA3 GLY 82 HA3 GLY 82 -14.371 6.576 5.324 579 H MET 83 H MET 83 -12.378 4.102 4.959 580 HA MET 83 HA MET 83 -10.793 4.715 7.147 581 HB2 MET 83 HB2 MET 83 -9.697 2.519 6.523 582 HB3 MET 83 HB3 MET 83 -11.375 2.487 6.948 583 HG2 MET 83 HG2 MET 83 -11.778 2.578 4.399 584 HG3 MET 83 HG3 MET 83 -10.088 2.090 4.291 585 HE1 MET 83 HE1 MET 83 -10.834 0.201 2.880 586 HE2 MET 83 HE2 MET 83 -12.568 -0.003 3.107 587 HE3 MET 83 HE3 MET 83 -11.470 -1.326 3.489 588 H HIS 84 H HIS 84 -8.364 4.436 7.154 589 HA HIS 84 HA HIS 84 -7.346 5.925 4.898 590 HB2 HIS 84 HB2 HIS 84 -6.415 5.811 7.752 591 HB3 HIS 84 HB3 HIS 84 -5.415 6.492 6.476 592 HD1 HIS 84 HD1 HIS 84 -5.896 8.866 5.781 593 HD2 HIS 84 HD2 HIS 84 -8.840 7.285 8.250 594 HE1 HIS 84 HE1 HIS 84 -7.381 10.804 6.385 595 HE2 HIS 84 HE2 HIS 84 -9.157 9.824 7.877 596 H THR 85 H THR 85 -5.416 5.328 3.862 597 HA THR 85 HA THR 85 -4.251 2.768 4.614 598 HB THR 85 HB THR 85 -4.317 2.950 1.768 599 HG1 THR 85 HG1 THR 85 -6.906 2.514 2.228 600 HG21 THR 85 HG21 THR 85 -5.589 1.064 3.744 601 HG22 THR 85 HG22 THR 85 -4.041 0.869 2.921 602 HG23 THR 85 HG23 THR 85 -5.545 0.787 2.003 603 H GLY 86 H GLY 86 -2.155 2.913 4.640 604 HA2 GLY 86 HA2 GLY 86 -0.853 5.142 3.243 605 HA3 GLY 86 HA3 GLY 86 -0.206 4.310 4.652 606 H TYR 87 H TYR 87 1.111 4.799 2.183 607 HA TYR 87 HA TYR 87 1.903 2.125 1.451 608 HB2 TYR 87 HB2 TYR 87 1.521 4.286 -0.652 609 HB3 TYR 87 HB3 TYR 87 1.851 2.586 -0.921 610 HD1 TYR 87 HD1 TYR 87 0.074 1.241 -1.647 611 HD2 TYR 87 HD2 TYR 87 -0.849 4.768 0.578 612 HE1 TYR 87 HE1 TYR 87 -2.348 0.854 -2.012 613 HE2 TYR 87 HE2 TYR 87 -3.237 4.372 0.216 614 HH TYR 87 HH TYR 87 -4.466 1.440 -0.995 615 H ALA 88 H ALA 88 3.846 2.344 2.523 616 HA ALA 88 HA ALA 88 5.413 4.756 1.881 617 HB1 ALA 88 HB1 ALA 88 5.289 3.272 4.491 618 HB2 ALA 88 HB2 ALA 88 4.747 4.911 4.150 619 HB3 ALA 88 HB3 ALA 88 6.468 4.528 4.125 620 H HIS 89 H HIS 89 7.798 4.479 2.480 621 HA HIS 89 HA HIS 89 9.835 3.690 1.953 622 HB2 HIS 89 HB2 HIS 89 8.466 1.034 2.375 623 HB3 HIS 89 HB3 HIS 89 10.175 1.157 1.963 624 HD1 HIS 89 HD1 HIS 89 11.459 2.986 3.716 625 HD2 HIS 89 HD2 HIS 89 8.116 0.922 5.045 626 HE1 HIS 89 HE1 HIS 89 11.538 3.114 6.229 627 HE2 HIS 89 HE2 HIS 89 9.505 1.855 7.009 628 H LEU 90 H LEU 90 7.774 4.217 -0.096 629 HA LEU 90 HA LEU 90 8.445 2.613 -2.367 630 HB2 LEU 90 HB2 LEU 90 6.909 5.189 -2.389 631 HB3 LEU 90 HB3 LEU 90 6.835 3.889 -3.551 632 HG LEU 90 HG LEU 90 5.911 3.516 -0.702 633 HD11 LEU 90 HD11 LEU 90 4.246 4.404 -3.052 634 HD12 LEU 90 HD12 LEU 90 4.711 5.416 -1.684 635 HD13 LEU 90 HD13 LEU 90 3.661 4.019 -1.433 636 HD21 LEU 90 HD21 LEU 90 4.438 1.821 -1.923 637 HD22 LEU 90 HD22 LEU 90 6.153 1.444 -1.751 638 HD23 LEU 90 HD23 LEU 90 5.533 2.046 -3.287 639 H SER 91 H SER 91 9.052 3.875 -4.470 640 HA SER 91 HA SER 91 11.320 5.546 -3.825 641 HB2 SER 91 HB2 SER 91 11.764 3.407 -5.058 642 HB3 SER 91 HB3 SER 91 10.842 4.062 -6.405 643 HG SER 91 HG SER 91 13.406 4.552 -5.660 644 H LYS 92 H LYS 92 8.209 5.705 -5.136 645 HA LYS 92 HA LYS 92 8.502 8.393 -5.873 646 HB2 LYS 92 HB2 LYS 92 9.210 6.629 -7.892 647 HB3 LYS 92 HB3 LYS 92 7.567 7.103 -8.285 648 HG2 LYS 92 HG2 LYS 92 8.157 9.413 -8.271 649 HG3 LYS 92 HG3 LYS 92 9.783 9.014 -7.710 650 HD2 LYS 92 HD2 LYS 92 10.193 7.778 -9.782 651 HD3 LYS 92 HD3 LYS 92 8.554 8.142 -10.326 652 HE2 LYS 92 HE2 LYS 92 9.941 9.698 -11.429 653 HE3 LYS 92 HE3 LYS 92 9.195 10.595 -10.108 654 HZ1 LYS 92 HZ1 LYS 92 11.935 9.448 -10.095 655 HZ2 LYS 92 HZ2 LYS 92 11.222 10.294 -8.816 656 HZ3 LYS 92 HZ3 LYS 92 11.548 11.086 -10.274 657 H ILE 93 H ILE 93 6.619 9.368 -6.570 658 HA ILE 93 HA ILE 93 4.151 7.934 -6.101 659 HB ILE 93 HB ILE 93 5.169 10.328 -4.818 660 HG12 ILE 93 HG12 ILE 93 3.182 9.606 -3.241 661 HG13 ILE 93 HG13 ILE 93 3.328 8.113 -4.160 662 HG21 ILE 93 HG21 ILE 93 2.299 10.370 -5.583 663 HG22 ILE 93 HG22 ILE 93 3.557 11.412 -6.244 664 HG23 ILE 93 HG23 ILE 93 3.126 11.520 -4.537 665 HD11 ILE 93 HD11 ILE 93 5.286 9.390 -2.300 666 HD12 ILE 93 HD12 ILE 93 5.850 8.300 -3.566 667 HD13 ILE 93 HD13 ILE 93 4.712 7.722 -2.349 668 H SER 94 H SER 94 2.404 8.501 -7.292 669 HA SER 94 HA SER 94 2.872 10.150 -9.640 670 HB2 SER 94 HB2 SER 94 2.245 7.617 -9.751 671 HB3 SER 94 HB3 SER 94 0.630 8.213 -9.355 672 HG SER 94 HG SER 94 1.885 9.576 -11.392 673 H VAL 95 H VAL 95 1.386 10.128 -6.691 674 HA VAL 95 HA VAL 95 -0.896 11.575 -7.539 675 HB VAL 95 HB VAL 95 -1.421 11.239 -4.967 676 HG11 VAL 95 HG11 VAL 95 -2.805 10.570 -6.898 677 HG12 VAL 95 HG12 VAL 95 -2.847 9.406 -5.576 678 HG13 VAL 95 HG13 VAL 95 -1.867 9.081 -7.005 679 HG21 VAL 95 HG21 VAL 95 0.476 10.055 -4.248 680 HG22 VAL 95 HG22 VAL 95 0.429 8.981 -5.647 681 HG23 VAL 95 HG23 VAL 95 -0.802 8.848 -4.392 682 H SER 96 H SER 96 -1.578 12.970 -5.384 683 HA SER 96 HA SER 96 0.507 14.662 -4.473 684 HB2 SER 96 HB2 SER 96 -1.663 15.806 -6.253 685 HB3 SER 96 HB3 SER 96 -0.464 16.748 -5.369 686 HG SER 96 HG SER 96 -0.024 16.264 -7.667 687 H THR 97 H THR 97 -0.040 15.666 -2.638 688 HA THR 97 HA THR 97 -2.040 14.670 -1.037 689 HB THR 97 HB THR 97 -0.858 17.416 -0.673 690 HG1 THR 97 HG1 THR 97 1.011 16.424 -0.688 691 HG21 THR 97 HG21 THR 97 -2.588 16.744 0.951 692 HG22 THR 97 HG22 THR 97 -1.004 16.906 1.711 693 HG23 THR 97 HG23 THR 97 -1.646 15.304 1.343 694 H ASP 98 H ASP 98 -4.154 15.050 -0.828 695 HA ASP 98 HA ASP 98 -6.159 16.140 -0.679 696 HB2 ASP 98 HB2 ASP 98 -4.492 18.388 -1.083 697 HB3 ASP 98 HB3 ASP 98 -5.818 18.532 -2.233 698 H SER 99 H SER 99 -4.518 15.178 -3.409 699 HA SER 99 HA SER 99 -6.515 15.777 -5.350 700 HB2 SER 99 HB2 SER 99 -4.207 13.839 -5.455 701 HB3 SER 99 HB3 SER 99 -5.173 14.358 -6.837 702 HG SER 99 HG SER 99 -4.286 16.344 -6.733 703 H THR 100 H THR 100 -7.872 14.238 -6.376 704 HA THR 100 HA THR 100 -8.805 12.169 -4.660 705 HB THR 100 HB THR 100 -10.431 11.762 -6.599 706 HG1 THR 100 HG1 THR 100 -10.277 13.071 -8.258 707 HG21 THR 100 HG21 THR 100 -10.434 14.350 -5.060 708 HG22 THR 100 HG22 THR 100 -11.051 12.793 -4.500 709 HG23 THR 100 HG23 THR 100 -11.845 13.626 -5.839 710 H VAL 101 H VAL 101 -8.864 10.001 -5.091 711 HA VAL 101 HA VAL 101 -7.232 9.087 -7.279 712 HB VAL 101 HB VAL 101 -6.922 7.104 -5.505 713 HG11 VAL 101 HG11 VAL 101 -4.659 8.002 -5.127 714 HG12 VAL 101 HG12 VAL 101 -5.183 9.522 -5.853 715 HG13 VAL 101 HG13 VAL 101 -5.159 8.044 -6.818 716 HG21 VAL 101 HG21 VAL 101 -6.305 8.032 -3.338 717 HG22 VAL 101 HG22 VAL 101 -8.014 8.280 -3.685 718 HG23 VAL 101 HG23 VAL 101 -6.877 9.616 -3.856 719 H LYS 102 H LYS 102 -7.510 6.727 -7.700 720 HA LYS 102 HA LYS 102 -10.115 5.687 -7.257 721 HB2 LYS 102 HB2 LYS 102 -9.968 6.994 -9.429 722 HB3 LYS 102 HB3 LYS 102 -8.923 5.691 -9.943 723 HG2 LYS 102 HG2 LYS 102 -10.790 4.103 -9.429 724 HG3 LYS 102 HG3 LYS 102 -11.814 5.506 -9.146 725 HD2 LYS 102 HD2 LYS 102 -11.408 6.250 -11.455 726 HD3 LYS 102 HD3 LYS 102 -10.429 4.807 -11.734 727 HE2 LYS 102 HE2 LYS 102 -12.375 3.400 -11.246 728 HE3 LYS 102 HE3 LYS 102 -13.348 4.844 -10.971 729 HZ1 LYS 102 HZ1 LYS 102 -13.664 3.899 -13.193 730 HZ2 LYS 102 HZ2 LYS 102 -12.028 4.155 -13.539 731 HZ3 LYS 102 HZ3 LYS 102 -13.050 5.474 -13.259 732 H GLN 103 H GLN 103 -10.279 3.534 -7.376 733 HA GLN 103 HA GLN 103 -8.188 2.018 -6.456 734 HB2 GLN 103 HB2 GLN 103 -10.722 1.604 -6.343 735 HB3 GLN 103 HB3 GLN 103 -10.530 0.856 -7.915 736 HG2 GLN 103 HG2 GLN 103 -8.755 -0.110 -5.758 737 HG3 GLN 103 HG3 GLN 103 -10.458 -0.541 -5.656 738 HE21 GLN 103 HE21 GLN 103 -9.069 -0.033 -8.729 739 HE22 GLN 103 HE22 GLN 103 -8.962 -1.667 -9.185 740 H GLY 104 H GLY 104 -6.789 0.655 -7.334 741 HA2 GLY 104 HA2 GLY 104 -5.523 -0.499 -8.854 742 HA3 GLY 104 HA3 GLY 104 -6.750 -0.189 -10.026 743 H GLN 105 H GLN 105 -6.162 2.776 -9.026 744 HA GLN 105 HA GLN 105 -4.608 3.503 -11.280 745 HB2 GLN 105 HB2 GLN 105 -6.422 4.875 -10.249 746 HB3 GLN 105 HB3 GLN 105 -5.378 5.156 -8.875 747 HG2 GLN 105 HG2 GLN 105 -3.885 6.463 -10.196 748 HG3 GLN 105 HG3 GLN 105 -4.715 6.005 -11.686 749 HE21 GLN 105 HE21 GLN 105 -5.112 7.687 -8.624 750 HE22 GLN 105 HE22 GLN 105 -6.356 8.754 -9.154 751 H ILE 106 H ILE 106 -2.572 4.215 -11.408 752 HA ILE 106 HA ILE 106 -0.793 3.140 -9.552 753 HB ILE 106 HB ILE 106 -0.298 4.742 -11.983 754 HG12 ILE 106 HG12 ILE 106 0.572 1.915 -11.542 755 HG13 ILE 106 HG13 ILE 106 -1.105 2.253 -11.944 756 HG21 ILE 106 HG21 ILE 106 2.104 4.235 -11.772 757 HG22 ILE 106 HG22 ILE 106 1.789 3.497 -10.200 758 HG23 ILE 106 HG23 ILE 106 1.527 5.226 -10.431 759 HD11 ILE 106 HD11 ILE 106 1.266 3.047 -13.621 760 HD12 ILE 106 HD12 ILE 106 -0.437 3.251 -14.039 761 HD13 ILE 106 HD13 ILE 106 0.251 1.632 -13.895 762 H ILE 107 H ILE 107 -0.798 4.006 -7.679 763 HA ILE 107 HA ILE 107 -0.797 6.827 -7.277 764 HB ILE 107 HB ILE 107 -0.849 6.007 -4.807 765 HG12 ILE 107 HG12 ILE 107 -2.426 3.767 -5.176 766 HG13 ILE 107 HG13 ILE 107 -1.082 3.500 -6.276 767 HG21 ILE 107 HG21 ILE 107 -3.198 5.670 -6.647 768 HG22 ILE 107 HG22 ILE 107 -2.648 7.188 -5.938 769 HG23 ILE 107 HG23 ILE 107 -3.283 5.911 -4.901 770 HD11 ILE 107 HD11 ILE 107 -0.826 2.536 -3.995 771 HD12 ILE 107 HD12 ILE 107 -0.722 4.186 -3.379 772 HD13 ILE 107 HD13 ILE 107 0.488 3.589 -4.516 773 H GLY 108 H GLY 108 1.574 4.538 -7.679 774 HA2 GLY 108 HA2 GLY 108 3.691 6.199 -7.208 775 HA3 GLY 108 HA3 GLY 108 3.450 5.293 -5.722 776 H TYR 109 H TYR 109 5.608 4.661 -6.308 777 HA TYR 109 HA TYR 109 5.690 2.172 -7.731 778 HB2 TYR 109 HB2 TYR 109 7.874 4.255 -7.996 779 HB3 TYR 109 HB3 TYR 109 7.831 2.681 -8.777 780 HD1 TYR 109 HD1 TYR 109 6.785 2.410 -10.884 781 HD2 TYR 109 HD2 TYR 109 6.194 5.999 -8.684 782 HE1 TYR 109 HE1 TYR 109 5.717 3.431 -12.852 783 HE2 TYR 109 HE2 TYR 109 5.124 7.035 -10.646 784 HH TYR 109 HH TYR 109 5.067 6.773 -13.066 785 H THR 110 H THR 110 6.813 0.654 -6.644 786 HA THR 110 HA THR 110 7.330 0.913 -3.928 787 HB THR 110 HB THR 110 8.845 -1.244 -4.612 788 HG1 THR 110 HG1 THR 110 7.123 -0.653 -6.723 789 HG21 THR 110 HG21 THR 110 5.933 -0.904 -4.027 790 HG22 THR 110 HG22 THR 110 7.210 -1.547 -2.990 791 HG23 THR 110 HG23 THR 110 6.599 -2.507 -4.337 792 H GLY 111 H GLY 111 9.299 0.862 -2.656 793 HA2 GLY 111 HA2 GLY 111 11.735 1.526 -4.123 794 HA3 GLY 111 HA3 GLY 111 11.137 2.730 -3.000 795 H ALA 112 H ALA 112 13.373 2.313 -2.221 796 HA ALA 112 HA ALA 112 13.211 0.472 -0.037 797 HB1 ALA 112 HB1 ALA 112 15.845 0.502 -1.424 798 HB2 ALA 112 HB2 ALA 112 14.548 -0.426 -2.177 799 HB3 ALA 112 HB3 ALA 112 15.066 -0.804 -0.529 800 H THR 113 H THR 113 12.834 3.151 0.028 801 HA THR 113 HA THR 113 15.263 4.585 0.591 802 HB THR 113 HB THR 113 13.697 6.460 1.201 803 HG1 THR 113 HG1 THR 113 11.478 5.695 0.126 804 HG21 THR 113 HG21 THR 113 14.592 6.319 -1.050 805 HG22 THR 113 HG22 THR 113 12.903 6.822 -1.120 806 HG23 THR 113 HG23 THR 113 13.343 5.157 -1.505 807 H GLY 114 H GLY 114 13.605 2.395 2.391 808 HA2 GLY 114 HA2 GLY 114 13.944 3.797 4.953 809 HA3 GLY 114 HA3 GLY 114 13.023 2.322 4.702 810 H GLN 115 H GLN 115 14.535 2.120 6.791 811 HA GLN 115 HA GLN 115 17.195 1.181 6.132 812 HB2 GLN 115 HB2 GLN 115 17.404 0.781 8.590 813 HB3 GLN 115 HB3 GLN 115 17.009 2.433 8.161 814 HG2 GLN 115 HG2 GLN 115 14.745 2.155 8.877 815 HG3 GLN 115 HG3 GLN 115 14.976 0.422 9.103 816 HE21 GLN 115 HE21 GLN 115 15.637 3.594 10.363 817 HE22 GLN 115 HE22 GLN 115 16.160 3.084 11.929 818 H VAL 116 H VAL 116 16.951 -0.588 4.887 819 HA VAL 116 HA VAL 116 16.325 -3.077 6.201 820 HB VAL 116 HB VAL 116 14.881 -3.753 4.103 821 HG11 VAL 116 HG11 VAL 116 14.082 -3.891 6.369 822 HG12 VAL 116 HG12 VAL 116 12.833 -3.168 5.355 823 HG13 VAL 116 HG13 VAL 116 13.806 -2.149 6.416 824 HG21 VAL 116 HG21 VAL 116 14.286 -0.793 4.272 825 HG22 VAL 116 HG22 VAL 116 13.404 -1.977 3.307 826 HG23 VAL 116 HG23 VAL 116 15.084 -1.604 2.924 827 H THR 117 H THR 117 16.801 -4.976 4.721 828 HA THR 117 HA THR 117 19.339 -4.525 3.439 829 HB THR 117 HB THR 117 19.189 -7.032 2.961 830 HG1 THR 117 HG1 THR 117 16.691 -6.583 3.859 831 HG21 THR 117 HG21 THR 117 20.473 -6.140 4.830 832 HG22 THR 117 HG22 THR 117 19.658 -7.632 5.301 833 HG23 THR 117 HG23 THR 117 19.015 -6.074 5.821 834 H GLY 118 H GLY 118 16.239 -4.184 2.312 835 HA2 GLY 118 HA2 GLY 118 17.066 -3.996 -0.409 836 HA3 GLY 118 HA3 GLY 118 16.101 -5.439 -0.147 837 HA PRO 119 HA PRO 119 13.201 -1.845 -1.126 838 HB2 PRO 119 HB2 PRO 119 12.034 -3.825 -2.986 839 HB3 PRO 119 HB3 PRO 119 12.549 -2.164 -3.297 840 HG2 PRO 119 HG2 PRO 119 13.970 -4.164 -4.275 841 HG3 PRO 119 HG3 PRO 119 14.777 -2.744 -3.581 842 HD2 PRO 119 HD2 PRO 119 14.251 -5.403 -2.290 843 HD3 PRO 119 HD3 PRO 119 15.776 -4.491 -2.392 844 H HIS 120 H HIS 120 11.052 -1.611 -0.365 845 HA HIS 120 HA HIS 120 9.607 -3.898 0.467 846 HB2 HIS 120 HB2 HIS 120 10.979 -2.091 2.382 847 HB3 HIS 120 HB3 HIS 120 9.357 -2.624 2.807 848 HD1 HIS 120 HD1 HIS 120 12.859 -3.718 2.744 849 HD2 HIS 120 HD2 HIS 120 9.115 -5.478 3.082 850 HE1 HIS 120 HE1 HIS 120 13.285 -6.041 3.609 851 HE2 HIS 120 HE2 HIS 120 11.002 -7.088 3.811 852 H LEU 121 H LEU 121 7.587 -3.503 1.250 853 HA LEU 121 HA LEU 121 6.309 -1.076 0.397 854 HB2 LEU 121 HB2 LEU 121 5.577 -2.600 -1.170 855 HB3 LEU 121 HB3 LEU 121 5.567 -3.930 -0.047 856 HG LEU 121 HG LEU 121 3.508 -2.870 0.994 857 HD11 LEU 121 HD11 LEU 121 3.766 -0.607 0.106 858 HD12 LEU 121 HD12 LEU 121 2.228 -1.310 -0.396 859 HD13 LEU 121 HD13 LEU 121 3.570 -1.222 -1.537 860 HD21 LEU 121 HD21 LEU 121 3.453 -4.803 -0.537 861 HD22 LEU 121 HD22 LEU 121 3.270 -3.691 -1.894 862 HD23 LEU 121 HD23 LEU 121 2.016 -3.789 -0.657 863 H HIS 122 H HIS 122 5.297 -0.061 1.916 864 HA HIS 122 HA HIS 122 4.612 -1.457 4.324 865 HB2 HIS 122 HB2 HIS 122 6.206 0.154 4.960 866 HB3 HIS 122 HB3 HIS 122 5.522 1.376 3.903 867 HD2 HIS 122 HD2 HIS 122 3.038 2.497 4.912 868 HE1 HIS 122 HE1 HIS 122 3.755 1.172 8.863 869 HE2 HIS 122 HE2 HIS 122 2.317 2.649 7.396 870 H PHE 123 H PHE 123 2.583 -1.914 4.431 871 HA PHE 123 HA PHE 123 0.601 -0.043 3.360 872 HB2 PHE 123 HB2 PHE 123 0.805 -2.321 2.221 873 HB3 PHE 123 HB3 PHE 123 0.222 -3.024 3.722 874 HD1 PHE 123 HD1 PHE 123 -0.703 -0.953 0.830 875 HD2 PHE 123 HD2 PHE 123 -2.054 -2.919 4.348 876 HE1 PHE 123 HE1 PHE 123 -3.032 -0.679 0.087 877 HE2 PHE 123 HE2 PHE 123 -4.385 -2.654 3.611 878 HZ PHE 123 HZ PHE 123 -4.876 -1.533 1.476 879 H GLU 124 H GLU 124 -0.315 0.979 4.953 880 HA GLU 124 HA GLU 124 -0.990 -0.316 7.422 881 HB2 GLU 124 HB2 GLU 124 0.785 1.628 7.325 882 HB3 GLU 124 HB3 GLU 124 -0.637 2.649 7.180 883 HG2 GLU 124 HG2 GLU 124 -1.475 1.774 9.306 884 HG3 GLU 124 HG3 GLU 124 -0.042 0.761 9.449 885 H MET 125 H MET 125 -3.000 -0.051 8.102 886 HA MET 125 HA MET 125 -4.876 1.510 6.609 887 HB2 MET 125 HB2 MET 125 -5.289 -0.563 5.687 888 HB3 MET 125 HB3 MET 125 -4.919 -1.365 7.179 889 HG2 MET 125 HG2 MET 125 -7.236 -1.651 6.832 890 HG3 MET 125 HG3 MET 125 -7.061 -0.454 8.109 891 HE1 MET 125 HE1 MET 125 -8.548 -1.459 4.950 892 HE2 MET 125 HE2 MET 125 -7.373 -0.513 4.035 893 HE3 MET 125 HE3 MET 125 -9.058 -0.003 4.106 894 H LEU 126 H LEU 126 -6.344 2.475 7.752 895 HA LEU 126 HA LEU 126 -6.640 1.951 10.573 896 HB2 LEU 126 HB2 LEU 126 -5.451 4.386 9.324 897 HB3 LEU 126 HB3 LEU 126 -6.539 4.655 10.666 898 HG LEU 126 HG LEU 126 -4.931 2.811 11.777 899 HD11 LEU 126 HD11 LEU 126 -3.548 2.640 9.743 900 HD12 LEU 126 HD12 LEU 126 -2.634 3.195 11.147 901 HD13 LEU 126 HD13 LEU 126 -3.135 4.345 9.906 902 HD21 LEU 126 HD21 LEU 126 -3.758 4.680 12.827 903 HD22 LEU 126 HD22 LEU 126 -5.492 4.975 12.708 904 HD23 LEU 126 HD23 LEU 126 -4.384 5.766 11.586 905 HA PRO 127 HA PRO 127 -10.947 3.200 9.886 906 HB2 PRO 127 HB2 PRO 127 -11.359 5.042 11.872 907 HB3 PRO 127 HB3 PRO 127 -11.515 3.315 12.103 908 HG2 PRO 127 HG2 PRO 127 -9.260 5.107 12.790 909 HG3 PRO 127 HG3 PRO 127 -9.870 3.687 13.666 910 HD2 PRO 127 HD2 PRO 127 -7.636 3.571 12.219 911 HD3 PRO 127 HD3 PRO 127 -8.761 2.211 12.284 912 H ALA 128 H ALA 128 -12.396 5.214 9.834 913 HA ALA 128 HA ALA 128 -11.252 7.120 8.124 914 HB1 ALA 128 HB1 ALA 128 -13.907 7.182 9.542 915 HB2 ALA 128 HB2 ALA 128 -13.613 6.453 7.961 916 HB3 ALA 128 HB3 ALA 128 -13.450 8.198 8.173 917 H ASN 129 H ASN 129 -11.755 6.785 11.480 918 HA ASN 129 HA ASN 129 -10.221 9.058 12.196 919 HB2 ASN 129 HB2 ASN 129 -13.167 9.075 12.925 920 HB3 ASN 129 HB3 ASN 129 -11.960 10.051 13.755 921 HD21 ASN 129 HD21 ASN 129 -10.703 11.540 12.371 922 HD22 ASN 129 HD22 ASN 129 -11.523 12.311 11.063 923 HA PRO 130 HA PRO 130 -9.477 5.690 14.785 924 HB2 PRO 130 HB2 PRO 130 -6.939 6.915 15.452 925 HB3 PRO 130 HB3 PRO 130 -7.269 5.415 14.571 926 HG2 PRO 130 HG2 PRO 130 -6.340 7.693 13.354 927 HG3 PRO 130 HG3 PRO 130 -7.228 6.419 12.518 928 HD2 PRO 130 HD2 PRO 130 -8.142 9.078 13.474 929 HD3 PRO 130 HD3 PRO 130 -8.620 8.148 12.038 930 H ASN 131 H ASN 131 -8.841 5.253 16.877 931 HA ASN 131 HA ASN 131 -9.295 7.338 18.834 932 HB2 ASN 131 HB2 ASN 131 -10.884 5.203 18.372 933 HB3 ASN 131 HB3 ASN 131 -9.755 4.555 19.545 934 HD21 ASN 131 HD21 ASN 131 -12.246 6.815 18.899 935 HD22 ASN 131 HD22 ASN 131 -12.575 7.241 20.527 936 H TRP 132 H TRP 132 -6.991 7.588 18.411 937 HA TRP 132 HA TRP 132 -5.073 5.650 18.944 938 HB2 TRP 132 HB2 TRP 132 -4.589 8.593 19.362 939 HB3 TRP 132 HB3 TRP 132 -3.442 7.370 18.834 940 HD1 TRP 132 HD1 TRP 132 -3.822 6.430 16.271 941 HE1 TRP 132 HE1 TRP 132 -4.667 7.685 14.186 942 HE3 TRP 132 HE3 TRP 132 -6.143 10.368 18.562 943 HZ2 TRP 132 HZ2 TRP 132 -6.112 9.982 13.595 944 HZ3 TRP 132 HZ3 TRP 132 -7.242 12.059 17.148 945 HH2 TRP 132 HH2 TRP 132 -7.228 11.871 14.711 946 H GLN 133 H GLN 133 -7.189 6.335 21.053 947 HA GLN 133 HA GLN 133 -5.755 7.133 23.356 948 HB2 GLN 133 HB2 GLN 133 -8.562 6.215 22.852 949 HB3 GLN 133 HB3 GLN 133 -7.954 6.663 24.418 950 HG2 GLN 133 HG2 GLN 133 -8.973 8.624 23.735 951 HG3 GLN 133 HG3 GLN 133 -7.296 8.897 23.269 952 HE21 GLN 133 HE21 GLN 133 -6.734 8.404 21.008 953 HE22 GLN 133 HE22 GLN 133 -7.901 8.628 19.766 954 H ASN 134 H ASN 134 -4.874 4.785 22.111 955 HA ASN 134 HA ASN 134 -3.801 2.887 22.610 956 HB2 ASN 134 HB2 ASN 134 -4.881 3.428 25.374 957 HB3 ASN 134 HB3 ASN 134 -3.932 1.992 24.997 958 HD21 ASN 134 HD21 ASN 134 -3.900 5.505 24.852 959 HD22 ASN 134 HD22 ASN 134 -2.195 5.679 25.021 960 H GLY 135 H GLY 135 -4.301 0.982 21.947 961 HA2 GLY 135 HA2 GLY 135 -6.015 -0.874 22.765 962 HA3 GLY 135 HA3 GLY 135 -7.094 0.249 21.952 963 H PHE 136 H PHE 136 -5.729 1.009 19.742 964 HA PHE 136 HA PHE 136 -4.688 -1.324 18.377 965 HB2 PHE 136 HB2 PHE 136 -6.388 -0.662 16.426 966 HB3 PHE 136 HB3 PHE 136 -6.769 -1.880 17.626 967 HD1 PHE 136 HD1 PHE 136 -9.067 -1.824 17.722 968 HD2 PHE 136 HD2 PHE 136 -6.946 1.868 18.027 969 HE1 PHE 136 HE1 PHE 136 -11.160 -0.655 18.253 970 HE2 PHE 136 HE2 PHE 136 -9.034 3.016 18.539 971 HZ PHE 136 HZ PHE 136 -11.148 1.769 18.663 972 H SER 137 H SER 137 -5.187 2.018 18.621 973 HA SER 137 HA SER 137 -4.158 3.862 17.830 974 HB2 SER 137 HB2 SER 137 -2.018 2.565 18.151 975 HB3 SER 137 HB3 SER 137 -2.156 2.035 16.478 976 HG SER 137 HG SER 137 -2.027 4.741 17.321 977 H GLY 138 H GLY 138 -6.058 2.055 16.528 978 HA2 GLY 138 HA2 GLY 138 -7.521 2.322 14.794 979 HA3 GLY 138 HA3 GLY 138 -6.501 3.602 14.172 980 H ARG 139 H ARG 139 -4.266 1.383 14.527 981 HA ARG 139 HA ARG 139 -4.443 0.620 11.759 982 HB2 ARG 139 HB2 ARG 139 -2.235 -0.593 12.261 983 HB3 ARG 139 HB3 ARG 139 -2.253 1.158 12.352 984 HG2 ARG 139 HG2 ARG 139 -1.095 0.679 14.249 985 HG3 ARG 139 HG3 ARG 139 -2.725 0.671 14.904 986 HD2 ARG 139 HD2 ARG 139 -2.734 -1.819 14.509 987 HD3 ARG 139 HD3 ARG 139 -1.013 -1.681 14.165 988 HE ARG 139 HE ARG 139 -2.309 -1.330 16.758 989 HH11 ARG 139 HH11 ARG 139 0.671 -1.294 14.869 990 HH12 ARG 139 HH12 ARG 139 1.720 -1.364 16.332 991 HH21 ARG 139 HH21 ARG 139 0.788 -1.429 18.412 992 HH22 ARG 139 HH22 ARG 139 -1.003 -1.408 18.611 993 H ILE 140 H ILE 140 -5.235 -1.189 10.921 994 HA ILE 140 HA ILE 140 -5.457 -3.513 12.660 995 HB ILE 140 HB ILE 140 -7.481 -3.580 10.628 996 HG12 ILE 140 HG12 ILE 140 -8.975 -1.973 12.071 997 HG13 ILE 140 HG13 ILE 140 -7.431 -1.235 12.486 998 HG21 ILE 140 HG21 ILE 140 -8.883 -4.253 12.499 999 HG22 ILE 140 HG22 ILE 140 -7.608 -3.777 13.622 1000 HG23 ILE 140 HG23 ILE 140 -7.343 -5.116 12.504 1001 HD11 ILE 140 HD11 ILE 140 -8.470 -0.066 10.644 1002 HD12 ILE 140 HD12 ILE 140 -8.553 -1.569 9.719 1003 HD13 ILE 140 HD13 ILE 140 -6.987 -0.865 10.121 1004 H ASP 141 H ASP 141 -6.306 -5.447 11.051 1005 HA ASP 141 HA ASP 141 -3.934 -6.119 9.642 1006 HB2 ASP 141 HB2 ASP 141 -5.194 -8.293 9.193 1007 HB3 ASP 141 HB3 ASP 141 -4.860 -7.884 10.867 1008 HA PRO 142 HA PRO 142 -5.292 -5.004 5.505 1009 HB2 PRO 142 HB2 PRO 142 -3.362 -6.164 4.065 1010 HB3 PRO 142 HB3 PRO 142 -3.055 -4.745 5.068 1011 HG2 PRO 142 HG2 PRO 142 -2.512 -7.611 5.654 1012 HG3 PRO 142 HG3 PRO 142 -1.475 -6.200 5.922 1013 HD2 PRO 142 HD2 PRO 142 -2.941 -7.346 7.896 1014 HD3 PRO 142 HD3 PRO 142 -2.542 -5.617 7.863 1015 H THR 143 H THR 143 -6.186 -7.710 6.784 1016 HA THR 143 HA THR 143 -6.284 -9.747 4.951 1017 HB THR 143 HB THR 143 -8.420 -10.368 6.239 1018 HG1 THR 143 HG1 THR 143 -9.093 -8.972 7.655 1019 HG21 THR 143 HG21 THR 143 -7.098 -11.128 8.163 1020 HG22 THR 143 HG22 THR 143 -5.789 -10.055 7.665 1021 HG23 THR 143 HG23 THR 143 -6.256 -11.410 6.637 1022 H GLY 144 H GLY 144 -8.138 -6.858 5.040 1023 HA2 GLY 144 HA2 GLY 144 -10.296 -7.753 3.343 1024 HA3 GLY 144 HA3 GLY 144 -9.930 -6.083 3.766 1025 H TYR 145 H TYR 145 -7.131 -6.552 2.948 1026 HA TYR 145 HA TYR 145 -7.375 -6.010 0.129 1027 HB2 TYR 145 HB2 TYR 145 -6.154 -4.302 1.091 1028 HB3 TYR 145 HB3 TYR 145 -5.464 -5.353 2.311 1029 HD1 TYR 145 HD1 TYR 145 -5.186 -4.394 -1.274 1030 HD2 TYR 145 HD2 TYR 145 -3.314 -6.198 2.084 1031 HE1 TYR 145 HE1 TYR 145 -3.052 -4.425 -2.496 1032 HE2 TYR 145 HE2 TYR 145 -1.168 -6.235 0.876 1033 HH TYR 145 HH TYR 145 -0.593 -4.476 -1.905 1034 H ILE 146 H ILE 146 -6.647 -8.574 2.150 1035 HA ILE 146 HA ILE 146 -4.981 -9.918 0.204 1036 HB ILE 146 HB ILE 146 -5.434 -10.758 3.061 1037 HG12 ILE 146 HG12 ILE 146 -4.274 -8.601 3.054 1038 HG13 ILE 146 HG13 ILE 146 -3.196 -9.875 3.596 1039 HG21 ILE 146 HG21 ILE 146 -4.749 -12.629 1.694 1040 HG22 ILE 146 HG22 ILE 146 -3.431 -12.172 2.772 1041 HG23 ILE 146 HG23 ILE 146 -3.376 -11.714 1.070 1042 HD11 ILE 146 HD11 ILE 146 -2.119 -9.884 1.385 1043 HD12 ILE 146 HD12 ILE 146 -2.030 -8.304 2.164 1044 HD13 ILE 146 HD13 ILE 146 -3.195 -8.584 0.867 1045 H ALA 147 H ALA 147 -8.111 -9.759 1.330 1046 HA ALA 147 HA ALA 147 -8.909 -12.474 1.063 1047 HB1 ALA 147 HB1 ALA 147 -11.141 -11.679 1.414 1048 HB2 ALA 147 HB2 ALA 147 -10.627 -10.024 1.091 1049 HB3 ALA 147 HB3 ALA 147 -10.053 -10.861 2.535 1050 H ASN 148 H ASN 148 -8.728 -9.740 -0.990 1051 HA ASN 148 HA ASN 148 -10.049 -11.101 -3.149 1052 HB2 ASN 148 HB2 ASN 148 -9.487 -8.507 -3.977 1053 HB3 ASN 148 HB3 ASN 148 -11.027 -9.080 -3.410 1054 HD21 ASN 148 HD21 ASN 148 -8.020 -8.302 -1.825 1055 HD22 ASN 148 HD22 ASN 148 -8.682 -7.196 -0.682 1056 H ALA 149 H ALA 149 -7.238 -11.122 -1.921 1057 HA ALA 149 HA ALA 149 -5.740 -10.640 -4.283 1058 HB1 ALA 149 HB1 ALA 149 -5.264 -9.665 -1.921 1059 HB2 ALA 149 HB2 ALA 149 -3.933 -10.134 -2.979 1060 HB3 ALA 149 HB3 ALA 149 -4.452 -11.212 -1.677 1061 HA PRO 150 HA PRO 150 -4.938 -14.891 -5.354 1062 HB2 PRO 150 HB2 PRO 150 -2.052 -14.131 -5.374 1063 HB3 PRO 150 HB3 PRO 150 -3.017 -14.922 -6.630 1064 HG2 PRO 150 HG2 PRO 150 -2.396 -12.390 -6.894 1065 HG3 PRO 150 HG3 PRO 150 -4.029 -12.955 -7.294 1066 HD2 PRO 150 HD2 PRO 150 -3.104 -11.467 -4.866 1067 HD3 PRO 150 HD3 PRO 150 -4.601 -11.279 -5.797 1068 H VAL 151 H VAL 151 -3.277 -16.701 -4.930 1069 HA VAL 151 HA VAL 151 -2.944 -17.003 -2.050 1070 HB VAL 151 HB VAL 151 -3.448 -19.109 -4.086 1071 HG11 VAL 151 HG11 VAL 151 -3.375 -20.745 -2.384 1072 HG12 VAL 151 HG12 VAL 151 -3.324 -19.514 -1.120 1073 HG13 VAL 151 HG13 VAL 151 -1.926 -19.748 -2.179 1074 HG21 VAL 151 HG21 VAL 151 -5.595 -19.445 -3.018 1075 HG22 VAL 151 HG22 VAL 151 -5.436 -17.764 -3.537 1076 HG23 VAL 151 HG23 VAL 151 -5.217 -18.188 -1.838 1077 H PHE 152 H PHE 152 -1.054 -17.355 -1.324 1078 HA PHE 152 HA PHE 152 1.214 -17.868 -3.100 1079 HB2 PHE 152 HB2 PHE 152 1.394 -15.777 -1.887 1080 HB3 PHE 152 HB3 PHE 152 1.053 -16.573 -0.358 1081 HD1 PHE 152 HD1 PHE 152 3.537 -16.124 -3.010 1082 HD2 PHE 152 HD2 PHE 152 2.754 -17.664 0.855 1083 HE1 PHE 152 HE1 PHE 152 5.954 -16.449 -2.674 1084 HE2 PHE 152 HE2 PHE 152 5.173 -18.000 1.221 1085 HZ PHE 152 HZ PHE 152 6.775 -17.392 -0.551 1086 H ASN 153 H ASN 153 1.305 -20.044 -3.232 1087 HA ASN 153 HA ASN 153 1.701 -22.213 -2.722 1088 HB2 ASN 153 HB2 ASN 153 3.315 -20.744 -0.678 1089 HB3 ASN 153 HB3 ASN 153 3.241 -22.502 -0.614 1090 HD21 ASN 153 HD21 ASN 153 3.977 -19.786 -2.737 1091 HD22 ASN 153 HD22 ASN 153 5.150 -20.617 -3.695 1092 H GLY 154 H GLY 154 -0.728 -20.913 -1.410 1093 HA2 GLY 154 HA2 GLY 154 -1.101 -22.887 0.764 1094 HA3 GLY 154 HA3 GLY 154 -1.933 -21.338 0.684 1095 H THR 155 H THR 155 -1.436 -24.197 -1.351 1096 HA THR 155 HA THR 155 -4.146 -24.000 -2.347 1097 HB THR 155 HB THR 155 -3.269 -25.712 -3.983 1098 HG1 THR 155 HG1 THR 155 -1.230 -26.315 -3.895 1099 HG21 THR 155 HG21 THR 155 -3.497 -23.412 -4.663 1100 HG22 THR 155 HG22 THR 155 -1.972 -24.038 -5.293 1101 HG23 THR 155 HG23 THR 155 -1.976 -22.998 -3.865 1102 H THR 156 H THR 156 -5.477 -25.021 -1.020 1103 HA THR 156 HA THR 156 -4.832 -27.743 -0.118 1104 HB THR 156 HB THR 156 -6.832 -27.410 1.437 1105 HG1 THR 156 HG1 THR 156 -7.876 -25.623 0.931 1106 HG21 THR 156 HG21 THR 156 -5.515 -26.144 3.090 1107 HG22 THR 156 HG22 THR 156 -4.390 -25.673 1.815 1108 HG23 THR 156 HG23 THR 156 -4.547 -27.371 2.271 1109 HA PRO 157 HA PRO 157 -8.054 -29.062 -2.919 1110 HB2 PRO 157 HB2 PRO 157 -8.171 -31.715 -1.962 1111 HB3 PRO 157 HB3 PRO 157 -7.218 -31.122 -3.325 1112 HG2 PRO 157 HG2 PRO 157 -6.192 -32.082 -0.915 1113 HG3 PRO 157 HG3 PRO 157 -5.302 -31.155 -2.137 1114 HD2 PRO 157 HD2 PRO 157 -6.496 -30.240 0.423 1115 HD3 PRO 157 HD3 PRO 157 -5.052 -29.666 -0.427 1116 H THR 158 H THR 158 -8.356 -30.158 0.371 1117 HA THR 158 HA THR 158 -11.018 -29.240 0.647 1118 HB THR 158 HB THR 158 -11.575 -31.313 -0.450 1119 HG1 THR 158 HG1 THR 158 -13.179 -31.397 0.892 1120 HG21 THR 158 HG21 THR 158 -10.989 -33.500 0.235 1121 HG22 THR 158 HG22 THR 158 -10.237 -32.901 1.710 1122 HG23 THR 158 HG23 THR 158 -9.489 -32.577 0.147 1123 H GLU 159 H GLU 159 -9.025 -31.749 2.053 1124 HA GLU 159 HA GLU 159 -9.449 -30.819 4.726 1125 HB2 GLU 159 HB2 GLU 159 -7.995 -33.138 3.524 1126 HB3 GLU 159 HB3 GLU 159 -7.731 -32.718 5.211 1127 HG2 GLU 159 HG2 GLU 159 -10.105 -32.986 5.665 1128 HG3 GLU 159 HG3 GLU 159 -10.395 -33.370 3.969
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