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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
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655081 |
6m6f ![]() ![]() |
cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 13 HT1 GLY 13 79.850 -0.900 -5.162 2 H2 GLY 13 HT2 GLY 13 79.466 0.339 -4.063 3 H3 GLY 13 HT3 GLY 13 79.765 -1.235 -3.501 4 HA2 GLY 13 HA2 GLY 13 81.586 0.709 -3.487 5 HA3 GLY 13 HA1 GLY 13 81.982 -1.007 -3.566 6 H GLN 14 HN GLN 14 82.063 1.996 -5.224 7 HA GLN 14 HA GLN 14 82.500 0.882 -7.860 8 HB2 GLN 14 HB2 GLN 14 81.501 3.092 -7.666 9 HB3 GLN 14 HB1 GLN 14 82.903 3.680 -6.773 10 HG2 GLN 14 HG2 GLN 14 83.270 2.466 -9.511 11 HG3 GLN 14 HG1 GLN 14 82.735 4.137 -9.358 12 HE21 GLN 14 HE21 GLN 14 85.499 2.108 -9.347 13 HE22 GLN 14 HE22 GLN 14 86.617 3.254 -8.786 14 H VAL 15 HN VAL 15 84.339 -0.004 -8.508 15 HA VAL 15 HA VAL 15 86.900 1.027 -7.463 16 HB VAL 15 HB VAL 15 86.492 -0.897 -6.109 17 HG11 VAL 15 HG11 VAL 15 86.001 -3.115 -7.185 18 HG12 VAL 15 HG12 VAL 15 85.798 -2.269 -8.719 19 HG13 VAL 15 HG13 VAL 15 84.707 -1.931 -7.376 20 HG21 VAL 15 HG21 VAL 15 88.220 -1.975 -8.343 21 HG22 VAL 15 HG22 VAL 15 88.408 -2.201 -6.604 22 HG23 VAL 15 HG23 VAL 15 88.764 -0.635 -7.333 23 H ARG 16 HN ARG 16 88.639 0.847 -8.838 24 HA ARG 16 HA ARG 16 88.190 -0.286 -11.532 25 HB2 ARG 16 HB2 ARG 16 89.084 2.536 -10.921 26 HB3 ARG 16 HB1 ARG 16 89.283 1.769 -12.497 27 HG2 ARG 16 HG2 ARG 16 86.825 1.366 -12.576 28 HG3 ARG 16 HG1 ARG 16 86.659 2.233 -11.049 29 HD2 ARG 16 HD2 ARG 16 87.913 3.423 -13.533 30 HD3 ARG 16 HD1 ARG 16 86.225 3.656 -13.088 31 HE ARG 16 HE ARG 16 88.558 4.831 -11.777 32 HH11 ARG 16 HH11 ARG 16 88.079 6.417 -10.225 33 HH12 ARG 16 HH12 ARG 16 86.445 6.637 -9.696 34 HH21 ARG 16 HH21 ARG 16 85.166 4.130 -11.717 35 HH22 ARG 16 HH22 ARG 16 84.799 5.343 -10.538 36 H GLN 17 HN GLN 17 90.077 -0.876 -12.640 37 HA GLN 17 HA GLN 17 92.507 -1.097 -10.952 38 HB2 GLN 17 HB2 GLN 17 91.579 -2.795 -13.281 39 HB3 GLN 17 HB1 GLN 17 93.074 -3.026 -12.380 40 HG2 GLN 17 HG2 GLN 17 91.759 -3.353 -10.304 41 HG3 GLN 17 HG1 GLN 17 90.275 -3.180 -11.240 42 HE21 GLN 17 HE21 GLN 17 92.310 -4.651 -13.361 43 HE22 GLN 17 HE22 GLN 17 91.973 -6.278 -13.014 44 H ARG 18 HN ARG 18 94.128 0.269 -11.529 45 HA ARG 18 HA ARG 18 94.690 0.659 -14.379 46 HB2 ARG 18 HB2 ARG 18 94.141 2.991 -12.526 47 HB3 ARG 18 HB1 ARG 18 94.703 3.108 -14.189 48 HG2 ARG 18 HG2 ARG 18 92.619 1.898 -14.906 49 HG3 ARG 18 HG1 ARG 18 92.050 2.003 -13.244 50 HD2 ARG 18 HD2 ARG 18 92.249 4.468 -13.339 51 HD3 ARG 18 HD1 ARG 18 92.744 4.346 -15.027 52 HE ARG 18 HE ARG 18 90.054 3.971 -13.973 53 HH11 ARG 18 HH11 ARG 18 88.439 3.751 -15.553 54 HH12 ARG 18 HH12 ARG 18 88.881 3.486 -17.207 55 HH21 ARG 18 HH21 ARG 18 92.292 3.517 -16.573 56 HH22 ARG 18 HH22 ARG 18 91.065 3.351 -17.785 57 H TYR 19 HN TYR 19 96.761 1.621 -14.787 58 HA TYR 19 HA TYR 19 98.722 1.100 -12.646 59 HB2 TYR 19 HB2 TYR 19 98.983 1.601 -15.623 60 HB3 TYR 19 HB1 TYR 19 100.367 1.495 -14.539 61 HD1 TYR 19 HD1 TYR 19 97.358 -0.401 -15.695 62 HD2 TYR 19 HD2 TYR 19 101.270 -0.593 -13.930 63 HE1 TYR 19 HE1 TYR 19 97.329 -2.873 -15.888 64 HE2 TYR 19 HE2 TYR 19 101.236 -3.065 -14.119 65 HH TYR 19 HH TYR 19 98.410 -4.759 -15.498 66 H LEU 20 HN LEU 20 99.842 2.768 -11.661 67 HA LEU 20 HA LEU 20 99.080 5.502 -12.401 68 HB2 LEU 20 HB2 LEU 20 99.861 4.175 -9.959 69 HB3 LEU 20 HB1 LEU 20 100.988 5.490 -10.253 70 HG LEU 20 HG LEU 20 99.010 7.019 -10.581 71 HD11 LEU 20 HD11 LEU 20 97.202 5.587 -11.110 72 HD12 LEU 20 HD12 LEU 20 96.866 6.087 -9.457 73 HD13 LEU 20 HD13 LEU 20 97.560 4.498 -9.772 74 HD21 LEU 20 HD21 LEU 20 98.470 7.116 -8.137 75 HD22 LEU 20 HD22 LEU 20 100.199 6.986 -8.455 76 HD23 LEU 20 HD23 LEU 20 99.288 5.568 -7.931 77 H TYR 21 HN TYR 21 100.253 6.750 -13.646 78 HA TYR 21 HA TYR 21 103.153 6.212 -13.956 79 HB2 TYR 21 HB2 TYR 21 102.267 5.267 -15.927 80 HB3 TYR 21 HB1 TYR 21 101.049 6.528 -16.097 81 HD1 TYR 21 HD1 TYR 21 104.774 6.510 -15.615 82 HD2 TYR 21 HD2 TYR 21 101.458 7.886 -17.963 83 HE1 TYR 21 HE1 TYR 21 106.325 7.819 -17.035 84 HE2 TYR 21 HE2 TYR 21 103.008 9.183 -19.396 85 HH TYR 21 HH TYR 21 106.516 9.225 -18.734 86 H THR 22 HN THR 22 104.312 7.869 -13.496 87 HA THR 22 HA THR 22 103.281 10.608 -13.959 88 HB THR 22 HB THR 22 104.463 9.365 -11.508 89 HG1 THR 22 HG1 THR 22 102.886 10.633 -10.567 90 HG21 THR 22 HG21 THR 22 104.870 12.202 -12.417 91 HG22 THR 22 HG22 THR 22 106.084 11.057 -11.842 92 HG23 THR 22 HG23 THR 22 104.915 11.745 -10.715 93 H SER 23 HN SER 23 104.609 11.819 -15.175 94 HA SER 23 HA SER 23 107.110 10.754 -16.114 95 HB2 SER 23 HB2 SER 23 106.099 13.579 -16.467 96 HB3 SER 23 HB1 SER 23 107.236 12.704 -17.488 97 HG SER 23 HG SER 23 105.026 12.788 -18.271 98 H GLY 24 HN GLY 24 109.205 11.640 -15.752 99 HA2 GLY 24 HA2 GLY 24 109.519 13.631 -13.621 100 HA3 GLY 24 HA1 GLY 24 110.153 12.020 -13.302 101 HA PRO 25 HA PRO 25 113.490 14.619 -15.276 102 HB2 PRO 25 HB2 PRO 25 115.117 13.043 -13.329 103 HB3 PRO 25 HB1 PRO 25 115.125 14.790 -13.645 104 HG2 PRO 25 HG2 PRO 25 114.035 13.787 -11.422 105 HG3 PRO 25 HG1 PRO 25 113.318 15.181 -12.255 106 HD2 PRO 25 HD2 PRO 25 112.425 12.309 -12.279 107 HD3 PRO 25 HD1 PRO 25 111.446 13.794 -12.233 108 H HIS 26 HN HIS 26 115.000 13.931 -16.817 109 HA HIS 26 HA HIS 26 114.560 11.564 -18.167 110 HB2 HIS 26 HB2 HIS 26 117.082 13.230 -18.045 111 HB3 HIS 26 HB1 HIS 26 116.791 11.952 -19.225 112 HD2 HIS 26 HD2 HIS 26 114.589 12.523 -21.047 113 HE1 HIS 26 HE1 HIS 26 114.534 16.654 -20.174 114 HE2 HIS 26 HE2 HIS 26 113.682 14.864 -21.762 115 H GLY 27 HN GLY 27 115.221 9.518 -18.007 116 HA2 GLY 27 HA2 GLY 27 117.508 8.768 -16.351 117 HA3 GLY 27 HA1 GLY 27 115.935 8.180 -15.815 118 H LEU 28 HN LEU 28 116.568 6.000 -16.194 119 HA LEU 28 HA LEU 28 117.564 5.035 -18.656 120 HB2 LEU 28 HB2 LEU 28 115.961 3.658 -16.487 121 HB3 LEU 28 HB1 LEU 28 116.639 2.822 -17.879 122 HG LEU 28 HG LEU 28 118.905 3.799 -17.202 123 HD11 LEU 28 HD11 LEU 28 118.371 5.528 -15.683 124 HD12 LEU 28 HD12 LEU 28 118.961 4.235 -14.645 125 HD13 LEU 28 HD13 LEU 28 117.228 4.523 -14.795 126 HD21 LEU 28 HD21 LEU 28 119.269 2.037 -15.522 127 HD22 LEU 28 HD22 LEU 28 118.249 1.439 -16.832 128 HD23 LEU 28 HD23 LEU 28 117.526 1.889 -15.288 129 H SER 29 HN SER 29 114.294 5.420 -17.384 130 HA SER 29 HA SER 29 113.166 5.693 -19.994 131 HB2 SER 29 HB2 SER 29 113.605 3.149 -19.615 132 HB3 SER 29 HB1 SER 29 112.213 3.242 -18.542 133 HG SER 29 HG SER 29 112.129 4.334 -21.141 134 H SER 30 HN SER 30 110.546 4.959 -19.440 135 HA SER 30 HA SER 30 109.588 7.154 -17.984 136 HB2 SER 30 HB2 SER 30 107.402 6.097 -18.170 137 HB3 SER 30 HB1 SER 30 108.278 5.923 -19.687 138 HG SER 30 HG SER 30 107.794 4.018 -17.657 139 H CYS 31 HN CYS 31 108.319 7.159 -15.994 140 HA CYS 31 HA CYS 31 109.320 5.182 -14.018 141 HB2 CYS 31 HB2 CYS 31 109.239 8.120 -13.999 142 HB3 CYS 31 HB1 CYS 31 108.539 7.423 -12.546 143 H HIS 32 HN HIS 32 107.807 3.843 -13.366 144 HA HIS 32 HA HIS 32 104.989 4.774 -13.170 145 HB2 HIS 32 HB2 HIS 32 106.106 2.003 -13.685 146 HB3 HIS 32 HB1 HIS 32 104.399 2.366 -13.424 147 HD2 HIS 32 HD2 HIS 32 107.112 2.775 -16.220 148 HE1 HIS 32 HE1 HIS 32 103.449 4.217 -17.749 149 HE2 HIS 32 HE2 HIS 32 105.852 3.637 -18.340 150 H LEU 33 HN LEU 33 104.032 4.632 -11.179 151 HA LEU 33 HA LEU 33 105.558 4.360 -8.864 152 HB2 LEU 33 HB2 LEU 33 103.084 5.230 -9.283 153 HB3 LEU 33 HB1 LEU 33 102.648 3.598 -8.794 154 HG LEU 33 HG LEU 33 104.315 5.570 -7.196 155 HD11 LEU 33 HD11 LEU 33 102.336 5.338 -5.610 156 HD12 LEU 33 HD12 LEU 33 101.484 4.539 -6.930 157 HD13 LEU 33 HD13 LEU 33 102.016 6.211 -7.109 158 HD21 LEU 33 HD21 LEU 33 103.705 2.653 -6.814 159 HD22 LEU 33 HD22 LEU 33 103.822 3.690 -5.393 160 HD23 LEU 33 HD23 LEU 33 105.193 3.545 -6.488 161 H GLU 34 HN GLU 34 106.224 2.664 -7.660 162 HA GLU 34 HA GLU 34 105.242 -0.054 -8.333 163 HB2 GLU 34 HB2 GLU 34 107.400 0.455 -9.456 164 HB3 GLU 34 HB1 GLU 34 108.120 0.765 -7.881 165 HG2 GLU 34 HG2 GLU 34 107.580 -1.548 -7.184 166 HG3 GLU 34 HG1 GLU 34 106.897 -1.857 -8.780 167 H ILE 35 HN ILE 35 104.660 -1.196 -6.578 168 HA ILE 35 HA ILE 35 105.613 -0.285 -3.910 169 HB ILE 35 HB ILE 35 103.140 -1.918 -4.568 170 HG12 ILE 35 HG12 ILE 35 103.509 1.004 -3.831 171 HG13 ILE 35 HG11 ILE 35 102.897 0.380 -5.362 172 HG21 ILE 35 HG21 ILE 35 102.580 -1.657 -2.231 173 HG22 ILE 35 HG22 ILE 35 103.936 -0.561 -1.971 174 HG23 ILE 35 HG23 ILE 35 104.227 -2.268 -2.289 175 HD11 ILE 35 HD11 ILE 35 100.967 1.020 -4.090 176 HD12 ILE 35 HD12 ILE 35 101.583 0.226 -2.641 177 HD13 ILE 35 HD13 ILE 35 101.038 -0.741 -4.012 178 H ARG 36 HN ARG 36 106.878 -1.589 -2.783 179 HA ARG 36 HA ARG 36 107.521 -4.248 -3.863 180 HB2 ARG 36 HB2 ARG 36 108.829 -2.300 -2.014 181 HB3 ARG 36 HB1 ARG 36 109.297 -3.993 -1.914 182 HG2 ARG 36 HG2 ARG 36 110.803 -2.857 -3.452 183 HG3 ARG 36 HG1 ARG 36 109.772 -3.948 -4.377 184 HD2 ARG 36 HD2 ARG 36 108.330 -2.106 -5.036 185 HD3 ARG 36 HD1 ARG 36 109.214 -0.993 -3.997 186 HE ARG 36 HE ARG 36 110.011 -1.899 -6.619 187 HH11 ARG 36 HH11 ARG 36 111.948 -1.010 -7.407 188 HH12 ARG 36 HH12 ARG 36 113.041 -0.224 -6.316 189 HH21 ARG 36 HH21 ARG 36 111.057 -0.764 -3.523 190 HH22 ARG 36 HH22 ARG 36 112.534 -0.082 -4.115 191 H GLU 37 HN GLU 37 107.836 -6.024 -2.357 192 HA GLU 37 HA GLU 37 105.531 -6.416 -0.696 193 HB2 GLU 37 HB2 GLU 37 107.973 -8.194 -0.690 194 HB3 GLU 37 HB1 GLU 37 106.287 -8.633 -0.416 195 HG2 GLU 37 HG2 GLU 37 105.807 -8.041 -2.797 196 HG3 GLU 37 HG1 GLU 37 107.528 -7.775 -3.042 197 H ASP 38 HN ASP 38 108.774 -5.338 -0.291 198 HA ASP 38 HA ASP 38 108.976 -5.814 2.530 199 HB2 ASP 38 HB2 ASP 38 110.509 -4.041 0.619 200 HB3 ASP 38 HB1 ASP 38 110.903 -4.188 2.328 201 H GLY 39 HN GLY 39 107.174 -3.721 0.666 202 HA2 GLY 39 HA2 GLY 39 105.587 -2.203 1.501 203 HA3 GLY 39 HA1 GLY 39 106.499 -2.085 3.001 204 H THR 40 HN THR 40 108.600 -1.864 0.361 205 HA THR 40 HA THR 40 108.924 1.004 0.835 206 HB THR 40 HB THR 40 110.810 0.668 -0.902 207 HG1 THR 40 HG1 THR 40 111.406 -1.704 -0.686 208 HG21 THR 40 HG21 THR 40 111.427 0.929 1.366 209 HG22 THR 40 HG22 THR 40 112.202 -0.575 0.866 210 HG23 THR 40 HG23 THR 40 110.720 -0.622 1.822 211 H VAL 41 HN VAL 41 109.051 2.529 -0.966 212 HA VAL 41 HA VAL 41 107.302 1.807 -3.249 213 HB VAL 41 HB VAL 41 107.111 4.235 -1.456 214 HG11 VAL 41 HG11 VAL 41 105.212 4.822 -3.103 215 HG12 VAL 41 HG12 VAL 41 106.002 3.706 -4.216 216 HG13 VAL 41 HG13 VAL 41 106.863 5.133 -3.638 217 HG21 VAL 41 HG21 VAL 41 105.064 2.163 -2.306 218 HG22 VAL 41 HG22 VAL 41 104.832 3.447 -1.119 219 HG23 VAL 41 HG23 VAL 41 105.945 2.121 -0.779 220 H GLY 42 HN GLY 42 107.805 2.705 -5.190 221 HA2 GLY 42 HA2 GLY 42 109.582 4.903 -5.550 222 HA3 GLY 42 HA1 GLY 42 110.423 3.375 -5.804 223 H CYS 43 HN CYS 43 110.479 4.673 -8.014 224 HA CYS 43 HA CYS 43 108.042 4.202 -9.578 225 HB2 CYS 43 HB2 CYS 43 108.708 6.052 -10.704 226 HB3 CYS 43 HB1 CYS 43 110.089 6.173 -9.627 227 H ALA 44 HN ALA 44 108.270 3.210 -11.750 228 HA ALA 44 HA ALA 44 110.378 1.139 -11.917 229 HB1 ALA 44 HB1 ALA 44 108.335 -0.265 -12.940 230 HB2 ALA 44 HB2 ALA 44 107.409 0.764 -11.847 231 HB3 ALA 44 HB3 ALA 44 108.684 -0.274 -11.212 232 H ALA 45 HN ALA 45 111.039 0.636 -13.954 233 HA ALA 45 HA ALA 45 109.982 2.317 -16.166 234 HB1 ALA 45 HB1 ALA 45 112.494 1.551 -16.978 235 HB2 ALA 45 HB2 ALA 45 112.713 1.637 -15.231 236 HB3 ALA 45 HB3 ALA 45 112.153 3.055 -16.116 237 H ASP 46 HN ASP 46 110.195 -0.815 -14.958 238 HA ASP 46 HA ASP 46 110.207 -2.100 -17.605 239 HB2 ASP 46 HB2 ASP 46 111.637 -3.064 -15.852 240 HB3 ASP 46 HB1 ASP 46 110.220 -3.310 -14.832 241 H GLN 47 HN GLN 47 107.989 -0.666 -15.702 242 HA GLN 47 HA GLN 47 105.721 -0.964 -15.283 243 HB2 GLN 47 HB2 GLN 47 106.079 -1.749 -18.173 244 HB3 GLN 47 HB1 GLN 47 104.498 -1.524 -17.428 245 HG2 GLN 47 HG2 GLN 47 105.051 0.780 -16.858 246 HG3 GLN 47 HG1 GLN 47 106.685 0.572 -17.484 247 HE21 GLN 47 HE21 GLN 47 104.017 2.135 -18.350 248 HE22 GLN 47 HE22 GLN 47 104.012 1.885 -20.029 249 H SER 48 HN SER 48 105.649 -2.638 -13.748 250 HA SER 48 HA SER 48 104.955 -5.301 -14.850 251 HB2 SER 48 HB2 SER 48 107.161 -4.693 -13.238 252 HB3 SER 48 HB1 SER 48 106.009 -5.429 -12.134 253 HG SER 48 HG SER 48 106.946 -7.147 -13.015 254 HA PRO 49 HA PRO 49 101.222 -5.454 -12.526 255 HB2 PRO 49 HB2 PRO 49 102.254 -7.569 -10.677 256 HB3 PRO 49 HB1 PRO 49 100.813 -7.582 -11.712 257 HG2 PRO 49 HG2 PRO 49 102.975 -8.983 -12.365 258 HG3 PRO 49 HG1 PRO 49 102.016 -8.148 -13.604 259 HD2 PRO 49 HD2 PRO 49 104.662 -7.357 -12.420 260 HD3 PRO 49 HD1 PRO 49 104.078 -7.206 -14.092 261 H GLU 50 HN GLU 50 104.096 -5.446 -10.458 262 HA GLU 50 HA GLU 50 102.921 -4.720 -8.034 263 HB2 GLU 50 HB2 GLU 50 105.317 -3.347 -7.928 264 HB3 GLU 50 HB1 GLU 50 105.137 -5.056 -7.572 265 HG2 GLU 50 HG2 GLU 50 105.739 -5.662 -9.830 266 HG3 GLU 50 HG1 GLU 50 105.739 -3.969 -10.331 267 H SER 51 HN SER 51 103.359 -2.872 -10.924 268 HA SER 51 HA SER 51 102.906 -0.317 -9.586 269 HB2 SER 51 HB2 SER 51 103.400 -1.096 -12.463 270 HB3 SER 51 HB1 SER 51 103.037 0.550 -11.961 271 HG SER 51 HG SER 51 104.857 -0.098 -10.334 272 H LEU 52 HN LEU 52 100.938 -2.749 -10.184 273 HA LEU 52 HA LEU 52 98.766 -1.215 -11.460 274 HB2 LEU 52 HB2 LEU 52 99.504 -3.699 -11.987 275 HB3 LEU 52 HB1 LEU 52 98.548 -4.081 -10.558 276 HG LEU 52 HG LEU 52 97.559 -2.563 -12.984 277 HD11 LEU 52 HD11 LEU 52 96.705 -5.291 -12.011 278 HD12 LEU 52 HD12 LEU 52 97.987 -5.072 -13.202 279 HD13 LEU 52 HD13 LEU 52 96.347 -4.531 -13.559 280 HD21 LEU 52 HD21 LEU 52 96.272 -3.333 -10.367 281 HD22 LEU 52 HD22 LEU 52 95.319 -3.010 -11.815 282 HD23 LEU 52 HD23 LEU 52 96.336 -1.747 -11.134 283 H LEU 53 HN LEU 53 97.513 -0.075 -10.133 284 HA LEU 53 HA LEU 53 97.017 -1.092 -7.376 285 HB2 LEU 53 HB2 LEU 53 96.954 1.784 -8.301 286 HB3 LEU 53 HB1 LEU 53 96.872 1.183 -6.646 287 HG LEU 53 HG LEU 53 99.246 0.831 -8.501 288 HD11 LEU 53 HD11 LEU 53 100.335 2.501 -7.061 289 HD12 LEU 53 HD12 LEU 53 98.851 2.673 -6.124 290 HD13 LEU 53 HD13 LEU 53 98.893 3.180 -7.814 291 HD21 LEU 53 HD21 LEU 53 100.322 0.273 -6.206 292 HD22 LEU 53 HD22 LEU 53 99.305 -0.955 -6.951 293 HD23 LEU 53 HD23 LEU 53 98.666 0.041 -5.641 294 H GLN 54 HN GLN 54 94.941 -1.493 -6.865 295 HA GLN 54 HA GLN 54 92.874 -0.567 -8.779 296 HB2 GLN 54 HB2 GLN 54 91.392 -2.237 -7.842 297 HB3 GLN 54 HB1 GLN 54 92.909 -3.000 -8.297 298 HG2 GLN 54 HG2 GLN 54 93.648 -2.801 -5.915 299 HG3 GLN 54 HG1 GLN 54 92.038 -2.222 -5.505 300 HE21 GLN 54 HE21 GLN 54 90.956 -4.116 -7.710 301 HE22 GLN 54 HE22 GLN 54 90.938 -5.633 -6.947 302 H LEU 55 HN LEU 55 91.868 1.219 -8.336 303 HA LEU 55 HA LEU 55 91.948 2.293 -5.641 304 HB2 LEU 55 HB2 LEU 55 91.164 4.353 -6.603 305 HB3 LEU 55 HB1 LEU 55 92.494 3.718 -7.565 306 HG LEU 55 HG LEU 55 90.354 2.538 -8.831 307 HD11 LEU 55 HD11 LEU 55 89.351 5.337 -8.333 308 HD12 LEU 55 HD12 LEU 55 88.911 4.039 -7.228 309 HD13 LEU 55 HD13 LEU 55 88.477 3.927 -8.933 310 HD21 LEU 55 HD21 LEU 55 91.686 5.210 -9.317 311 HD22 LEU 55 HD22 LEU 55 90.565 4.490 -10.473 312 HD23 LEU 55 HD23 LEU 55 92.065 3.658 -10.062 313 H LYS 56 HN LYS 56 90.389 2.126 -4.211 314 HA LYS 56 HA LYS 56 87.673 1.341 -5.118 315 HB2 LYS 56 HB2 LYS 56 89.031 0.973 -2.429 316 HB3 LYS 56 HB1 LYS 56 87.385 0.472 -2.822 317 HG2 LYS 56 HG2 LYS 56 88.231 -1.032 -4.564 318 HG3 LYS 56 HG1 LYS 56 89.876 -0.493 -4.252 319 HD2 LYS 56 HD2 LYS 56 89.703 -2.519 -3.047 320 HD3 LYS 56 HD1 LYS 56 89.494 -1.267 -1.825 321 HE2 LYS 56 HE2 LYS 56 87.129 -1.591 -1.751 322 HE3 LYS 56 HE1 LYS 56 87.139 -2.551 -3.230 323 HZ1 LYS 56 HZ1 LYS 56 88.619 -3.391 -0.813 324 HZ2 LYS 56 HZ2 LYS 56 88.169 -4.329 -2.156 325 HZ3 LYS 56 HZ3 LYS 56 86.991 -3.799 -1.051 326 H ALA 57 HN ALA 57 85.973 2.616 -4.627 327 HA ALA 57 HA ALA 57 86.553 5.260 -3.520 328 HB1 ALA 57 HB1 ALA 57 84.502 5.927 -4.475 329 HB2 ALA 57 HB2 ALA 57 83.891 4.272 -4.526 330 HB3 ALA 57 HB3 ALA 57 85.175 4.770 -5.626 331 H LEU 58 HN LEU 58 86.526 5.433 -1.361 332 HA LEU 58 HA LEU 58 84.855 3.746 0.299 333 HB2 LEU 58 HB2 LEU 58 86.449 6.195 1.089 334 HB3 LEU 58 HB1 LEU 58 85.826 4.948 2.166 335 HG LEU 58 HG LEU 58 87.919 4.558 0.007 336 HD11 LEU 58 HD11 LEU 58 89.058 5.603 1.758 337 HD12 LEU 58 HD12 LEU 58 89.227 3.908 2.210 338 HD13 LEU 58 HD13 LEU 58 88.012 4.911 2.997 339 HD21 LEU 58 HD21 LEU 58 88.100 2.282 1.289 340 HD22 LEU 58 HD22 LEU 58 86.806 2.488 0.111 341 HD23 LEU 58 HD23 LEU 58 86.462 2.648 1.834 342 H LYS 59 HN LYS 59 85.129 7.254 -0.161 343 HA LYS 59 HA LYS 59 82.213 7.535 0.201 344 HB2 LYS 59 HB2 LYS 59 84.209 9.481 1.368 345 HB3 LYS 59 HB1 LYS 59 82.489 9.366 1.697 346 HG2 LYS 59 HG2 LYS 59 82.759 7.317 2.915 347 HG3 LYS 59 HG1 LYS 59 84.438 7.157 2.403 348 HD2 LYS 59 HD2 LYS 59 83.637 9.653 3.881 349 HD3 LYS 59 HD1 LYS 59 83.842 8.164 4.800 350 HE2 LYS 59 HE2 LYS 59 85.965 9.063 2.856 351 HE3 LYS 59 HE1 LYS 59 85.906 9.716 4.493 352 HZ1 LYS 59 HZ1 LYS 59 86.971 7.286 3.676 353 HZ2 LYS 59 HZ2 LYS 59 85.580 6.921 4.580 354 HZ3 LYS 59 HZ3 LYS 59 86.815 7.869 5.262 355 HA PRO 60 HA PRO 60 82.455 10.065 -3.445 356 HB2 PRO 60 HB2 PRO 60 81.091 12.315 -2.025 357 HB3 PRO 60 HB1 PRO 60 80.634 11.491 -3.528 358 HG2 PRO 60 HG2 PRO 60 79.329 11.077 -1.216 359 HG3 PRO 60 HG1 PRO 60 79.538 9.801 -2.427 360 HD2 PRO 60 HD2 PRO 60 80.915 10.141 0.201 361 HD3 PRO 60 HD1 PRO 60 80.525 8.655 -0.693 362 H GLY 61 HN GLY 61 84.367 10.929 -4.031 363 HA2 GLY 61 HA2 GLY 61 85.885 12.723 -4.239 364 HA3 GLY 61 HA1 GLY 61 85.346 13.353 -2.689 365 H VAL 62 HN VAL 62 85.660 10.372 -1.731 366 HA VAL 62 HA VAL 62 88.603 10.517 -1.285 367 HB VAL 62 HB VAL 62 86.398 9.568 0.564 368 HG11 VAL 62 HG11 VAL 62 88.337 9.195 2.169 369 HG12 VAL 62 HG12 VAL 62 89.415 9.345 0.782 370 HG13 VAL 62 HG13 VAL 62 88.235 8.035 0.845 371 HG21 VAL 62 HG21 VAL 62 88.506 11.677 1.050 372 HG22 VAL 62 HG22 VAL 62 87.016 11.393 1.953 373 HG23 VAL 62 HG23 VAL 62 86.947 12.065 0.324 374 H ILE 63 HN ILE 63 89.760 8.779 -1.877 375 HA ILE 63 HA ILE 63 88.361 6.212 -2.338 376 HB ILE 63 HB ILE 63 89.512 5.891 -4.419 377 HG12 ILE 63 HG12 ILE 63 90.868 7.961 -5.296 378 HG13 ILE 63 HG11 ILE 63 90.975 8.415 -3.602 379 HG21 ILE 63 HG21 ILE 63 88.580 7.789 -5.728 380 HG22 ILE 63 HG22 ILE 63 88.329 8.672 -4.223 381 HG23 ILE 63 HG23 ILE 63 87.442 7.180 -4.527 382 HD11 ILE 63 HD11 ILE 63 91.721 5.594 -4.155 383 HD12 ILE 63 HD12 ILE 63 92.524 6.799 -3.152 384 HD13 ILE 63 HD13 ILE 63 92.770 6.799 -4.893 385 H GLN 64 HN GLN 64 89.898 4.404 -2.575 386 HA GLN 64 HA GLN 64 92.331 4.716 -0.896 387 HB2 GLN 64 HB2 GLN 64 90.439 3.599 0.301 388 HB3 GLN 64 HB1 GLN 64 90.437 2.351 -0.939 389 HG2 GLN 64 HG2 GLN 64 92.720 1.727 -0.380 390 HG3 GLN 64 HG1 GLN 64 92.835 3.054 0.777 391 HE21 GLN 64 HE21 GLN 64 93.206 0.339 1.621 392 HE22 GLN 64 HE22 GLN 64 91.904 -0.086 2.623 393 H ILE 65 HN ILE 65 94.132 3.478 -1.593 394 HA ILE 65 HA ILE 65 93.779 2.101 -4.206 395 HB ILE 65 HB ILE 65 96.313 2.746 -4.430 396 HG12 ILE 65 HG12 ILE 65 95.308 4.859 -2.489 397 HG13 ILE 65 HG11 ILE 65 96.504 3.620 -2.117 398 HG21 ILE 65 HG21 ILE 65 94.118 4.822 -4.686 399 HG22 ILE 65 HG22 ILE 65 94.485 3.568 -5.871 400 HG23 ILE 65 HG23 ILE 65 95.660 4.841 -5.541 401 HD11 ILE 65 HD11 ILE 65 97.755 4.589 -4.220 402 HD12 ILE 65 HD12 ILE 65 97.860 5.438 -2.677 403 HD13 ILE 65 HD13 ILE 65 96.749 6.007 -3.922 404 H LEU 66 HN LEU 66 94.154 0.074 -4.199 405 HA LEU 66 HA LEU 66 95.849 -1.131 -2.095 406 HB2 LEU 66 HB2 LEU 66 93.268 -1.556 -2.248 407 HB3 LEU 66 HB1 LEU 66 93.678 -2.570 -3.618 408 HG LEU 66 HG LEU 66 94.304 -2.962 -0.708 409 HD11 LEU 66 HD11 LEU 66 92.371 -4.072 -1.797 410 HD12 LEU 66 HD12 LEU 66 93.557 -5.233 -1.199 411 HD13 LEU 66 HD13 LEU 66 93.485 -4.853 -2.922 412 HD21 LEU 66 HD21 LEU 66 95.899 -4.753 -1.312 413 HD22 LEU 66 HD22 LEU 66 96.531 -3.169 -1.692 414 HD23 LEU 66 HD23 LEU 66 95.891 -4.195 -2.977 415 H GLY 67 HN GLY 67 97.636 -2.257 -2.851 416 HA2 GLY 67 HA2 GLY 67 98.029 -2.464 -5.730 417 HA3 GLY 67 HA1 GLY 67 99.178 -2.932 -4.483 418 H VAL 68 HN VAL 68 97.266 -4.151 -6.867 419 HA VAL 68 HA VAL 68 96.052 -6.395 -5.668 420 HB VAL 68 HB VAL 68 95.885 -7.263 -7.951 421 HG11 VAL 68 HG11 VAL 68 94.250 -5.615 -7.328 422 HG12 VAL 68 HG12 VAL 68 94.796 -5.200 -8.953 423 HG13 VAL 68 HG13 VAL 68 95.401 -4.300 -7.562 424 HG21 VAL 68 HG21 VAL 68 98.019 -6.753 -8.882 425 HG22 VAL 68 HG22 VAL 68 97.864 -5.041 -8.484 426 HG23 VAL 68 HG23 VAL 68 96.874 -5.743 -9.760 427 H LYS 69 HN LYS 69 99.242 -6.051 -7.221 428 HA LYS 69 HA LYS 69 99.940 -8.788 -7.100 429 HB2 LYS 69 HB2 LYS 69 101.118 -6.994 -8.442 430 HB3 LYS 69 HB1 LYS 69 101.859 -6.465 -6.930 431 HG2 LYS 69 HG2 LYS 69 102.612 -8.929 -6.656 432 HG3 LYS 69 HG1 LYS 69 102.201 -9.101 -8.359 433 HD2 LYS 69 HD2 LYS 69 103.752 -7.280 -8.928 434 HD3 LYS 69 HD1 LYS 69 104.138 -7.083 -7.219 435 HE2 LYS 69 HE2 LYS 69 105.887 -8.443 -8.035 436 HE3 LYS 69 HE1 LYS 69 104.784 -9.583 -7.262 437 HZ1 LYS 69 HZ1 LYS 69 103.876 -10.177 -9.355 438 HZ2 LYS 69 HZ2 LYS 69 105.566 -10.233 -9.523 439 HZ3 LYS 69 HZ3 LYS 69 104.691 -8.921 -10.152 440 H THR 70 HN THR 70 100.687 -6.087 -4.928 441 HA THR 70 HA THR 70 101.985 -7.852 -3.009 442 HB THR 70 HB THR 70 102.134 -5.554 -1.759 443 HG1 THR 70 HG1 THR 70 100.656 -4.411 -2.915 444 HG21 THR 70 HG21 THR 70 103.521 -5.754 -4.435 445 HG22 THR 70 HG22 THR 70 103.972 -6.732 -3.043 446 HG23 THR 70 HG23 THR 70 104.114 -4.983 -2.965 447 H SER 71 HN SER 71 98.851 -6.510 -3.499 448 HA SER 71 HA SER 71 96.946 -6.536 -2.238 449 HB2 SER 71 HB2 SER 71 97.051 -8.869 -2.007 450 HB3 SER 71 HB1 SER 71 98.487 -8.804 -0.994 451 HG SER 71 HG SER 71 96.939 -9.053 0.469 452 H ARG 72 HN ARG 72 99.389 -4.906 -1.519 453 HA ARG 72 HA ARG 72 98.919 -4.396 1.354 454 HB2 ARG 72 HB2 ARG 72 101.164 -3.642 -0.530 455 HB3 ARG 72 HB1 ARG 72 101.000 -2.963 1.083 456 HG2 ARG 72 HG2 ARG 72 101.146 -5.199 2.075 457 HG3 ARG 72 HG1 ARG 72 101.236 -5.920 0.471 458 HD2 ARG 72 HD2 ARG 72 103.336 -4.749 0.021 459 HD3 ARG 72 HD1 ARG 72 103.230 -3.920 1.566 460 HE ARG 72 HE ARG 72 104.123 -5.806 2.544 461 HH11 ARG 72 HH11 ARG 72 104.898 -7.928 2.565 462 HH12 ARG 72 HH12 ARG 72 104.533 -8.993 1.249 463 HH21 ARG 72 HH21 ARG 72 102.684 -6.637 -0.489 464 HH22 ARG 72 HH22 ARG 72 103.282 -8.261 -0.480 465 H PHE 73 HN PHE 73 98.137 -2.429 2.042 466 HA PHE 73 HA PHE 73 96.913 -0.699 0.032 467 HB2 PHE 73 HB2 PHE 73 97.039 -0.278 3.030 468 HB3 PHE 73 HB1 PHE 73 95.884 0.412 1.894 469 HD1 PHE 73 HD1 PHE 73 96.822 -2.530 3.836 470 HD2 PHE 73 HD2 PHE 73 94.135 -1.015 0.844 471 HE1 PHE 73 HE1 PHE 73 95.339 -4.486 4.182 472 HE2 PHE 73 HE2 PHE 73 92.651 -2.976 1.193 473 HZ PHE 73 HZ PHE 73 93.252 -4.709 2.862 474 H LEU 74 HN LEU 74 97.724 1.244 -0.628 475 HA LEU 74 HA LEU 74 100.371 2.006 0.379 476 HB2 LEU 74 HB2 LEU 74 100.238 2.017 -1.997 477 HB3 LEU 74 HB1 LEU 74 98.709 2.883 -1.985 478 HG LEU 74 HG LEU 74 99.760 4.916 -1.246 479 HD11 LEU 74 HD11 LEU 74 101.365 4.308 0.358 480 HD12 LEU 74 HD12 LEU 74 102.367 4.824 -0.990 481 HD13 LEU 74 HD13 LEU 74 102.110 3.106 -0.697 482 HD21 LEU 74 HD21 LEU 74 101.544 5.207 -3.037 483 HD22 LEU 74 HD22 LEU 74 99.996 4.602 -3.618 484 HD23 LEU 74 HD23 LEU 74 101.348 3.493 -3.403 485 H CYS 75 HN CYS 75 100.379 3.193 2.155 486 HA CYS 75 HA CYS 75 98.430 5.416 2.397 487 HB2 CYS 75 HB2 CYS 75 99.706 4.020 4.738 488 HB3 CYS 75 HB1 CYS 75 98.307 5.089 4.733 489 H GLN 76 HN GLN 76 99.183 7.355 3.290 490 HA GLN 76 HA GLN 76 102.102 7.720 3.066 491 HB2 GLN 76 HB2 GLN 76 100.731 9.107 1.574 492 HB3 GLN 76 HB1 GLN 76 99.858 9.749 2.966 493 HG2 GLN 76 HG2 GLN 76 101.855 10.774 3.841 494 HG3 GLN 76 HG1 GLN 76 102.860 9.975 2.636 495 HE21 GLN 76 HE21 GLN 76 103.338 11.247 0.844 496 HE22 GLN 76 HE22 GLN 76 102.411 12.565 0.310 497 H ARG 77 HN ARG 77 103.278 8.280 4.790 498 HA ARG 77 HA ARG 77 102.001 8.355 7.378 499 HB2 ARG 77 HB2 ARG 77 104.162 8.037 8.260 500 HB3 ARG 77 HB1 ARG 77 104.212 7.196 6.723 501 HG2 ARG 77 HG2 ARG 77 105.215 9.232 5.689 502 HG3 ARG 77 HG1 ARG 77 105.294 9.959 7.291 503 HD2 ARG 77 HD2 ARG 77 106.567 7.307 6.586 504 HD3 ARG 77 HD1 ARG 77 107.431 8.842 6.579 505 HE ARG 77 HE ARG 77 106.340 8.776 9.067 506 HH11 ARG 77 HH11 ARG 77 107.314 7.802 10.865 507 HH12 ARG 77 HH12 ARG 77 108.452 6.515 10.639 508 HH21 ARG 77 HH21 ARG 77 108.208 6.555 7.179 509 HH22 ARG 77 HH22 ARG 77 108.957 5.808 8.551 510 HA PRO 78 HA PRO 78 101.741 12.701 8.160 511 HB2 PRO 78 HB2 PRO 78 103.805 12.499 10.331 512 HB3 PRO 78 HB1 PRO 78 102.180 13.213 10.383 513 HG2 PRO 78 HG2 PRO 78 102.629 10.861 11.489 514 HG3 PRO 78 HG1 PRO 78 101.140 11.151 10.570 515 HD2 PRO 78 HD2 PRO 78 103.593 9.632 9.749 516 HD3 PRO 78 HD1 PRO 78 101.883 9.270 9.424 517 H ASP 79 HN ASP 79 105.075 11.498 8.160 518 HA ASP 79 HA ASP 79 106.332 13.970 7.596 519 HB2 ASP 79 HB2 ASP 79 107.233 11.155 6.920 520 HB3 ASP 79 HB1 ASP 79 108.242 12.593 6.873 521 H GLY 80 HN GLY 80 104.262 12.043 5.775 522 HA2 GLY 80 HA2 GLY 80 103.394 12.569 3.661 523 HA3 GLY 80 HA1 GLY 80 104.777 13.622 3.374 524 H ALA 81 HN ALA 81 105.660 10.558 4.598 525 HA ALA 81 HA ALA 81 106.818 9.843 2.016 526 HB1 ALA 81 HB1 ALA 81 107.039 8.073 4.427 527 HB2 ALA 81 HB2 ALA 81 107.878 9.624 4.431 528 HB3 ALA 81 HB3 ALA 81 108.237 8.433 3.182 529 H LEU 82 HN LEU 82 106.407 7.970 0.892 530 HA LEU 82 HA LEU 82 103.724 6.818 1.275 531 HB2 LEU 82 HB2 LEU 82 105.638 7.112 -1.017 532 HB3 LEU 82 HB1 LEU 82 104.465 5.800 -1.080 533 HG LEU 82 HG LEU 82 102.622 7.371 -0.843 534 HD11 LEU 82 HD11 LEU 82 103.201 9.863 -0.904 535 HD12 LEU 82 HD12 LEU 82 104.844 9.387 -0.473 536 HD13 LEU 82 HD13 LEU 82 103.506 9.032 0.620 537 HD21 LEU 82 HD21 LEU 82 104.708 8.058 -2.927 538 HD22 LEU 82 HD22 LEU 82 103.126 8.831 -2.913 539 HD23 LEU 82 HD23 LEU 82 103.248 7.085 -3.116 540 H TYR 83 HN TYR 83 103.355 4.694 1.714 541 HA TYR 83 HA TYR 83 105.425 2.706 1.422 542 HB2 TYR 83 HB2 TYR 83 105.722 2.151 3.735 543 HB3 TYR 83 HB1 TYR 83 106.016 3.882 3.576 544 HD1 TYR 83 HD1 TYR 83 103.959 1.322 5.082 545 HD2 TYR 83 HD2 TYR 83 104.151 5.513 4.166 546 HE1 TYR 83 HE1 TYR 83 102.147 1.755 6.711 547 HE2 TYR 83 HE2 TYR 83 102.336 5.949 5.803 548 HH TYR 83 HH TYR 83 100.478 4.710 6.858 549 H GLY 84 HN GLY 84 104.649 0.598 1.545 550 HA2 GLY 84 HA2 GLY 84 101.779 0.298 1.275 551 HA3 GLY 84 HA1 GLY 84 102.991 -0.975 1.117 552 H SER 85 HN SER 85 100.442 -0.946 2.673 553 HA SER 85 HA SER 85 101.596 -1.664 5.305 554 HB2 SER 85 HB2 SER 85 99.713 -0.635 6.429 555 HB3 SER 85 HB1 SER 85 100.509 0.566 5.419 556 HG SER 85 HG SER 85 98.072 -0.791 5.026 557 H LEU 86 HN LEU 86 100.457 -3.241 6.473 558 HA LEU 86 HA LEU 86 98.941 -5.107 4.791 559 HB2 LEU 86 HB2 LEU 86 100.299 -5.316 7.477 560 HB3 LEU 86 HB1 LEU 86 99.178 -6.555 6.922 561 HG LEU 86 HG LEU 86 101.581 -7.057 6.401 562 HD11 LEU 86 HD11 LEU 86 100.286 -6.659 3.725 563 HD12 LEU 86 HD12 LEU 86 99.435 -7.660 4.901 564 HD13 LEU 86 HD13 LEU 86 101.066 -8.087 4.401 565 HD21 LEU 86 HD21 LEU 86 102.095 -4.585 5.964 566 HD22 LEU 86 HD22 LEU 86 101.373 -4.824 4.373 567 HD23 LEU 86 HD23 LEU 86 102.805 -5.741 4.836 568 H HIS 87 HN HIS 87 98.212 -2.491 6.547 569 HA HIS 87 HA HIS 87 95.528 -3.499 7.237 570 HB2 HIS 87 HB2 HIS 87 95.685 -1.999 9.310 571 HB3 HIS 87 HB1 HIS 87 96.567 -3.525 9.362 572 HD2 HIS 87 HD2 HIS 87 99.443 -3.198 8.802 573 HE1 HIS 87 HE1 HIS 87 99.431 0.880 9.895 574 HE2 HIS 87 HE2 HIS 87 100.911 -1.126 9.408 575 H PHE 88 HN PHE 88 93.898 -1.970 7.118 576 HA PHE 88 HA PHE 88 94.482 0.296 5.381 577 HB2 PHE 88 HB2 PHE 88 92.626 -1.013 4.696 578 HB3 PHE 88 HB1 PHE 88 91.958 -1.059 6.324 579 HD1 PHE 88 HD1 PHE 88 93.215 1.764 4.158 580 HD2 PHE 88 HD2 PHE 88 89.926 0.085 6.361 581 HE1 PHE 88 HE1 PHE 88 91.854 3.766 3.654 582 HE2 PHE 88 HE2 PHE 88 88.568 2.091 5.851 583 HZ PHE 88 HZ PHE 88 89.527 3.929 4.499 584 H ASP 89 HN ASP 89 94.587 2.344 6.008 585 HA ASP 89 HA ASP 89 93.538 3.136 8.669 586 HB2 ASP 89 HB2 ASP 89 96.070 2.816 8.544 587 HB3 ASP 89 HB1 ASP 89 96.086 4.214 7.471 588 HA PRO 90 HA PRO 90 91.515 5.839 5.512 589 HB2 PRO 90 HB2 PRO 90 90.215 6.832 8.026 590 HB3 PRO 90 HB1 PRO 90 89.475 6.381 6.476 591 HG2 PRO 90 HG2 PRO 90 89.325 4.795 8.619 592 HG3 PRO 90 HG1 PRO 90 89.480 4.134 6.985 593 HD2 PRO 90 HD2 PRO 90 91.534 4.307 9.148 594 HD3 PRO 90 HD1 PRO 90 91.348 3.087 7.867 595 H GLU 91 HN GLU 91 92.692 6.850 8.686 596 HA GLU 91 HA GLU 91 92.940 9.599 8.134 597 HB2 GLU 91 HB2 GLU 91 94.293 7.814 10.141 598 HB3 GLU 91 HB1 GLU 91 94.560 9.557 10.086 599 HG2 GLU 91 HG2 GLU 91 92.161 9.959 10.362 600 HG3 GLU 91 HG1 GLU 91 91.849 8.224 10.362 601 H ALA 92 HN ALA 92 94.743 7.095 6.766 602 HA ALA 92 HA ALA 92 96.859 9.028 5.997 603 HB1 ALA 92 HB1 ALA 92 97.921 7.703 7.672 604 HB2 ALA 92 HB2 ALA 92 98.489 7.099 6.115 605 HB3 ALA 92 HB3 ALA 92 97.255 6.210 7.009 606 H CYS 93 HN CYS 93 95.084 6.075 5.263 607 HA CYS 93 HA CYS 93 96.226 5.976 2.578 608 HB2 CYS 93 HB2 CYS 93 95.101 4.056 4.374 609 HB3 CYS 93 HB1 CYS 93 94.159 4.018 2.886 610 H SER 94 HN SER 94 93.739 7.690 3.946 611 HA SER 94 HA SER 94 91.871 7.424 1.729 612 HB2 SER 94 HB2 SER 94 91.958 9.456 3.978 613 HB3 SER 94 HB1 SER 94 90.633 9.230 2.842 614 HG SER 94 HG SER 94 91.438 6.914 4.053 615 H PHE 95 HN PHE 95 91.968 8.568 -0.105 616 HA PHE 95 HA PHE 95 93.704 10.979 -0.205 617 HB2 PHE 95 HB2 PHE 95 93.425 8.851 -2.338 618 HB3 PHE 95 HB1 PHE 95 94.430 10.294 -2.423 619 HD1 PHE 95 HD1 PHE 95 94.093 6.929 -1.047 620 HD2 PHE 95 HD2 PHE 95 96.413 10.543 -0.938 621 HE1 PHE 95 HE1 PHE 95 95.938 5.707 0.065 622 HE2 PHE 95 HE2 PHE 95 98.260 9.321 0.183 623 HZ PHE 95 HZ PHE 95 98.028 6.902 0.678 624 H ARG 96 HN ARG 96 93.062 12.603 -1.609 625 HA ARG 96 HA ARG 96 90.223 12.496 -2.413 626 HB2 ARG 96 HB2 ARG 96 90.943 14.328 -0.881 627 HB3 ARG 96 HB1 ARG 96 92.043 14.901 -2.136 628 HG2 ARG 96 HG2 ARG 96 90.141 15.211 -3.675 629 HG3 ARG 96 HG1 ARG 96 89.036 14.631 -2.428 630 HD2 ARG 96 HD2 ARG 96 89.895 16.505 -0.950 631 HD3 ARG 96 HD1 ARG 96 90.734 17.135 -2.365 632 HE ARG 96 HE ARG 96 87.920 16.666 -2.812 633 HH11 ARG 96 HH11 ARG 96 86.627 18.505 -3.075 634 HH12 ARG 96 HH12 ARG 96 87.252 20.067 -2.668 635 HH21 ARG 96 HH21 ARG 96 90.346 18.858 -1.669 636 HH22 ARG 96 HH22 ARG 96 89.357 20.265 -1.868 637 H GLU 97 HN GLU 97 89.599 12.946 -4.519 638 HA GLU 97 HA GLU 97 91.702 12.588 -6.526 639 HB2 GLU 97 HB2 GLU 97 89.706 12.483 -8.103 640 HB3 GLU 97 HB1 GLU 97 89.815 11.203 -6.897 641 HG2 GLU 97 HG2 GLU 97 88.202 12.376 -5.470 642 HG3 GLU 97 HG1 GLU 97 88.122 13.706 -6.626 643 H LEU 98 HN LEU 98 92.569 14.152 -7.651 644 HA LEU 98 HA LEU 98 91.240 16.811 -7.744 645 HB2 LEU 98 HB2 LEU 98 94.192 16.170 -7.919 646 HB3 LEU 98 HB1 LEU 98 93.465 17.775 -7.855 647 HG LEU 98 HG LEU 98 93.251 15.686 -5.663 648 HD11 LEU 98 HD11 LEU 98 94.992 18.147 -5.965 649 HD12 LEU 98 HD12 LEU 98 95.528 16.475 -5.799 650 HD13 LEU 98 HD13 LEU 98 94.763 17.295 -4.437 651 HD21 LEU 98 HD21 LEU 98 92.226 18.507 -6.003 652 HD22 LEU 98 HD22 LEU 98 92.547 17.864 -4.392 653 HD23 LEU 98 HD23 LEU 98 91.361 17.080 -5.433 654 H LEU 99 HN LEU 99 90.760 17.568 -9.733 655 HA LEU 99 HA LEU 99 92.037 16.277 -12.088 656 HB2 LEU 99 HB2 LEU 99 89.216 16.640 -11.402 657 HB3 LEU 99 HB1 LEU 99 89.585 17.384 -12.954 658 HG LEU 99 HG LEU 99 88.896 15.021 -13.210 659 HD11 LEU 99 HD11 LEU 99 90.282 14.814 -14.981 660 HD12 LEU 99 HD12 LEU 99 91.715 14.684 -13.967 661 HD13 LEU 99 HD13 LEU 99 91.094 16.271 -14.415 662 HD21 LEU 99 HD21 LEU 99 89.873 13.250 -12.103 663 HD22 LEU 99 HD22 LEU 99 90.124 14.494 -10.880 664 HD23 LEU 99 HD23 LEU 99 91.442 14.042 -11.964 665 H LEU 100 HN LEU 100 93.176 17.534 -13.309 666 HA LEU 100 HA LEU 100 93.081 20.447 -12.928 667 HB2 LEU 100 HB2 LEU 100 95.056 18.644 -14.346 668 HB3 LEU 100 HB1 LEU 100 95.199 20.398 -14.250 669 HG LEU 100 HG LEU 100 95.014 18.577 -11.833 670 HD11 LEU 100 HD11 LEU 100 97.521 19.348 -11.650 671 HD12 LEU 100 HD12 LEU 100 97.377 19.610 -13.389 672 HD13 LEU 100 HD13 LEU 100 97.102 18.007 -12.712 673 HD21 LEU 100 HD21 LEU 100 96.128 20.788 -10.856 674 HD22 LEU 100 HD22 LEU 100 94.382 20.677 -11.042 675 HD23 LEU 100 HD23 LEU 100 95.341 21.542 -12.242 676 H GLU 101 HN GLU 101 92.857 21.884 -14.656 677 HA GLU 101 HA GLU 101 90.931 21.271 -16.582 678 HB2 GLU 101 HB2 GLU 101 91.535 23.572 -15.845 679 HB3 GLU 101 HB1 GLU 101 93.058 23.429 -16.719 680 HG2 GLU 101 HG2 GLU 101 91.538 24.611 -18.153 681 HG3 GLU 101 HG1 GLU 101 91.697 22.989 -18.816 682 H ASP 102 HN ASP 102 94.394 20.928 -16.594 683 HA ASP 102 HA ASP 102 94.755 20.588 -19.392 684 HB2 ASP 102 HB2 ASP 102 96.389 19.817 -16.986 685 HB3 ASP 102 HB1 ASP 102 96.926 19.504 -18.634 686 H GLY 103 HN GLY 103 93.282 18.619 -17.058 687 HA2 GLY 103 HA2 GLY 103 92.135 16.626 -17.561 688 HA3 GLY 103 HA1 GLY 103 93.165 16.396 -18.966 689 H TYR 104 HN TYR 104 94.956 17.177 -16.148 690 HA TYR 104 HA TYR 104 95.844 14.370 -15.950 691 HB2 TYR 104 HB2 TYR 104 97.003 16.893 -14.743 692 HB3 TYR 104 HB1 TYR 104 97.701 15.285 -14.594 693 HD1 TYR 104 HD1 TYR 104 97.956 18.257 -16.371 694 HD2 TYR 104 HD2 TYR 104 97.861 14.012 -17.018 695 HE1 TYR 104 HE1 TYR 104 99.105 18.565 -18.542 696 HE2 TYR 104 HE2 TYR 104 99.014 14.323 -19.190 697 HH TYR 104 HH TYR 104 100.452 15.959 -20.290 698 H ASN 105 HN ASN 105 96.087 13.378 -13.819 699 HA ASN 105 HA ASN 105 94.152 14.449 -11.835 700 HB2 ASN 105 HB2 ASN 105 93.194 12.497 -12.911 701 HB3 ASN 105 HB1 ASN 105 94.654 11.564 -12.583 702 HD21 ASN 105 HD21 ASN 105 91.587 11.857 -11.475 703 HD22 ASN 105 HD22 ASN 105 91.828 11.541 -9.824 704 H VAL 106 HN VAL 106 94.760 14.514 -9.759 705 HA VAL 106 HA VAL 106 97.337 13.278 -8.987 706 HB VAL 106 HB VAL 106 96.530 16.027 -8.043 707 HG11 VAL 106 HG11 VAL 106 99.203 14.621 -8.323 708 HG12 VAL 106 HG12 VAL 106 98.292 14.781 -6.820 709 HG13 VAL 106 HG13 VAL 106 98.934 16.215 -7.618 710 HG21 VAL 106 HG21 VAL 106 96.599 16.255 -10.437 711 HG22 VAL 106 HG22 VAL 106 98.046 15.257 -10.546 712 HG23 VAL 106 HG23 VAL 106 98.136 16.864 -9.823 713 H TYR 107 HN TYR 107 97.558 12.941 -6.699 714 HA TYR 107 HA TYR 107 94.954 12.745 -5.274 715 HB2 TYR 107 HB2 TYR 107 97.350 10.903 -5.192 716 HB3 TYR 107 HB1 TYR 107 95.943 10.764 -4.141 717 HD1 TYR 107 HD1 TYR 107 97.187 10.451 -7.595 718 HD2 TYR 107 HD2 TYR 107 93.789 10.017 -5.006 719 HE1 TYR 107 HE1 TYR 107 95.998 9.186 -9.368 720 HE2 TYR 107 HE2 TYR 107 92.599 8.750 -6.776 721 HH TYR 107 HH TYR 107 93.143 8.812 -9.762 722 H GLN 108 HN GLN 108 94.871 13.304 -3.147 723 HA GLN 108 HA GLN 108 97.312 14.196 -1.771 724 HB2 GLN 108 HB2 GLN 108 96.472 16.210 -2.872 725 HB3 GLN 108 HB1 GLN 108 94.861 15.924 -2.220 726 HG2 GLN 108 HG2 GLN 108 95.679 16.225 0.057 727 HG3 GLN 108 HG1 GLN 108 97.337 16.373 -0.527 728 HE21 GLN 108 HE21 GLN 108 95.529 18.392 0.904 729 HE22 GLN 108 HE22 GLN 108 95.558 19.760 -0.101 730 H SER 109 HN SER 109 97.283 13.549 0.315 731 HA SER 109 HA SER 109 95.234 11.936 1.354 732 HB2 SER 109 HB2 SER 109 96.408 12.064 3.465 733 HB3 SER 109 HB1 SER 109 97.599 11.987 2.169 734 HG SER 109 HG SER 109 97.350 13.831 4.025 735 H GLU 110 HN GLU 110 93.252 12.500 1.905 736 HA GLU 110 HA GLU 110 92.440 15.202 2.285 737 HB2 GLU 110 HB2 GLU 110 90.258 14.344 2.438 738 HB3 GLU 110 HB1 GLU 110 91.086 13.229 1.363 739 HG2 GLU 110 HG2 GLU 110 89.995 11.766 2.833 740 HG3 GLU 110 HG1 GLU 110 91.600 11.877 3.545 741 H ALA 111 HN ALA 111 93.246 12.575 4.465 742 HA ALA 111 HA ALA 111 92.094 13.504 6.815 743 HB1 ALA 111 HB1 ALA 111 94.707 12.016 6.553 744 HB2 ALA 111 HB2 ALA 111 93.107 11.276 6.527 745 HB3 ALA 111 HB3 ALA 111 93.677 12.089 7.985 746 H HIS 112 HN HIS 112 95.431 14.153 5.667 747 HA HIS 112 HA HIS 112 95.556 16.371 7.644 748 HB2 HIS 112 HB2 HIS 112 97.131 14.388 7.929 749 HB3 HIS 112 HB1 HIS 112 97.930 14.944 6.462 750 HD2 HIS 112 HD2 HIS 112 96.927 18.094 8.292 751 HE1 HIS 112 HE1 HIS 112 100.752 17.147 9.793 752 HE2 HIS 112 HE2 HIS 112 98.970 18.946 9.663 753 H GLY 113 HN GLY 113 95.482 15.670 4.321 754 HA2 GLY 113 HA2 GLY 113 95.451 17.229 2.571 755 HA3 GLY 113 HA1 GLY 113 96.022 18.456 3.691 756 H LEU 114 HN LEU 114 97.864 15.578 3.812 757 HA LEU 114 HA LEU 114 100.192 16.909 2.842 758 HB2 LEU 114 HB2 LEU 114 99.644 14.020 3.536 759 HB3 LEU 114 HB1 LEU 114 101.223 14.588 3.008 760 HG LEU 114 HG LEU 114 99.866 16.036 5.275 761 HD11 LEU 114 HD11 LEU 114 99.712 13.593 5.814 762 HD12 LEU 114 HD12 LEU 114 100.775 14.474 6.910 763 HD13 LEU 114 HD13 LEU 114 101.461 13.478 5.627 764 HD21 LEU 114 HD21 LEU 114 102.779 15.272 4.965 765 HD22 LEU 114 HD22 LEU 114 102.087 16.604 5.892 766 HD23 LEU 114 HD23 LEU 114 102.107 16.674 4.132 767 HA PRO 115 HA PRO 115 99.514 15.860 -1.464 768 HB2 PRO 115 HB2 PRO 115 101.916 16.521 -2.521 769 HB3 PRO 115 HB1 PRO 115 100.797 17.756 -1.905 770 HG2 PRO 115 HG2 PRO 115 103.186 16.544 -0.568 771 HG3 PRO 115 HG1 PRO 115 102.698 18.247 -0.666 772 HD2 PRO 115 HD2 PRO 115 102.185 16.695 1.535 773 HD3 PRO 115 HD1 PRO 115 101.131 18.040 1.040 774 H LEU 116 HN LEU 116 99.965 14.165 -2.935 775 HA LEU 116 HA LEU 116 101.509 11.936 -1.790 776 HB2 LEU 116 HB2 LEU 116 99.120 11.656 -2.587 777 HB3 LEU 116 HB1 LEU 116 99.708 11.912 -4.224 778 HG LEU 116 HG LEU 116 101.079 9.821 -2.537 779 HD11 LEU 116 HD11 LEU 116 98.503 9.273 -4.021 780 HD12 LEU 116 HD12 LEU 116 98.619 9.423 -2.271 781 HD13 LEU 116 HD13 LEU 116 99.466 8.122 -3.100 782 HD21 LEU 116 HD21 LEU 116 102.031 10.155 -4.722 783 HD22 LEU 116 HD22 LEU 116 100.444 10.156 -5.486 784 HD23 LEU 116 HD23 LEU 116 101.099 8.667 -4.817 785 H HIS 117 HN HIS 117 103.493 11.532 -2.480 786 HA HIS 117 HA HIS 117 104.222 11.865 -5.276 787 HB2 HIS 117 HB2 HIS 117 106.186 13.289 -4.739 788 HB3 HIS 117 HB1 HIS 117 104.656 14.113 -4.441 789 HD2 HIS 117 HD2 HIS 117 107.832 13.124 -2.502 790 HE1 HIS 117 HE1 HIS 117 104.973 14.265 0.388 791 HE2 HIS 117 HE2 HIS 117 107.421 13.701 0.013 792 H LEU 118 HN LEU 118 106.313 10.921 -5.756 793 HA LEU 118 HA LEU 118 106.788 8.494 -4.401 794 HB2 LEU 118 HB2 LEU 118 108.542 10.055 -6.316 795 HB3 LEU 118 HB1 LEU 118 108.832 8.387 -5.836 796 HG LEU 118 HG LEU 118 106.271 9.359 -7.133 797 HD11 LEU 118 HD11 LEU 118 107.078 8.451 -9.206 798 HD12 LEU 118 HD12 LEU 118 108.516 7.788 -8.423 799 HD13 LEU 118 HD13 LEU 118 108.328 9.535 -8.592 800 HD21 LEU 118 HD21 LEU 118 105.656 7.368 -6.107 801 HD22 LEU 118 HD22 LEU 118 107.285 6.698 -6.164 802 HD23 LEU 118 HD23 LEU 118 106.290 6.726 -7.618 803 HA PRO 119 HA PRO 119 109.307 9.782 -0.993 804 HB2 PRO 119 HB2 PRO 119 111.148 7.702 -0.856 805 HB3 PRO 119 HB1 PRO 119 109.493 7.620 -0.224 806 HG2 PRO 119 HG2 PRO 119 110.574 6.607 -2.819 807 HG3 PRO 119 HG1 PRO 119 109.419 5.850 -1.705 808 HD2 PRO 119 HD2 PRO 119 108.585 7.067 -3.963 809 HD3 PRO 119 HD1 PRO 119 107.627 7.145 -2.469 810 H GLY 120 HN GLY 120 111.099 11.013 -0.633 811 HA2 GLY 120 HA2 GLY 120 113.618 10.962 -1.593 812 HA3 GLY 120 HA1 GLY 120 112.736 11.708 -2.925 813 H ASN 121 HN ASN 121 113.531 12.008 0.500 814 HA ASN 121 HA ASN 121 112.465 14.697 0.695 815 HB2 ASN 121 HB2 ASN 121 113.572 14.585 2.981 816 HB3 ASN 121 HB1 ASN 121 112.316 13.385 2.676 817 HD21 ASN 121 HD21 ASN 121 113.184 11.197 1.824 818 HD22 ASN 121 HD22 ASN 121 114.667 10.657 2.449 819 H LYS 122 HN LYS 122 113.607 15.957 -0.759 820 HA LYS 122 HA LYS 122 115.380 17.133 -1.652 821 HB2 LYS 122 HB2 LYS 122 115.998 17.224 1.310 822 HB3 LYS 122 HB1 LYS 122 116.752 18.261 0.097 823 HG2 LYS 122 HG2 LYS 122 114.590 19.194 -0.523 824 HG3 LYS 122 HG1 LYS 122 113.763 18.074 0.556 825 HD2 LYS 122 HD2 LYS 122 113.878 20.107 1.776 826 HD3 LYS 122 HD1 LYS 122 115.157 19.099 2.448 827 HE2 LYS 122 HE2 LYS 122 116.854 20.283 1.248 828 HE3 LYS 122 HE1 LYS 122 115.666 21.097 0.230 829 HZ1 LYS 122 HZ1 LYS 122 115.712 22.730 1.709 830 HZ2 LYS 122 HZ2 LYS 122 116.624 21.815 2.813 831 HZ3 LYS 122 HZ3 LYS 122 114.930 21.694 2.800 832 H SER 123 HN SER 123 116.584 15.773 -2.891 833 HA SER 123 HA SER 123 119.212 15.186 -2.145 834 HB2 SER 123 HB2 SER 123 118.574 12.497 -2.362 835 HB3 SER 123 HB1 SER 123 118.905 13.341 -0.853 836 HG SER 123 HG SER 123 116.380 13.810 -1.606 837 HA PRO 124 HA PRO 124 118.399 13.021 -6.349 838 HB2 PRO 124 HB2 PRO 124 115.825 12.941 -7.309 839 HB3 PRO 124 HB1 PRO 124 116.529 11.652 -6.310 840 HG2 PRO 124 HG2 PRO 124 114.757 13.920 -5.492 841 HG3 PRO 124 HG1 PRO 124 114.676 12.210 -5.027 842 HD2 PRO 124 HD2 PRO 124 115.757 14.060 -3.387 843 HD3 PRO 124 HD1 PRO 124 116.409 12.409 -3.477 844 H HIS 125 HN HIS 125 118.305 13.981 -8.471 845 HA HIS 125 HA HIS 125 118.536 16.780 -8.499 846 HB2 HIS 125 HB2 HIS 125 119.593 15.245 -10.147 847 HB3 HIS 125 HB1 HIS 125 118.003 14.960 -10.856 848 HD2 HIS 125 HD2 HIS 125 120.494 18.022 -10.411 849 HE1 HIS 125 HE1 HIS 125 117.768 18.907 -13.512 850 HE2 HIS 125 HE2 HIS 125 119.835 19.723 -12.280 851 H ARG 126 HN ARG 126 117.090 18.359 -8.636 852 HA ARG 126 HA ARG 126 114.443 17.845 -9.836 853 HB2 ARG 126 HB2 ARG 126 114.192 17.580 -7.388 854 HB3 ARG 126 HB1 ARG 126 114.868 19.192 -7.157 855 HG2 ARG 126 HG2 ARG 126 113.034 20.221 -8.322 856 HG3 ARG 126 HG1 ARG 126 112.415 18.655 -8.848 857 HD2 ARG 126 HD2 ARG 126 112.657 19.492 -5.947 858 HD3 ARG 126 HD1 ARG 126 111.174 19.624 -6.891 859 HE ARG 126 HE ARG 126 111.944 17.003 -7.185 860 HH11 ARG 126 HH11 ARG 126 111.196 15.361 -5.815 861 HH12 ARG 126 HH12 ARG 126 110.685 15.745 -4.206 862 HH21 ARG 126 HH21 ARG 126 111.335 19.137 -4.527 863 HH22 ARG 126 HH22 ARG 126 110.762 17.884 -3.478 864 H ASP 127 HN ASP 127 113.850 19.430 -11.187 865 HA ASP 127 HA ASP 127 115.530 21.457 -11.981 866 HB2 ASP 127 HB2 ASP 127 112.507 21.514 -12.113 867 HB3 ASP 127 HB1 ASP 127 113.614 22.395 -13.162 868 HA PRO 128 HA PRO 128 115.145 24.679 -8.955 869 HB2 PRO 128 HB2 PRO 128 114.597 26.808 -10.943 870 HB3 PRO 128 HB1 PRO 128 116.020 26.581 -9.910 871 HG2 PRO 128 HG2 PRO 128 116.106 26.181 -12.567 872 HG3 PRO 128 HG1 PRO 128 117.077 25.220 -11.435 873 HD2 PRO 128 HD2 PRO 128 114.508 24.482 -12.810 874 HD3 PRO 128 HD1 PRO 128 115.966 23.503 -12.549 875 H ALA 129 HN ALA 129 113.633 25.876 -7.737 876 HA ALA 129 HA ALA 129 111.565 26.549 -7.009 877 HB1 ALA 129 HB1 ALA 129 110.116 27.596 -8.527 878 HB2 ALA 129 HB2 ALA 129 110.612 26.558 -9.862 879 HB3 ALA 129 HB3 ALA 129 111.708 27.798 -9.254 880 HA PRO 130 HA PRO 130 109.705 22.393 -7.334 881 HB2 PRO 130 HB2 PRO 130 108.728 22.181 -4.830 882 HB3 PRO 130 HB1 PRO 130 110.472 22.070 -5.152 883 HG2 PRO 130 HG2 PRO 130 108.890 24.374 -4.101 884 HG3 PRO 130 HG1 PRO 130 110.491 23.792 -3.610 885 HD2 PRO 130 HD2 PRO 130 110.054 25.933 -5.346 886 HD3 PRO 130 HD1 PRO 130 111.565 25.001 -5.260 887 H ARG 131 HN ARG 131 107.835 22.292 -8.512 888 HA ARG 131 HA ARG 131 105.774 24.232 -8.329 889 HB2 ARG 131 HB2 ARG 131 105.669 21.449 -9.525 890 HB3 ARG 131 HB1 ARG 131 104.492 22.735 -9.802 891 HG2 ARG 131 HG2 ARG 131 106.833 24.045 -10.430 892 HG3 ARG 131 HG1 ARG 131 107.234 22.404 -10.925 893 HD2 ARG 131 HD2 ARG 131 104.885 24.066 -11.861 894 HD3 ARG 131 HD1 ARG 131 106.275 23.564 -12.816 895 HE ARG 131 HE ARG 131 104.845 21.323 -11.724 896 HH11 ARG 131 HH11 ARG 131 103.581 20.107 -13.185 897 HH12 ARG 131 HH12 ARG 131 103.233 20.750 -14.755 898 HH21 ARG 131 HH21 ARG 131 104.972 23.702 -14.225 899 HH22 ARG 131 HH22 ARG 131 104.017 22.786 -15.345 900 H GLY 132 HN GLY 132 106.153 20.991 -6.958 901 HA2 GLY 132 HA2 GLY 132 105.164 20.950 -4.608 902 HA3 GLY 132 HA1 GLY 132 103.661 21.373 -5.401 903 HA PRO 133 HA PRO 133 103.357 16.866 -5.443 904 HB2 PRO 133 HB2 PRO 133 100.812 16.603 -6.313 905 HB3 PRO 133 HB1 PRO 133 101.184 17.199 -4.683 906 HG2 PRO 133 HG2 PRO 133 100.462 18.749 -7.137 907 HG3 PRO 133 HG1 PRO 133 99.876 18.945 -5.474 908 HD2 PRO 133 HD2 PRO 133 101.857 20.514 -6.553 909 HD3 PRO 133 HD1 PRO 133 101.747 20.154 -4.815 910 H ALA 134 HN ALA 134 103.511 15.214 -6.965 911 HA ALA 134 HA ALA 134 104.127 16.046 -9.680 912 HB1 ALA 134 HB1 ALA 134 104.089 13.193 -8.721 913 HB2 ALA 134 HB2 ALA 134 105.378 14.289 -8.227 914 HB3 ALA 134 HB3 ALA 134 105.123 13.943 -9.938 915 H ARG 135 HN ARG 135 103.048 15.450 -11.530 916 HA ARG 135 HA ARG 135 100.223 14.881 -11.247 917 HB2 ARG 135 HB2 ARG 135 100.192 15.138 -13.713 918 HB3 ARG 135 HB1 ARG 135 100.977 16.505 -12.918 919 HG2 ARG 135 HG2 ARG 135 103.188 15.463 -13.354 920 HG3 ARG 135 HG1 ARG 135 102.382 14.146 -14.207 921 HD2 ARG 135 HD2 ARG 135 101.427 15.772 -15.804 922 HD3 ARG 135 HD1 ARG 135 102.270 17.075 -14.969 923 HE ARG 135 HE ARG 135 104.146 15.095 -15.696 924 HH11 ARG 135 HH11 ARG 135 105.454 15.444 -17.517 925 HH12 ARG 135 HH12 ARG 135 104.971 16.596 -18.718 926 HH21 ARG 135 HH21 ARG 135 102.044 17.474 -17.075 927 HH22 ARG 135 HH22 ARG 135 103.041 17.749 -18.465 928 H PHE 136 HN PHE 136 99.175 13.008 -11.695 929 HA PHE 136 HA PHE 136 100.806 10.690 -12.595 930 HB2 PHE 136 HB2 PHE 136 98.916 10.993 -10.298 931 HB3 PHE 136 HB1 PHE 136 98.825 9.470 -11.185 932 HD1 PHE 136 HD1 PHE 136 100.754 11.459 -8.833 933 HD2 PHE 136 HD2 PHE 136 100.902 8.100 -11.502 934 HE1 PHE 136 HE1 PHE 136 102.816 10.646 -7.705 935 HE2 PHE 136 HE2 PHE 136 102.958 7.293 -10.384 936 HZ PHE 136 HZ PHE 136 103.915 8.560 -8.484 937 H LEU 137 HN LEU 137 100.039 9.422 -14.113 938 HA LEU 137 HA LEU 137 97.435 10.103 -15.363 939 HB2 LEU 137 HB2 LEU 137 100.112 9.348 -16.485 940 HB3 LEU 137 HB1 LEU 137 98.668 8.913 -17.392 941 HG LEU 137 HG LEU 137 99.018 11.736 -16.371 942 HD11 LEU 137 HD11 LEU 137 100.061 12.313 -18.553 943 HD12 LEU 137 HD12 LEU 137 100.160 10.595 -18.939 944 HD13 LEU 137 HD13 LEU 137 101.084 11.250 -17.587 945 HD21 LEU 137 HD21 LEU 137 96.836 11.222 -17.290 946 HD22 LEU 137 HD22 LEU 137 97.554 10.449 -18.703 947 HD23 LEU 137 HD23 LEU 137 97.696 12.190 -18.484 948 HA PRO 138 HA PRO 138 96.909 5.779 -14.015 949 HB2 PRO 138 HB2 PRO 138 94.217 5.710 -13.854 950 HB3 PRO 138 HB1 PRO 138 95.201 6.561 -12.646 951 HG2 PRO 138 HG2 PRO 138 93.668 7.674 -14.952 952 HG3 PRO 138 HG1 PRO 138 93.826 8.298 -13.300 953 HD2 PRO 138 HD2 PRO 138 95.298 9.231 -15.467 954 HD3 PRO 138 HD1 PRO 138 95.810 9.391 -13.770 955 H LEU 139 HN LEU 139 97.321 4.303 -15.578 956 HA LEU 139 HA LEU 139 95.967 4.463 -18.163 957 HB2 LEU 139 HB2 LEU 139 97.894 2.251 -17.591 958 HB3 LEU 139 HB1 LEU 139 97.722 3.246 -19.034 959 HG LEU 139 HG LEU 139 98.932 4.151 -16.401 960 HD11 LEU 139 HD11 LEU 139 100.486 2.690 -17.442 961 HD12 LEU 139 HD12 LEU 139 101.000 4.307 -17.920 962 HD13 LEU 139 HD13 LEU 139 100.102 3.297 -19.052 963 HD21 LEU 139 HD21 LEU 139 97.979 6.077 -17.410 964 HD22 LEU 139 HD22 LEU 139 98.392 5.534 -19.034 965 HD23 LEU 139 HD23 LEU 139 99.656 6.097 -17.945 966 HA PRO 140 HA PRO 140 92.853 1.393 -17.158 967 HB2 PRO 140 HB2 PRO 140 93.584 0.122 -19.777 968 HB3 PRO 140 HB1 PRO 140 91.983 0.567 -19.150 969 HG2 PRO 140 HG2 PRO 140 93.212 2.030 -21.019 970 HG3 PRO 140 HG1 PRO 140 92.213 2.774 -19.758 971 HD2 PRO 140 HD2 PRO 140 95.188 2.769 -20.037 972 HD3 PRO 140 HD1 PRO 140 94.116 3.964 -19.268 973 H GLY 141 HN GLY 141 93.077 -0.367 -15.857 974 HA2 GLY 141 HA2 GLY 141 95.126 -2.396 -16.493 975 HA3 GLY 141 HA1 GLY 141 95.121 -1.654 -14.894 Start of MODEL 2 1 H1 GLY 13 HT1 GLY 13 80.384 -0.061 -4.516 2 H2 GLY 13 HT2 GLY 13 80.118 0.855 -3.110 3 H3 GLY 13 HT3 GLY 13 81.318 -0.348 -3.129 4 HA2 GLY 13 HA2 GLY 13 81.335 2.329 -4.339 5 HA3 GLY 13 HA1 GLY 13 82.592 1.524 -3.399 6 H GLN 14 HN GLN 14 82.127 2.656 -6.336 7 HA GLN 14 HA GLN 14 82.616 0.531 -8.118 8 HB2 GLN 14 HB2 GLN 14 83.284 3.474 -8.292 9 HB3 GLN 14 HB1 GLN 14 83.511 2.340 -9.624 10 HG2 GLN 14 HG2 GLN 14 81.138 1.784 -9.613 11 HG3 GLN 14 HG1 GLN 14 80.875 2.811 -8.204 12 HE21 GLN 14 HE21 GLN 14 83.038 4.663 -9.639 13 HE22 GLN 14 HE22 GLN 14 82.081 5.541 -10.731 14 H VAL 15 HN VAL 15 84.396 -0.608 -8.603 15 HA VAL 15 HA VAL 15 87.025 0.380 -7.658 16 HB VAL 15 HB VAL 15 86.439 -1.301 -6.089 17 HG11 VAL 15 HG11 VAL 15 85.698 -3.030 -8.467 18 HG12 VAL 15 HG12 VAL 15 84.567 -2.294 -7.331 19 HG13 VAL 15 HG13 VAL 15 85.676 -3.549 -6.781 20 HG21 VAL 15 HG21 VAL 15 88.740 -1.447 -7.159 21 HG22 VAL 15 HG22 VAL 15 88.108 -2.749 -8.165 22 HG23 VAL 15 HG23 VAL 15 88.170 -2.939 -6.415 23 H ARG 16 HN ARG 16 88.659 0.209 -9.012 24 HA ARG 16 HA ARG 16 88.480 -1.508 -11.384 25 HB2 ARG 16 HB2 ARG 16 88.795 1.497 -11.487 26 HB3 ARG 16 HB1 ARG 16 89.241 0.434 -12.823 27 HG2 ARG 16 HG2 ARG 16 86.928 -0.463 -12.859 28 HG3 ARG 16 HG1 ARG 16 86.494 0.640 -11.553 29 HD2 ARG 16 HD2 ARG 16 87.104 2.565 -12.987 30 HD3 ARG 16 HD1 ARG 16 87.495 1.453 -14.295 31 HE ARG 16 HE ARG 16 84.876 0.891 -13.494 32 HH11 ARG 16 HH11 ARG 16 83.138 1.740 -14.678 33 HH12 ARG 16 HH12 ARG 16 83.368 3.151 -15.656 34 HH21 ARG 16 HH21 ARG 16 86.728 3.477 -14.853 35 HH22 ARG 16 HH22 ARG 16 85.406 4.136 -15.757 36 H GLN 17 HN GLN 17 90.494 -1.990 -12.315 37 HA GLN 17 HA GLN 17 92.801 -1.456 -10.546 38 HB2 GLN 17 HB2 GLN 17 93.760 -3.417 -11.977 39 HB3 GLN 17 HB1 GLN 17 92.562 -3.774 -10.734 40 HG2 GLN 17 HG2 GLN 17 90.790 -3.844 -12.353 41 HG3 GLN 17 HG1 GLN 17 91.854 -3.239 -13.621 42 HE21 GLN 17 HE21 GLN 17 94.153 -4.846 -13.108 43 HE22 GLN 17 HE22 GLN 17 93.765 -6.470 -13.412 44 H ARG 18 HN ARG 18 94.333 -0.070 -11.214 45 HA ARG 18 HA ARG 18 94.907 0.193 -14.089 46 HB2 ARG 18 HB2 ARG 18 94.215 2.561 -12.331 47 HB3 ARG 18 HB1 ARG 18 94.741 2.633 -14.009 48 HG2 ARG 18 HG2 ARG 18 92.729 1.286 -14.643 49 HG3 ARG 18 HG1 ARG 18 92.188 1.375 -12.972 50 HD2 ARG 18 HD2 ARG 18 91.060 3.142 -14.084 51 HD3 ARG 18 HD1 ARG 18 92.360 3.905 -13.175 52 HE ARG 18 HE ARG 18 93.277 3.303 -15.785 53 HH11 ARG 18 HH11 ARG 18 93.338 4.968 -17.335 54 HH12 ARG 18 HH12 ARG 18 92.411 6.410 -17.084 55 HH21 ARG 18 HH21 ARG 18 91.138 5.376 -14.029 56 HH22 ARG 18 HH22 ARG 18 91.167 6.641 -15.210 57 H TYR 19 HN TYR 19 96.873 1.522 -14.476 58 HA TYR 19 HA TYR 19 98.867 1.116 -12.321 59 HB2 TYR 19 HB2 TYR 19 99.138 1.719 -15.276 60 HB3 TYR 19 HB1 TYR 19 100.499 1.680 -14.166 61 HD1 TYR 19 HD1 TYR 19 97.765 -0.387 -15.635 62 HD2 TYR 19 HD2 TYR 19 101.472 -0.369 -13.462 63 HE1 TYR 19 HE1 TYR 19 97.966 -2.841 -15.947 64 HE2 TYR 19 HE2 TYR 19 101.668 -2.820 -13.769 65 HH TYR 19 HH TYR 19 99.223 -4.776 -14.585 66 H LEU 20 HN LEU 20 99.796 2.896 -11.295 67 HA LEU 20 HA LEU 20 98.772 5.537 -12.090 68 HB2 LEU 20 HB2 LEU 20 99.029 4.408 -9.625 69 HB3 LEU 20 HB1 LEU 20 100.563 5.262 -9.716 70 HG LEU 20 HG LEU 20 99.103 7.291 -10.508 71 HD11 LEU 20 HD11 LEU 20 96.834 7.231 -9.374 72 HD12 LEU 20 HD12 LEU 20 97.038 5.488 -9.221 73 HD13 LEU 20 HD13 LEU 20 96.979 6.234 -10.819 74 HD21 LEU 20 HD21 LEU 20 98.580 7.825 -8.057 75 HD22 LEU 20 HD22 LEU 20 100.260 7.437 -8.426 76 HD23 LEU 20 HD23 LEU 20 99.218 6.224 -7.680 77 H TYR 21 HN TYR 21 99.906 6.605 -13.550 78 HA TYR 21 HA TYR 21 102.874 6.545 -13.434 79 HB2 TYR 21 HB2 TYR 21 102.285 5.217 -15.324 80 HB3 TYR 21 HB1 TYR 21 101.026 6.345 -15.817 81 HD1 TYR 21 HD1 TYR 21 104.708 5.960 -15.433 82 HD2 TYR 21 HD2 TYR 21 101.511 8.207 -17.218 83 HE1 TYR 21 HE1 TYR 21 106.351 7.200 -16.814 84 HE2 TYR 21 HE2 TYR 21 103.156 9.433 -18.613 85 HH TYR 21 HH TYR 21 105.613 8.854 -19.496 86 H THR 22 HN THR 22 103.894 8.405 -13.539 87 HA THR 22 HA THR 22 102.334 10.883 -13.997 88 HB THR 22 HB THR 22 104.394 10.113 -11.978 89 HG1 THR 22 HG1 THR 22 102.736 12.023 -11.244 90 HG21 THR 22 HG21 THR 22 105.602 11.923 -12.866 91 HG22 THR 22 HG22 THR 22 104.659 12.648 -11.564 92 HG23 THR 22 HG23 THR 22 104.137 12.830 -13.238 93 H SER 23 HN SER 23 102.954 12.120 -15.637 94 HA SER 23 HA SER 23 105.116 11.347 -17.349 95 HB2 SER 23 HB2 SER 23 103.182 13.657 -17.322 96 HB3 SER 23 HB1 SER 23 104.492 13.570 -18.498 97 HG SER 23 HG SER 23 103.455 11.206 -18.510 98 H GLY 24 HN GLY 24 106.970 12.606 -17.895 99 HA2 GLY 24 HA2 GLY 24 107.728 14.849 -16.210 100 HA3 GLY 24 HA1 GLY 24 108.663 13.382 -15.944 101 HA PRO 25 HA PRO 25 110.325 15.901 -19.588 102 HB2 PRO 25 HB2 PRO 25 112.654 16.773 -18.455 103 HB3 PRO 25 HB1 PRO 25 111.124 17.665 -18.320 104 HG2 PRO 25 HG2 PRO 25 112.423 15.828 -16.346 105 HG3 PRO 25 HG1 PRO 25 111.631 17.393 -16.075 106 HD2 PRO 25 HD2 PRO 25 110.376 15.013 -15.589 107 HD3 PRO 25 HD1 PRO 25 109.495 16.470 -16.100 108 H HIS 26 HN HIS 26 112.255 15.405 -20.860 109 HA HIS 26 HA HIS 26 112.906 12.639 -20.828 110 HB2 HIS 26 HB2 HIS 26 114.359 14.866 -22.275 111 HB3 HIS 26 HB1 HIS 26 114.403 13.147 -22.664 112 HD2 HIS 26 HD2 HIS 26 112.236 16.242 -23.437 113 HE1 HIS 26 HE1 HIS 26 110.075 12.883 -24.806 114 HE2 HIS 26 HE2 HIS 26 110.183 15.420 -24.827 115 H GLY 27 HN GLY 27 113.793 14.783 -18.626 116 HA2 GLY 27 HA2 GLY 27 116.538 14.867 -18.393 117 HA3 GLY 27 HA1 GLY 27 115.439 14.811 -17.020 118 H LEU 28 HN LEU 28 114.381 12.155 -17.765 119 HA LEU 28 HA LEU 28 116.744 10.428 -17.461 120 HB2 LEU 28 HB2 LEU 28 116.017 10.991 -15.174 121 HB3 LEU 28 HB1 LEU 28 114.399 10.404 -15.541 122 HG LEU 28 HG LEU 28 115.323 8.147 -15.979 123 HD11 LEU 28 HD11 LEU 28 117.525 8.392 -16.704 124 HD12 LEU 28 HD12 LEU 28 117.779 7.878 -15.040 125 HD13 LEU 28 HD13 LEU 28 117.918 9.585 -15.465 126 HD21 LEU 28 HD21 LEU 28 114.530 8.631 -13.739 127 HD22 LEU 28 HD22 LEU 28 116.057 9.408 -13.320 128 HD23 LEU 28 HD23 LEU 28 116.001 7.668 -13.602 129 H SER 29 HN SER 29 113.446 9.480 -16.738 130 HA SER 29 HA SER 29 112.837 8.504 -19.360 131 HB2 SER 29 HB2 SER 29 114.096 6.697 -17.341 132 HB3 SER 29 HB1 SER 29 112.826 6.039 -18.366 133 HG SER 29 HG SER 29 115.122 7.441 -19.285 134 H SER 30 HN SER 30 110.972 6.711 -19.008 135 HA SER 30 HA SER 30 108.810 8.072 -17.816 136 HB2 SER 30 HB2 SER 30 109.202 5.247 -18.788 137 HB3 SER 30 HB1 SER 30 107.691 5.743 -18.039 138 HG SER 30 HG SER 30 108.134 5.970 -20.480 139 H CYS 31 HN CYS 31 107.777 7.830 -15.851 140 HA CYS 31 HA CYS 31 109.068 6.050 -13.856 141 HB2 CYS 31 HB2 CYS 31 108.580 8.951 -13.789 142 HB3 CYS 31 HB1 CYS 31 107.959 8.128 -12.368 143 H HIS 32 HN HIS 32 107.735 4.500 -13.277 144 HA HIS 32 HA HIS 32 104.817 5.046 -13.106 145 HB2 HIS 32 HB2 HIS 32 106.290 2.449 -13.628 146 HB3 HIS 32 HB1 HIS 32 104.558 2.569 -13.341 147 HD2 HIS 32 HD2 HIS 32 107.146 3.800 -16.098 148 HE1 HIS 32 HE1 HIS 32 103.265 3.829 -17.749 149 HE2 HIS 32 HE2 HIS 32 105.730 4.160 -18.257 150 H LEU 33 HN LEU 33 104.093 5.158 -11.070 151 HA LEU 33 HA LEU 33 105.625 4.811 -8.786 152 HB2 LEU 33 HB2 LEU 33 103.196 5.814 -9.204 153 HB3 LEU 33 HB1 LEU 33 102.674 4.218 -8.680 154 HG LEU 33 HG LEU 33 104.425 6.156 -7.133 155 HD11 LEU 33 HD11 LEU 33 102.484 5.986 -5.511 156 HD12 LEU 33 HD12 LEU 33 101.600 5.128 -6.772 157 HD13 LEU 33 HD13 LEU 33 102.108 6.798 -7.031 158 HD21 LEU 33 HD21 LEU 33 105.278 4.074 -6.485 159 HD22 LEU 33 HD22 LEU 33 103.721 3.263 -6.669 160 HD23 LEU 33 HD23 LEU 33 104.003 4.333 -5.298 161 H GLU 34 HN GLU 34 106.314 3.060 -7.660 162 HA GLU 34 HA GLU 34 104.976 0.457 -8.091 163 HB2 GLU 34 HB2 GLU 34 106.980 -0.680 -8.530 164 HB3 GLU 34 HB1 GLU 34 107.150 0.798 -9.471 165 HG2 GLU 34 HG2 GLU 34 108.414 1.780 -7.487 166 HG3 GLU 34 HG1 GLU 34 108.413 0.161 -6.789 167 H ILE 35 HN ILE 35 104.733 -0.756 -6.271 168 HA ILE 35 HA ILE 35 105.877 0.342 -3.759 169 HB ILE 35 HB ILE 35 103.401 -1.348 -4.172 170 HG12 ILE 35 HG12 ILE 35 103.737 1.518 -3.237 171 HG13 ILE 35 HG11 ILE 35 103.280 1.067 -4.879 172 HG21 ILE 35 HG21 ILE 35 104.785 -0.247 -1.710 173 HG22 ILE 35 HG22 ILE 35 104.383 -1.928 -2.052 174 HG23 ILE 35 HG23 ILE 35 103.102 -0.772 -1.695 175 HD11 ILE 35 HD11 ILE 35 101.733 0.611 -2.326 176 HD12 ILE 35 HD12 ILE 35 101.357 -0.255 -3.817 177 HD13 ILE 35 HD13 ILE 35 101.230 1.502 -3.764 178 H ARG 36 HN ARG 36 107.316 -0.801 -2.704 179 HA ARG 36 HA ARG 36 108.045 -3.465 -3.632 180 HB2 ARG 36 HB2 ARG 36 109.227 -1.359 -1.889 181 HB3 ARG 36 HB1 ARG 36 109.760 -3.011 -1.605 182 HG2 ARG 36 HG2 ARG 36 111.313 -2.117 -3.166 183 HG3 ARG 36 HG1 ARG 36 110.236 -3.113 -4.137 184 HD2 ARG 36 HD2 ARG 36 108.984 -1.158 -4.848 185 HD3 ARG 36 HD1 ARG 36 109.901 -0.123 -3.755 186 HE ARG 36 HE ARG 36 111.564 -1.549 -5.633 187 HH11 ARG 36 HH11 ARG 36 112.593 -0.291 -7.207 188 HH12 ARG 36 HH12 ARG 36 112.065 1.333 -7.499 189 HH21 ARG 36 HH21 ARG 36 109.567 1.229 -5.093 190 HH22 ARG 36 HH22 ARG 36 110.340 2.189 -6.310 191 H GLU 37 HN GLU 37 108.377 -5.217 -2.141 192 HA GLU 37 HA GLU 37 106.119 -5.694 -0.451 193 HB2 GLU 37 HB2 GLU 37 108.723 -7.206 -0.812 194 HB3 GLU 37 HB1 GLU 37 107.354 -7.789 0.135 195 HG2 GLU 37 HG2 GLU 37 105.928 -7.754 -1.837 196 HG3 GLU 37 HG1 GLU 37 107.236 -7.060 -2.795 197 H ASP 38 HN ASP 38 109.352 -4.561 -0.099 198 HA ASP 38 HA ASP 38 109.597 -4.882 2.731 199 HB2 ASP 38 HB2 ASP 38 111.044 -3.143 0.726 200 HB3 ASP 38 HB1 ASP 38 111.479 -3.222 2.430 201 H GLY 39 HN GLY 39 107.658 -2.958 0.858 202 HA2 GLY 39 HA2 GLY 39 106.076 -1.417 1.617 203 HA3 GLY 39 HA1 GLY 39 106.969 -1.261 3.126 204 H THR 40 HN THR 40 109.041 -1.025 0.430 205 HA THR 40 HA THR 40 109.322 1.848 0.909 206 HB THR 40 HB THR 40 111.163 1.517 -0.927 207 HG1 THR 40 HG1 THR 40 110.665 -1.133 -0.076 208 HG21 THR 40 HG21 THR 40 112.683 0.507 0.871 209 HG22 THR 40 HG22 THR 40 111.242 0.421 1.884 210 HG23 THR 40 HG23 THR 40 111.818 1.982 1.301 211 H VAL 41 HN VAL 41 109.438 3.360 -0.959 212 HA VAL 41 HA VAL 41 107.586 2.596 -3.147 213 HB VAL 41 HB VAL 41 107.472 5.083 -1.429 214 HG11 VAL 41 HG11 VAL 41 106.077 4.366 -4.016 215 HG12 VAL 41 HG12 VAL 41 107.052 5.797 -3.676 216 HG13 VAL 41 HG13 VAL 41 105.474 5.603 -2.914 217 HG21 VAL 41 HG21 VAL 41 106.382 3.172 -0.405 218 HG22 VAL 41 HG22 VAL 41 105.570 2.771 -1.918 219 HG23 VAL 41 HG23 VAL 41 105.132 4.240 -1.044 220 H GLY 42 HN GLY 42 107.945 3.497 -5.103 221 HA2 GLY 42 HA2 GLY 42 109.660 5.701 -5.631 222 HA3 GLY 42 HA1 GLY 42 110.516 4.182 -5.904 223 H CYS 43 HN CYS 43 110.441 5.289 -8.180 224 HA CYS 43 HA CYS 43 107.918 4.561 -9.554 225 HB2 CYS 43 HB2 CYS 43 108.161 6.383 -10.891 226 HB3 CYS 43 HB1 CYS 43 109.263 6.955 -9.646 227 H ALA 44 HN ALA 44 108.116 3.643 -11.718 228 HA ALA 44 HA ALA 44 110.590 2.074 -12.170 229 HB1 ALA 44 HB1 ALA 44 109.282 0.119 -12.761 230 HB2 ALA 44 HB2 ALA 44 107.775 0.999 -12.511 231 HB3 ALA 44 HB3 ALA 44 108.815 0.626 -11.141 232 H ALA 45 HN ALA 45 111.162 1.843 -14.319 233 HA ALA 45 HA ALA 45 109.566 3.433 -16.243 234 HB1 ALA 45 HB1 ALA 45 111.561 3.809 -17.457 235 HB2 ALA 45 HB2 ALA 45 112.424 2.530 -16.602 236 HB3 ALA 45 HB3 ALA 45 112.003 4.025 -15.764 237 H ASP 46 HN ASP 46 110.323 0.266 -15.365 238 HA ASP 46 HA ASP 46 109.966 -0.803 -18.091 239 HB2 ASP 46 HB2 ASP 46 111.845 -1.571 -16.543 240 HB3 ASP 46 HB1 ASP 46 110.594 -2.356 -15.584 241 H GLN 47 HN GLN 47 107.943 0.291 -15.924 242 HA GLN 47 HA GLN 47 105.849 -0.279 -15.097 243 HB2 GLN 47 HB2 GLN 47 105.866 -1.398 -17.899 244 HB3 GLN 47 HB1 GLN 47 104.413 -1.325 -16.903 245 HG2 GLN 47 HG2 GLN 47 104.608 1.094 -16.715 246 HG3 GLN 47 HG1 GLN 47 106.136 1.072 -17.595 247 HE21 GLN 47 HE21 GLN 47 102.871 1.649 -18.026 248 HE22 GLN 47 HE22 GLN 47 102.755 1.315 -19.685 249 H SER 48 HN SER 48 106.132 -1.713 -13.392 250 HA SER 48 HA SER 48 106.141 -4.601 -14.066 251 HB2 SER 48 HB2 SER 48 107.407 -3.041 -11.840 252 HB3 SER 48 HB1 SER 48 107.013 -4.738 -11.604 253 HG SER 48 HG SER 48 109.008 -4.769 -12.463 254 HA PRO 49 HA PRO 49 102.182 -5.251 -12.171 255 HB2 PRO 49 HB2 PRO 49 103.481 -7.171 -10.267 256 HB3 PRO 49 HB1 PRO 49 102.059 -7.401 -11.305 257 HG2 PRO 49 HG2 PRO 49 104.420 -8.465 -11.934 258 HG3 PRO 49 HG1 PRO 49 103.333 -7.825 -13.180 259 HD2 PRO 49 HD2 PRO 49 105.870 -6.655 -12.118 260 HD3 PRO 49 HD1 PRO 49 105.147 -6.523 -13.734 261 H GLU 50 HN GLU 50 104.906 -4.816 -9.934 262 HA GLU 50 HA GLU 50 103.463 -4.267 -7.607 263 HB2 GLU 50 HB2 GLU 50 105.725 -2.512 -7.589 264 HB3 GLU 50 HB1 GLU 50 105.573 -4.072 -6.795 265 HG2 GLU 50 HG2 GLU 50 106.342 -5.192 -8.861 266 HG3 GLU 50 HG1 GLU 50 106.483 -3.620 -9.648 267 H SER 51 HN SER 51 103.723 -2.426 -10.495 268 HA SER 51 HA SER 51 102.971 0.078 -9.226 269 HB2 SER 51 HB2 SER 51 103.376 -0.697 -12.117 270 HB3 SER 51 HB1 SER 51 102.934 0.918 -11.580 271 HG SER 51 HG SER 51 104.890 0.462 -10.092 272 H LEU 52 HN LEU 52 101.353 -2.677 -10.073 273 HA LEU 52 HA LEU 52 98.965 -1.425 -11.143 274 HB2 LEU 52 HB2 LEU 52 100.019 -3.957 -11.297 275 HB3 LEU 52 HB1 LEU 52 98.789 -4.193 -10.059 276 HG LEU 52 HG LEU 52 98.311 -2.988 -12.802 277 HD11 LEU 52 HD11 LEU 52 97.107 -5.088 -13.240 278 HD12 LEU 52 HD12 LEU 52 97.532 -5.669 -11.630 279 HD13 LEU 52 HD13 LEU 52 98.793 -5.414 -12.836 280 HD21 LEU 52 HD21 LEU 52 96.241 -3.878 -10.781 281 HD22 LEU 52 HD22 LEU 52 95.997 -2.943 -12.255 282 HD23 LEU 52 HD23 LEU 52 96.798 -2.208 -10.875 283 H LEU 53 HN LEU 53 97.665 -0.295 -9.832 284 HA LEU 53 HA LEU 53 97.366 -1.186 -7.007 285 HB2 LEU 53 HB2 LEU 53 97.066 1.616 -8.095 286 HB3 LEU 53 HB1 LEU 53 97.034 1.118 -6.404 287 HG LEU 53 HG LEU 53 99.406 0.782 -8.263 288 HD11 LEU 53 HD11 LEU 53 99.108 2.700 -5.941 289 HD12 LEU 53 HD12 LEU 53 98.794 3.162 -7.614 290 HD13 LEU 53 HD13 LEU 53 100.408 2.639 -7.131 291 HD21 LEU 53 HD21 LEU 53 100.505 0.479 -5.884 292 HD22 LEU 53 HD22 LEU 53 99.671 -0.878 -6.633 293 HD23 LEU 53 HD23 LEU 53 98.864 0.068 -5.383 294 H GLN 54 HN GLN 54 95.414 -1.837 -6.439 295 HA GLN 54 HA GLN 54 93.180 -1.551 -8.250 296 HB2 GLN 54 HB2 GLN 54 93.463 -2.766 -5.501 297 HB3 GLN 54 HB1 GLN 54 91.899 -2.616 -6.300 298 HG2 GLN 54 HG2 GLN 54 92.739 -3.890 -8.222 299 HG3 GLN 54 HG1 GLN 54 94.319 -4.026 -7.455 300 HE21 GLN 54 HE21 GLN 54 93.359 -6.449 -7.955 301 HE22 GLN 54 HE22 GLN 54 92.653 -7.176 -6.593 302 H LEU 55 HN LEU 55 92.034 0.217 -8.422 303 HA LEU 55 HA LEU 55 92.024 2.216 -6.292 304 HB2 LEU 55 HB2 LEU 55 92.366 2.912 -8.613 305 HB3 LEU 55 HB1 LEU 55 90.821 2.209 -9.073 306 HG LEU 55 HG LEU 55 90.569 4.079 -6.790 307 HD11 LEU 55 HD11 LEU 55 92.442 5.181 -8.006 308 HD12 LEU 55 HD12 LEU 55 90.959 6.136 -8.042 309 HD13 LEU 55 HD13 LEU 55 91.448 5.211 -9.462 310 HD21 LEU 55 HD21 LEU 55 88.746 4.981 -8.169 311 HD22 LEU 55 HD22 LEU 55 88.654 3.220 -8.121 312 HD23 LEU 55 HD23 LEU 55 89.299 4.031 -9.548 313 H LYS 56 HN LYS 56 90.485 2.235 -4.779 314 HA LYS 56 HA LYS 56 87.818 1.083 -5.423 315 HB2 LYS 56 HB2 LYS 56 89.372 0.928 -2.827 316 HB3 LYS 56 HB1 LYS 56 87.723 0.344 -3.063 317 HG2 LYS 56 HG2 LYS 56 88.486 -1.221 -4.783 318 HG3 LYS 56 HG1 LYS 56 90.124 -0.588 -4.658 319 HD2 LYS 56 HD2 LYS 56 90.160 -2.556 -3.342 320 HD3 LYS 56 HD1 LYS 56 90.021 -1.245 -2.173 321 HE2 LYS 56 HE2 LYS 56 87.691 -1.650 -1.843 322 HE3 LYS 56 HE1 LYS 56 87.594 -2.694 -3.259 323 HZ1 LYS 56 HZ1 LYS 56 87.669 -3.901 -1.121 324 HZ2 LYS 56 HZ2 LYS 56 89.235 -3.298 -0.862 325 HZ3 LYS 56 HZ3 LYS 56 88.923 -4.325 -2.180 326 H ALA 57 HN ALA 57 86.119 2.315 -5.008 327 HA ALA 57 HA ALA 57 86.568 5.020 -4.003 328 HB1 ALA 57 HB1 ALA 57 85.275 4.893 -5.995 329 HB2 ALA 57 HB2 ALA 57 84.145 5.285 -4.700 330 HB3 ALA 57 HB3 ALA 57 84.236 3.637 -5.325 331 H LEU 58 HN LEU 58 86.587 5.191 -1.846 332 HA LEU 58 HA LEU 58 85.017 3.522 -0.112 333 HB2 LEU 58 HB2 LEU 58 86.400 6.143 0.519 334 HB3 LEU 58 HB1 LEU 58 85.867 4.924 1.676 335 HG LEU 58 HG LEU 58 87.967 4.523 -0.473 336 HD11 LEU 58 HD11 LEU 58 88.109 5.450 2.326 337 HD12 LEU 58 HD12 LEU 58 89.300 5.560 1.032 338 HD13 LEU 58 HD13 LEU 58 89.173 4.087 1.984 339 HD21 LEU 58 HD21 LEU 58 87.086 2.389 -0.217 340 HD22 LEU 58 HD22 LEU 58 86.600 2.663 1.458 341 HD23 LEU 58 HD23 LEU 58 88.296 2.378 1.066 342 H LYS 59 HN LYS 59 85.050 7.050 -0.373 343 HA LYS 59 HA LYS 59 82.089 7.077 -0.315 344 HB2 LYS 59 HB2 LYS 59 83.888 9.172 0.910 345 HB3 LYS 59 HB1 LYS 59 82.142 9.049 1.056 346 HG2 LYS 59 HG2 LYS 59 82.493 7.901 3.001 347 HG3 LYS 59 HG1 LYS 59 83.039 6.556 2.006 348 HD2 LYS 59 HD2 LYS 59 84.837 6.899 3.496 349 HD3 LYS 59 HD1 LYS 59 85.354 7.744 2.038 350 HE2 LYS 59 HE2 LYS 59 85.736 9.120 4.056 351 HE3 LYS 59 HE1 LYS 59 84.563 9.880 2.985 352 HZ1 LYS 59 HZ1 LYS 59 83.062 9.813 4.592 353 HZ2 LYS 59 HZ2 LYS 59 84.229 9.176 5.650 354 HZ3 LYS 59 HZ3 LYS 59 83.235 8.133 4.749 355 HA PRO 60 HA PRO 60 82.281 9.437 -4.079 356 HB2 PRO 60 HB2 PRO 60 80.696 11.560 -2.660 357 HB3 PRO 60 HB1 PRO 60 80.407 10.809 -4.244 358 HG2 PRO 60 HG2 PRO 60 78.967 10.124 -2.107 359 HG3 PRO 60 HG1 PRO 60 79.439 8.931 -3.330 360 HD2 PRO 60 HD2 PRO 60 80.497 9.297 -0.563 361 HD3 PRO 60 HD1 PRO 60 80.394 7.826 -1.556 362 H GLY 61 HN GLY 61 84.218 10.359 -4.550 363 HA2 GLY 61 HA2 GLY 61 85.568 12.315 -4.761 364 HA3 GLY 61 HA1 GLY 61 84.961 12.883 -3.213 365 H VAL 62 HN VAL 62 85.448 9.951 -2.244 366 HA VAL 62 HA VAL 62 88.363 10.264 -1.755 367 HB VAL 62 HB VAL 62 86.254 9.096 0.075 368 HG11 VAL 62 HG11 VAL 62 88.167 9.126 1.721 369 HG12 VAL 62 HG12 VAL 62 89.246 9.498 0.376 370 HG13 VAL 62 HG13 VAL 62 88.369 7.968 0.406 371 HG21 VAL 62 HG21 VAL 62 86.805 11.081 1.484 372 HG22 VAL 62 HG22 VAL 62 86.082 11.528 -0.060 373 HG23 VAL 62 HG23 VAL 62 87.822 11.695 0.179 374 H ILE 63 HN ILE 63 89.651 8.564 -2.229 375 HA ILE 63 HA ILE 63 88.385 5.937 -2.764 376 HB ILE 63 HB ILE 63 89.737 5.637 -4.728 377 HG12 ILE 63 HG12 ILE 63 90.948 8.040 -5.390 378 HG13 ILE 63 HG11 ILE 63 91.179 8.018 -3.646 379 HG21 ILE 63 HG21 ILE 63 88.681 7.232 -6.175 380 HG22 ILE 63 HG22 ILE 63 88.567 8.424 -4.882 381 HG23 ILE 63 HG23 ILE 63 87.573 6.970 -4.828 382 HD11 ILE 63 HD11 ILE 63 92.007 5.562 -4.045 383 HD12 ILE 63 HD12 ILE 63 93.084 6.901 -4.437 384 HD13 ILE 63 HD13 ILE 63 92.192 6.083 -5.717 385 H GLN 64 HN GLN 64 89.960 4.173 -2.870 386 HA GLN 64 HA GLN 64 92.308 4.533 -1.088 387 HB2 GLN 64 HB2 GLN 64 90.524 3.485 0.202 388 HB3 GLN 64 HB1 GLN 64 90.253 2.297 -1.068 389 HG2 GLN 64 HG2 GLN 64 92.517 1.388 -0.719 390 HG3 GLN 64 HG1 GLN 64 92.825 2.615 0.510 391 HE21 GLN 64 HE21 GLN 64 92.581 -0.457 0.685 392 HE22 GLN 64 HE22 GLN 64 91.446 -0.700 1.923 393 H ILE 65 HN ILE 65 94.117 3.344 -1.666 394 HA ILE 65 HA ILE 65 93.933 1.809 -4.197 395 HB ILE 65 HB ILE 65 96.452 2.584 -4.355 396 HG12 ILE 65 HG12 ILE 65 95.203 4.737 -2.607 397 HG13 ILE 65 HG11 ILE 65 96.486 3.639 -2.115 398 HG21 ILE 65 HG21 ILE 65 95.756 4.502 -5.681 399 HG22 ILE 65 HG22 ILE 65 94.198 4.553 -4.856 400 HG23 ILE 65 HG23 ILE 65 94.594 3.198 -5.915 401 HD11 ILE 65 HD11 ILE 65 97.717 4.598 -4.244 402 HD12 ILE 65 HD12 ILE 65 97.700 5.525 -2.743 403 HD13 ILE 65 HD13 ILE 65 96.583 5.934 -4.043 404 H LEU 66 HN LEU 66 94.570 -0.209 -4.157 405 HA LEU 66 HA LEU 66 96.313 -1.156 -1.956 406 HB2 LEU 66 HB2 LEU 66 94.034 -1.774 -1.448 407 HB3 LEU 66 HB1 LEU 66 93.779 -2.384 -3.071 408 HG LEU 66 HG LEU 66 94.188 -4.100 -1.213 409 HD11 LEU 66 HD11 LEU 66 96.291 -4.647 -3.222 410 HD12 LEU 66 HD12 LEU 66 94.720 -4.254 -3.893 411 HD13 LEU 66 HD13 LEU 66 94.887 -5.598 -2.771 412 HD21 LEU 66 HD21 LEU 66 97.093 -3.370 -1.582 413 HD22 LEU 66 HD22 LEU 66 96.384 -4.452 -0.388 414 HD23 LEU 66 HD23 LEU 66 96.125 -2.715 -0.264 415 H GLY 67 HN GLY 67 98.140 -1.970 -2.743 416 HA2 GLY 67 HA2 GLY 67 98.503 -2.561 -5.533 417 HA3 GLY 67 HA1 GLY 67 99.704 -2.746 -4.266 418 H VAL 68 HN VAL 68 98.114 -4.428 -6.540 419 HA VAL 68 HA VAL 68 97.108 -6.698 -5.213 420 HB VAL 68 HB VAL 68 97.138 -7.755 -7.372 421 HG11 VAL 68 HG11 VAL 68 96.010 -6.002 -8.706 422 HG12 VAL 68 HG12 VAL 68 96.622 -4.770 -7.599 423 HG13 VAL 68 HG13 VAL 68 95.471 -5.982 -7.027 424 HG21 VAL 68 HG21 VAL 68 98.260 -6.423 -9.281 425 HG22 VAL 68 HG22 VAL 68 99.320 -7.332 -8.205 426 HG23 VAL 68 HG23 VAL 68 99.147 -5.588 -8.005 427 H LYS 69 HN LYS 69 100.330 -6.091 -6.604 428 HA LYS 69 HA LYS 69 101.336 -8.681 -6.194 429 HB2 LYS 69 HB2 LYS 69 102.424 -7.104 -7.690 430 HB3 LYS 69 HB1 LYS 69 102.807 -6.055 -6.326 431 HG2 LYS 69 HG2 LYS 69 104.254 -7.725 -5.354 432 HG3 LYS 69 HG1 LYS 69 103.762 -8.918 -6.553 433 HD2 LYS 69 HD2 LYS 69 104.767 -7.535 -8.329 434 HD3 LYS 69 HD1 LYS 69 105.247 -6.342 -7.123 435 HE2 LYS 69 HE2 LYS 69 106.629 -8.022 -5.985 436 HE3 LYS 69 HE1 LYS 69 106.142 -9.238 -7.166 437 HZ1 LYS 69 HZ1 LYS 69 107.030 -7.548 -8.866 438 HZ2 LYS 69 HZ2 LYS 69 108.146 -8.482 -7.990 439 HZ3 LYS 69 HZ3 LYS 69 107.853 -6.868 -7.548 440 H THR 70 HN THR 70 101.742 -5.776 -4.153 441 HA THR 70 HA THR 70 103.033 -7.394 -2.090 442 HB THR 70 HB THR 70 103.446 -5.264 -0.977 443 HG1 THR 70 HG1 THR 70 101.319 -4.547 -2.375 444 HG21 THR 70 HG21 THR 70 103.969 -5.371 -3.951 445 HG22 THR 70 HG22 THR 70 105.075 -5.750 -2.633 446 HG23 THR 70 HG23 THR 70 104.612 -4.079 -2.939 447 H SER 71 HN SER 71 99.880 -6.199 -2.808 448 HA SER 71 HA SER 71 97.891 -6.359 -1.655 449 HB2 SER 71 HB2 SER 71 97.602 -8.258 -0.375 450 HB3 SER 71 HB1 SER 71 99.137 -8.681 -1.130 451 HG SER 71 HG SER 71 99.873 -7.294 0.871 452 H ARG 72 HN ARG 72 99.947 -4.319 -0.986 453 HA ARG 72 HA ARG 72 99.287 -3.783 1.846 454 HB2 ARG 72 HB2 ARG 72 101.512 -2.725 0.089 455 HB3 ARG 72 HB1 ARG 72 101.196 -2.204 1.740 456 HG2 ARG 72 HG2 ARG 72 101.396 -4.633 2.432 457 HG3 ARG 72 HG1 ARG 72 101.989 -4.976 0.813 458 HD2 ARG 72 HD2 ARG 72 103.644 -2.936 1.394 459 HD3 ARG 72 HD1 ARG 72 103.315 -3.476 3.038 460 HE ARG 72 HE ARG 72 105.042 -4.746 1.223 461 HH11 ARG 72 HH11 ARG 72 105.762 -6.859 1.621 462 HH12 ARG 72 HH12 ARG 72 104.884 -7.870 2.719 463 HH21 ARG 72 HH21 ARG 72 102.500 -5.479 3.447 464 HH22 ARG 72 HH22 ARG 72 103.045 -7.092 3.739 465 H PHE 73 HN PHE 73 98.473 -1.798 2.442 466 HA PHE 73 HA PHE 73 97.045 -0.344 0.330 467 HB2 PHE 73 HB2 PHE 73 96.973 0.063 3.336 468 HB3 PHE 73 HB1 PHE 73 95.825 0.688 2.154 469 HD1 PHE 73 HD1 PHE 73 96.748 -2.127 4.234 470 HD2 PHE 73 HD2 PHE 73 94.426 -0.965 0.802 471 HE1 PHE 73 HE1 PHE 73 95.413 -4.208 4.427 472 HE2 PHE 73 HE2 PHE 73 93.099 -3.050 1.001 473 HZ PHE 73 HZ PHE 73 93.590 -4.665 2.812 474 H LEU 74 HN LEU 74 98.145 1.280 -0.631 475 HA LEU 74 HA LEU 74 100.447 2.493 0.527 476 HB2 LEU 74 HB2 LEU 74 100.315 2.441 -1.850 477 HB3 LEU 74 HB1 LEU 74 98.741 3.220 -1.855 478 HG LEU 74 HG LEU 74 99.695 5.309 -1.088 479 HD11 LEU 74 HD11 LEU 74 102.271 5.384 -0.863 480 HD12 LEU 74 HD12 LEU 74 102.180 3.630 -0.706 481 HD13 LEU 74 HD13 LEU 74 101.366 4.666 0.466 482 HD21 LEU 74 HD21 LEU 74 101.608 4.227 -3.168 483 HD22 LEU 74 HD22 LEU 74 101.019 5.879 -2.992 484 HD23 LEU 74 HD23 LEU 74 99.927 4.608 -3.536 485 H CYS 75 HN CYS 75 100.402 3.766 2.218 486 HA CYS 75 HA CYS 75 98.257 5.793 2.449 487 HB2 CYS 75 HB2 CYS 75 99.626 4.408 4.756 488 HB3 CYS 75 HB1 CYS 75 98.233 5.490 4.825 489 H GLN 76 HN GLN 76 98.851 7.789 3.413 490 HA GLN 76 HA GLN 76 101.701 8.424 2.987 491 HB2 GLN 76 HB2 GLN 76 100.056 9.645 1.633 492 HB3 GLN 76 HB1 GLN 76 99.288 10.245 3.103 493 HG2 GLN 76 HG2 GLN 76 101.323 11.412 3.747 494 HG3 GLN 76 HG1 GLN 76 102.193 10.709 2.387 495 HE21 GLN 76 HE21 GLN 76 102.295 12.037 0.573 496 HE22 GLN 76 HE22 GLN 76 101.181 13.263 0.211 497 H ARG 77 HN ARG 77 102.945 8.939 4.519 498 HA ARG 77 HA ARG 77 102.340 8.889 7.268 499 HB2 ARG 77 HB2 ARG 77 104.512 8.370 6.063 500 HB3 ARG 77 HB1 ARG 77 104.722 10.104 5.865 501 HG2 ARG 77 HG2 ARG 77 104.808 10.427 8.260 502 HG3 ARG 77 HG1 ARG 77 104.399 8.729 8.543 503 HD2 ARG 77 HD2 ARG 77 106.454 8.025 7.401 504 HD3 ARG 77 HD1 ARG 77 106.859 9.703 7.065 505 HE ARG 77 HE ARG 77 106.548 9.518 9.825 506 HH11 ARG 77 HH11 ARG 77 108.368 9.212 11.169 507 HH12 ARG 77 HH12 ARG 77 109.807 8.507 10.511 508 HH21 ARG 77 HH21 ARG 77 108.502 8.129 7.328 509 HH22 ARG 77 HH22 ARG 77 109.881 7.893 8.348 510 HA PRO 78 HA PRO 78 100.853 13.120 7.814 511 HB2 PRO 78 HB2 PRO 78 102.670 13.168 10.206 512 HB3 PRO 78 HB1 PRO 78 100.958 13.626 10.087 513 HG2 PRO 78 HG2 PRO 78 101.703 11.322 11.202 514 HG3 PRO 78 HG1 PRO 78 100.231 11.440 10.220 515 HD2 PRO 78 HD2 PRO 78 102.857 10.182 9.532 516 HD3 PRO 78 HD1 PRO 78 101.218 9.761 8.986 517 H ASP 79 HN ASP 79 104.261 12.310 8.118 518 HA ASP 79 HA ASP 79 105.304 14.937 7.765 519 HB2 ASP 79 HB2 ASP 79 106.533 12.938 8.722 520 HB3 ASP 79 HB1 ASP 79 106.690 12.344 7.070 521 H GLY 80 HN GLY 80 103.637 12.955 5.687 522 HA2 GLY 80 HA2 GLY 80 103.035 13.501 3.479 523 HA3 GLY 80 HA1 GLY 80 104.465 14.521 3.355 524 H ALA 81 HN ALA 81 105.120 11.494 4.757 525 HA ALA 81 HA ALA 81 106.562 10.646 2.362 526 HB1 ALA 81 HB1 ALA 81 107.854 9.358 3.775 527 HB2 ALA 81 HB2 ALA 81 106.503 8.964 4.840 528 HB3 ALA 81 HB3 ALA 81 107.275 10.545 4.940 529 H LEU 82 HN LEU 82 106.280 8.575 1.407 530 HA LEU 82 HA LEU 82 103.543 7.462 1.715 531 HB2 LEU 82 HB2 LEU 82 105.252 8.003 -0.670 532 HB3 LEU 82 HB1 LEU 82 104.329 6.506 -0.712 533 HG LEU 82 HG LEU 82 102.256 7.842 -0.192 534 HD11 LEU 82 HD11 LEU 82 102.259 10.216 -0.285 535 HD12 LEU 82 HD12 LEU 82 103.917 10.270 -0.884 536 HD13 LEU 82 HD13 LEU 82 103.593 9.791 0.773 537 HD21 LEU 82 HD21 LEU 82 103.174 7.250 -2.562 538 HD22 LEU 82 HD22 LEU 82 103.570 8.965 -2.665 539 HD23 LEU 82 HD23 LEU 82 101.899 8.456 -2.432 540 H TYR 83 HN TYR 83 103.281 5.364 2.203 541 HA TYR 83 HA TYR 83 105.423 3.443 1.790 542 HB2 TYR 83 HB2 TYR 83 105.687 2.833 4.117 543 HB3 TYR 83 HB1 TYR 83 106.026 4.555 3.946 544 HD1 TYR 83 HD1 TYR 83 103.801 2.049 5.376 545 HD2 TYR 83 HD2 TYR 83 104.303 6.252 4.621 546 HE1 TYR 83 HE1 TYR 83 102.015 2.560 7.021 547 HE2 TYR 83 HE2 TYR 83 102.517 6.760 6.268 548 HH TYR 83 HH TYR 83 100.359 5.189 7.174 549 H GLY 84 HN GLY 84 104.744 1.317 1.888 550 HA2 GLY 84 HA2 GLY 84 101.913 0.861 1.569 551 HA3 GLY 84 HA1 GLY 84 103.189 -0.354 1.509 552 H SER 85 HN SER 85 100.507 -0.008 3.066 553 HA SER 85 HA SER 85 101.607 -0.674 5.752 554 HB2 SER 85 HB2 SER 85 99.690 0.327 6.752 555 HB3 SER 85 HB1 SER 85 100.284 1.480 5.562 556 HG SER 85 HG SER 85 98.047 -0.230 5.453 557 H LEU 86 HN LEU 86 100.728 -2.379 6.864 558 HA LEU 86 HA LEU 86 99.364 -4.392 5.236 559 HB2 LEU 86 HB2 LEU 86 100.766 -4.400 7.903 560 HB3 LEU 86 HB1 LEU 86 99.749 -5.755 7.425 561 HG LEU 86 HG LEU 86 102.212 -6.006 6.879 562 HD11 LEU 86 HD11 LEU 86 100.710 -6.011 4.275 563 HD12 LEU 86 HD12 LEU 86 100.141 -7.051 5.580 564 HD13 LEU 86 HD13 LEU 86 101.775 -7.232 4.964 565 HD21 LEU 86 HD21 LEU 86 103.202 -4.700 5.143 566 HD22 LEU 86 HD22 LEU 86 102.397 -3.540 6.198 567 HD23 LEU 86 HD23 LEU 86 101.647 -4.013 4.675 568 H HIS 87 HN HIS 87 98.542 -1.901 7.297 569 HA HIS 87 HA HIS 87 95.906 -3.120 7.884 570 HB2 HIS 87 HB2 HIS 87 97.177 -3.077 9.962 571 HB3 HIS 87 HB1 HIS 87 97.561 -1.372 9.725 572 HD2 HIS 87 HD2 HIS 87 96.002 -0.925 12.176 573 HE1 HIS 87 HE1 HIS 87 92.293 -1.567 10.266 574 HE2 HIS 87 HE2 HIS 87 93.410 -0.676 12.363 575 H PHE 88 HN PHE 88 94.223 -1.949 7.294 576 HA PHE 88 HA PHE 88 94.569 0.401 5.737 577 HB2 PHE 88 HB2 PHE 88 92.758 -1.144 5.274 578 HB3 PHE 88 HB1 PHE 88 92.066 -0.863 6.873 579 HD1 PHE 88 HD1 PHE 88 93.275 1.104 3.920 580 HD2 PHE 88 HD2 PHE 88 90.321 0.706 7.016 581 HE1 PHE 88 HE1 PHE 88 92.072 3.071 3.025 582 HE2 PHE 88 HE2 PHE 88 89.116 2.677 6.114 583 HZ PHE 88 HZ PHE 88 89.992 3.857 4.123 584 H ASP 89 HN ASP 89 94.386 2.493 6.206 585 HA ASP 89 HA ASP 89 93.333 3.333 8.820 586 HB2 ASP 89 HB2 ASP 89 95.857 3.143 8.886 587 HB3 ASP 89 HB1 ASP 89 95.907 4.422 7.675 588 HA PRO 90 HA PRO 90 91.552 5.893 5.477 589 HB2 PRO 90 HB2 PRO 90 89.527 7.066 6.909 590 HB3 PRO 90 HB1 PRO 90 89.432 5.423 6.245 591 HG2 PRO 90 HG2 PRO 90 90.044 6.299 9.030 592 HG3 PRO 90 HG1 PRO 90 89.049 4.945 8.467 593 HD2 PRO 90 HD2 PRO 90 91.609 4.632 9.373 594 HD3 PRO 90 HD1 PRO 90 90.882 3.549 8.164 595 H GLU 91 HN GLU 91 92.734 6.959 8.559 596 HA GLU 91 HA GLU 91 92.559 9.767 8.099 597 HB2 GLU 91 HB2 GLU 91 92.821 8.739 10.345 598 HB3 GLU 91 HB1 GLU 91 94.467 8.278 9.912 599 HG2 GLU 91 HG2 GLU 91 95.061 10.635 9.575 600 HG3 GLU 91 HG1 GLU 91 93.403 11.116 9.932 601 H ALA 92 HN ALA 92 94.692 7.328 6.913 602 HA ALA 92 HA ALA 92 96.426 9.434 5.736 603 HB1 ALA 92 HB1 ALA 92 97.284 6.811 6.972 604 HB2 ALA 92 HB2 ALA 92 97.738 8.436 7.486 605 HB3 ALA 92 HB3 ALA 92 98.328 7.799 5.949 606 H CYS 93 HN CYS 93 94.928 6.272 5.435 607 HA CYS 93 HA CYS 93 96.030 5.795 2.812 608 HB2 CYS 93 HB2 CYS 93 93.772 4.298 4.124 609 HB3 CYS 93 HB1 CYS 93 94.869 3.728 2.867 610 H SER 94 HN SER 94 93.376 7.586 3.976 611 HA SER 94 HA SER 94 91.715 7.211 1.637 612 HB2 SER 94 HB2 SER 94 91.578 9.341 3.792 613 HB3 SER 94 HB1 SER 94 90.344 9.001 2.584 614 HG SER 94 HG SER 94 90.685 7.851 4.940 615 H PHE 95 HN PHE 95 91.600 8.551 -0.139 616 HA PHE 95 HA PHE 95 93.441 10.871 -0.241 617 HB2 PHE 95 HB2 PHE 95 93.145 8.728 -2.349 618 HB3 PHE 95 HB1 PHE 95 94.086 10.204 -2.522 619 HD1 PHE 95 HD1 PHE 95 93.947 6.870 -1.029 620 HD2 PHE 95 HD2 PHE 95 96.105 10.581 -1.129 621 HE1 PHE 95 HE1 PHE 95 95.879 5.769 0.056 622 HE2 PHE 95 HE2 PHE 95 98.041 9.484 -0.035 623 HZ PHE 95 HZ PHE 95 97.937 7.077 0.549 624 H ARG 96 HN ARG 96 92.800 12.545 -1.526 625 HA ARG 96 HA ARG 96 89.992 12.496 -2.445 626 HB2 ARG 96 HB2 ARG 96 90.661 14.283 -0.844 627 HB3 ARG 96 HB1 ARG 96 91.853 14.852 -2.015 628 HG2 ARG 96 HG2 ARG 96 90.086 15.297 -3.648 629 HG3 ARG 96 HG1 ARG 96 88.875 14.645 -2.543 630 HD2 ARG 96 HD2 ARG 96 90.646 17.009 -1.880 631 HD3 ARG 96 HD1 ARG 96 89.023 17.160 -2.547 632 HE ARG 96 HE ARG 96 88.847 15.515 -0.289 633 HH11 ARG 96 HH11 ARG 96 88.137 16.405 1.679 634 HH12 ARG 96 HH12 ARG 96 88.302 18.106 1.962 635 HH21 ARG 96 HH21 ARG 96 89.714 18.759 -1.135 636 HH22 ARG 96 HH22 ARG 96 89.192 19.435 0.371 637 H GLU 97 HN GLU 97 89.546 12.604 -4.609 638 HA GLU 97 HA GLU 97 91.827 12.582 -6.443 639 HB2 GLU 97 HB2 GLU 97 90.159 11.944 -8.143 640 HB3 GLU 97 HB1 GLU 97 90.109 10.874 -6.743 641 HG2 GLU 97 HG2 GLU 97 88.231 12.348 -5.843 642 HG3 GLU 97 HG1 GLU 97 88.199 13.116 -7.429 643 H LEU 98 HN LEU 98 92.501 14.259 -7.540 644 HA LEU 98 HA LEU 98 90.729 16.622 -7.872 645 HB2 LEU 98 HB2 LEU 98 93.753 16.513 -7.881 646 HB3 LEU 98 HB1 LEU 98 92.752 17.961 -7.930 647 HG LEU 98 HG LEU 98 92.798 15.964 -5.645 648 HD11 LEU 98 HD11 LEU 98 93.970 18.758 -5.809 649 HD12 LEU 98 HD12 LEU 98 94.909 17.267 -5.894 650 HD13 LEU 98 HD13 LEU 98 94.031 17.674 -4.420 651 HD21 LEU 98 HD21 LEU 98 91.649 18.043 -4.527 652 HD22 LEU 98 HD22 LEU 98 90.685 16.992 -5.562 653 HD23 LEU 98 HD23 LEU 98 91.293 18.525 -6.187 654 H LEU 99 HN LEU 99 90.112 16.982 -9.943 655 HA LEU 99 HA LEU 99 91.782 15.862 -12.135 656 HB2 LEU 99 HB2 LEU 99 88.911 15.704 -11.557 657 HB3 LEU 99 HB1 LEU 99 89.209 16.301 -13.182 658 HG LEU 99 HG LEU 99 88.977 13.800 -13.021 659 HD11 LEU 99 HD11 LEU 99 91.789 14.409 -13.912 660 HD12 LEU 99 HD12 LEU 99 90.422 15.128 -14.761 661 HD13 LEU 99 HD13 LEU 99 90.579 13.375 -14.665 662 HD21 LEU 99 HD21 LEU 99 91.739 13.599 -11.878 663 HD22 LEU 99 HD22 LEU 99 90.400 12.466 -11.787 664 HD23 LEU 99 HD23 LEU 99 90.409 13.895 -10.759 665 H LEU 100 HN LEU 100 92.742 17.237 -13.361 666 HA LEU 100 HA LEU 100 92.142 20.066 -13.265 667 HB2 LEU 100 HB2 LEU 100 94.168 18.383 -14.740 668 HB3 LEU 100 HB1 LEU 100 93.993 20.100 -15.063 669 HG LEU 100 HG LEU 100 95.795 19.329 -13.343 670 HD11 LEU 100 HD11 LEU 100 95.169 21.660 -13.722 671 HD12 LEU 100 HD12 LEU 100 95.460 21.357 -12.011 672 HD13 LEU 100 HD13 LEU 100 93.811 21.490 -12.612 673 HD21 LEU 100 HD21 LEU 100 93.386 19.333 -11.502 674 HD22 LEU 100 HD22 LEU 100 95.062 19.019 -11.070 675 HD23 LEU 100 HD23 LEU 100 94.182 17.865 -12.063 676 H GLU 101 HN GLU 101 91.373 21.313 -14.972 677 HA GLU 101 HA GLU 101 89.373 20.191 -16.597 678 HB2 GLU 101 HB2 GLU 101 90.938 22.759 -16.978 679 HB3 GLU 101 HB1 GLU 101 89.421 22.356 -17.785 680 HG2 GLU 101 HG2 GLU 101 88.291 22.191 -15.618 681 HG3 GLU 101 HG1 GLU 101 89.809 22.542 -14.793 682 H ASP 102 HN ASP 102 92.784 20.582 -16.967 683 HA ASP 102 HA ASP 102 92.890 20.160 -19.805 684 HB2 ASP 102 HB2 ASP 102 94.668 21.277 -18.359 685 HB3 ASP 102 HB1 ASP 102 95.110 19.657 -17.835 686 H GLY 103 HN GLY 103 92.369 18.123 -17.105 687 HA2 GLY 103 HA2 GLY 103 91.610 15.873 -17.463 688 HA3 GLY 103 HA1 GLY 103 92.683 15.749 -18.847 689 H TYR 104 HN TYR 104 94.402 17.247 -16.358 690 HA TYR 104 HA TYR 104 95.876 14.781 -15.853 691 HB2 TYR 104 HB2 TYR 104 96.325 17.597 -14.796 692 HB3 TYR 104 HB1 TYR 104 97.374 16.216 -14.485 693 HD1 TYR 104 HD1 TYR 104 96.912 18.988 -16.573 694 HD2 TYR 104 HD2 TYR 104 98.051 14.848 -16.715 695 HE1 TYR 104 HE1 TYR 104 98.066 19.382 -18.728 696 HE2 TYR 104 HE2 TYR 104 99.211 15.247 -18.873 697 HH TYR 104 HH TYR 104 99.414 18.513 -20.272 698 H ASN 105 HN ASN 105 95.942 13.666 -13.918 699 HA ASN 105 HA ASN 105 93.891 14.456 -11.922 700 HB2 ASN 105 HB2 ASN 105 94.995 11.684 -12.346 701 HB3 ASN 105 HB1 ASN 105 93.555 12.158 -11.445 702 HD21 ASN 105 HD21 ASN 105 92.152 10.834 -12.780 703 HD22 ASN 105 HD22 ASN 105 91.786 11.267 -14.380 704 H VAL 106 HN VAL 106 94.430 14.635 -9.831 705 HA VAL 106 HA VAL 106 97.112 13.773 -8.959 706 HB VAL 106 HB VAL 106 96.056 16.469 -8.124 707 HG11 VAL 106 HG11 VAL 106 97.928 15.523 -6.870 708 HG12 VAL 106 HG12 VAL 106 98.485 16.889 -7.835 709 HG13 VAL 106 HG13 VAL 106 98.817 15.243 -8.368 710 HG21 VAL 106 HG21 VAL 106 97.519 17.414 -9.956 711 HG22 VAL 106 HG22 VAL 106 96.062 16.607 -10.536 712 HG23 VAL 106 HG23 VAL 106 97.621 15.787 -10.627 713 H TYR 107 HN TYR 107 97.285 13.477 -6.667 714 HA TYR 107 HA TYR 107 94.654 13.162 -5.318 715 HB2 TYR 107 HB2 TYR 107 97.103 11.399 -5.132 716 HB3 TYR 107 HB1 TYR 107 95.648 11.227 -4.147 717 HD1 TYR 107 HD1 TYR 107 97.142 10.648 -7.418 718 HD2 TYR 107 HD2 TYR 107 93.451 10.754 -5.229 719 HE1 TYR 107 HE1 TYR 107 96.020 9.415 -9.252 720 HE2 TYR 107 HE2 TYR 107 92.324 9.518 -7.061 721 HH TYR 107 HH TYR 107 92.640 8.370 -8.982 722 H GLN 108 HN GLN 108 94.532 13.458 -3.121 723 HA GLN 108 HA GLN 108 96.797 14.576 -1.658 724 HB2 GLN 108 HB2 GLN 108 95.929 16.557 -2.736 725 HB3 GLN 108 HB1 GLN 108 94.278 16.138 -2.283 726 HG2 GLN 108 HG2 GLN 108 94.797 16.450 0.074 727 HG3 GLN 108 HG1 GLN 108 96.500 16.715 -0.300 728 HE21 GLN 108 HE21 GLN 108 94.473 18.595 0.953 729 HE22 GLN 108 HE22 GLN 108 94.500 19.977 -0.033 730 H SER 109 HN SER 109 96.687 13.994 0.458 731 HA SER 109 HA SER 109 94.727 12.193 1.372 732 HB2 SER 109 HB2 SER 109 95.738 12.434 3.557 733 HB3 SER 109 HB1 SER 109 97.014 12.438 2.345 734 HG SER 109 HG SER 109 96.675 14.845 2.451 735 H GLU 110 HN GLU 110 92.690 12.532 1.987 736 HA GLU 110 HA GLU 110 91.595 15.159 2.097 737 HB2 GLU 110 HB2 GLU 110 89.496 14.055 2.563 738 HB3 GLU 110 HB1 GLU 110 90.352 13.153 1.318 739 HG2 GLU 110 HG2 GLU 110 89.739 11.404 2.722 740 HG3 GLU 110 HG1 GLU 110 91.312 11.802 3.405 741 H ALA 111 HN ALA 111 92.360 12.731 4.569 742 HA ALA 111 HA ALA 111 91.220 14.117 6.747 743 HB1 ALA 111 HB1 ALA 111 92.357 12.554 8.146 744 HB2 ALA 111 HB2 ALA 111 93.545 12.212 6.893 745 HB3 ALA 111 HB3 ALA 111 91.876 11.683 6.689 746 H HIS 112 HN HIS 112 94.628 14.001 5.644 747 HA HIS 112 HA HIS 112 95.289 16.088 7.613 748 HB2 HIS 112 HB2 HIS 112 96.954 14.257 5.889 749 HB3 HIS 112 HB1 HIS 112 97.651 15.573 6.829 750 HD2 HIS 112 HD2 HIS 112 96.734 11.929 7.355 751 HE1 HIS 112 HE1 HIS 112 96.884 13.635 11.215 752 HE2 HIS 112 HE2 HIS 112 96.763 11.451 9.923 753 H GLY 113 HN GLY 113 94.722 15.782 4.199 754 HA2 GLY 113 HA2 GLY 113 94.625 17.503 2.617 755 HA3 GLY 113 HA1 GLY 113 95.152 18.620 3.869 756 H LEU 114 HN LEU 114 97.166 15.916 3.736 757 HA LEU 114 HA LEU 114 99.379 17.467 2.815 758 HB2 LEU 114 HB2 LEU 114 99.011 14.573 3.554 759 HB3 LEU 114 HB1 LEU 114 100.545 15.159 2.916 760 HG LEU 114 HG LEU 114 99.270 16.641 5.216 761 HD11 LEU 114 HD11 LEU 114 99.290 14.183 5.808 762 HD12 LEU 114 HD12 LEU 114 100.308 15.184 6.840 763 HD13 LEU 114 HD13 LEU 114 101.038 14.204 5.570 764 HD21 LEU 114 HD21 LEU 114 102.137 16.043 4.406 765 HD22 LEU 114 HD22 LEU 114 101.656 17.045 5.774 766 HD23 LEU 114 HD23 LEU 114 101.285 17.562 4.130 767 HA PRO 115 HA PRO 115 98.859 16.428 -1.521 768 HB2 PRO 115 HB2 PRO 115 101.234 17.271 -2.515 769 HB3 PRO 115 HB1 PRO 115 100.020 18.419 -1.907 770 HG2 PRO 115 HG2 PRO 115 102.446 17.335 -0.528 771 HG3 PRO 115 HG1 PRO 115 101.867 19.010 -0.623 772 HD2 PRO 115 HD2 PRO 115 101.393 17.425 1.553 773 HD3 PRO 115 HD1 PRO 115 100.258 18.690 1.030 774 H LEU 116 HN LEU 116 99.512 14.797 -3.019 775 HA LEU 116 HA LEU 116 101.192 12.678 -1.843 776 HB2 LEU 116 HB2 LEU 116 98.886 12.159 -2.643 777 HB3 LEU 116 HB1 LEU 116 99.386 12.582 -4.275 778 HG LEU 116 HG LEU 116 101.125 10.595 -2.855 779 HD11 LEU 116 HD11 LEU 116 99.546 8.734 -3.524 780 HD12 LEU 116 HD12 LEU 116 98.305 9.964 -3.753 781 HD13 LEU 116 HD13 LEU 116 99.007 9.708 -2.157 782 HD21 LEU 116 HD21 LEU 116 101.046 9.525 -5.128 783 HD22 LEU 116 HD22 LEU 116 101.615 11.189 -5.169 784 HD23 LEU 116 HD23 LEU 116 99.964 10.813 -5.654 785 H HIS 117 HN HIS 117 103.224 12.451 -2.471 786 HA HIS 117 HA HIS 117 103.999 12.846 -5.250 787 HB2 HIS 117 HB2 HIS 117 105.769 14.463 -4.716 788 HB3 HIS 117 HB1 HIS 117 104.182 15.121 -4.310 789 HD2 HIS 117 HD2 HIS 117 103.839 15.737 -1.604 790 HE1 HIS 117 HE1 HIS 117 107.431 14.020 -0.203 791 HE2 HIS 117 HE2 HIS 117 105.431 15.444 0.445 792 H LEU 118 HN LEU 118 106.028 11.919 -5.745 793 HA LEU 118 HA LEU 118 106.739 9.638 -4.251 794 HB2 LEU 118 HB2 LEU 118 108.216 11.144 -6.410 795 HB3 LEU 118 HB1 LEU 118 108.748 9.597 -5.759 796 HG LEU 118 HG LEU 118 106.020 10.069 -6.994 797 HD11 LEU 118 HD11 LEU 118 106.861 8.998 -8.988 798 HD12 LEU 118 HD12 LEU 118 108.417 8.678 -8.221 799 HD13 LEU 118 HD13 LEU 118 107.944 10.335 -8.599 800 HD21 LEU 118 HD21 LEU 118 106.391 7.414 -7.173 801 HD22 LEU 118 HD22 LEU 118 105.712 8.154 -5.728 802 HD23 LEU 118 HD23 LEU 118 107.416 7.706 -5.766 803 HA PRO 119 HA PRO 119 109.169 11.785 -1.058 804 HB2 PRO 119 HB2 PRO 119 110.605 9.161 -0.884 805 HB3 PRO 119 HB1 PRO 119 109.888 10.141 0.410 806 HG2 PRO 119 HG2 PRO 119 108.719 7.903 -0.483 807 HG3 PRO 119 HG1 PRO 119 107.776 9.303 0.057 808 HD2 PRO 119 HD2 PRO 119 108.244 8.318 -2.726 809 HD3 PRO 119 HD1 PRO 119 106.859 9.205 -2.051 810 H GLY 120 HN GLY 120 110.965 13.009 -1.310 811 HA2 GLY 120 HA2 GLY 120 112.846 12.349 -3.488 812 HA3 GLY 120 HA1 GLY 120 112.625 13.935 -2.753 813 H ASN 121 HN ASN 121 112.866 11.025 -0.843 814 HA ASN 121 HA ASN 121 115.281 12.064 0.459 815 HB2 ASN 121 HB2 ASN 121 113.664 9.627 1.213 816 HB3 ASN 121 HB1 ASN 121 114.781 10.539 2.227 817 HD21 ASN 121 HD21 ASN 121 111.884 11.285 0.194 818 HD22 ASN 121 HD22 ASN 121 111.161 12.295 1.351 819 H LYS 122 HN LYS 122 116.639 10.006 1.343 820 HA LYS 122 HA LYS 122 118.343 8.592 0.726 821 HB2 LYS 122 HB2 LYS 122 115.933 7.439 -0.673 822 HB3 LYS 122 HB1 LYS 122 117.508 6.647 -0.738 823 HG2 LYS 122 HG2 LYS 122 117.580 6.551 1.715 824 HG3 LYS 122 HG1 LYS 122 116.028 7.384 1.809 825 HD2 LYS 122 HD2 LYS 122 114.960 5.535 0.568 826 HD3 LYS 122 HD1 LYS 122 116.508 4.693 0.493 827 HE2 LYS 122 HE2 LYS 122 115.186 5.519 3.089 828 HE3 LYS 122 HE1 LYS 122 114.975 3.928 2.360 829 HZ1 LYS 122 HZ1 LYS 122 117.605 5.117 3.060 830 HZ2 LYS 122 HZ2 LYS 122 117.316 3.536 2.509 831 HZ3 LYS 122 HZ3 LYS 122 116.759 4.021 4.039 832 H SER 123 HN SER 123 119.720 9.942 -0.356 833 HA SER 123 HA SER 123 120.725 11.014 -2.165 834 HB2 SER 123 HB2 SER 123 121.794 9.401 -3.542 835 HB3 SER 123 HB1 SER 123 121.574 8.640 -1.968 836 HG SER 123 HG SER 123 120.197 7.288 -2.819 837 HA PRO 124 HA PRO 124 116.961 11.235 -4.942 838 HB2 PRO 124 HB2 PRO 124 116.682 13.968 -4.891 839 HB3 PRO 124 HB1 PRO 124 115.912 12.893 -3.706 840 HG2 PRO 124 HG2 PRO 124 118.415 14.505 -3.450 841 HG3 PRO 124 HG1 PRO 124 117.120 14.243 -2.267 842 HD2 PRO 124 HD2 PRO 124 119.487 12.895 -2.165 843 HD3 PRO 124 HD1 PRO 124 117.964 12.174 -1.601 844 H HIS 125 HN HIS 125 117.082 11.692 -7.149 845 HA HIS 125 HA HIS 125 119.715 12.184 -8.197 846 HB2 HIS 125 HB2 HIS 125 117.063 11.879 -9.626 847 HB3 HIS 125 HB1 HIS 125 118.658 11.801 -10.378 848 HD2 HIS 125 HD2 HIS 125 116.248 9.521 -8.365 849 HE1 HIS 125 HE1 HIS 125 119.867 7.393 -8.798 850 HE2 HIS 125 HE2 HIS 125 117.442 7.219 -8.064 851 H ARG 126 HN ARG 126 120.557 14.124 -8.541 852 HA ARG 126 HA ARG 126 120.680 16.440 -8.646 853 HB2 ARG 126 HB2 ARG 126 118.873 15.695 -10.958 854 HB3 ARG 126 HB1 ARG 126 119.631 17.277 -10.770 855 HG2 ARG 126 HG2 ARG 126 121.854 16.242 -10.785 856 HG3 ARG 126 HG1 ARG 126 121.123 14.640 -10.904 857 HD2 ARG 126 HD2 ARG 126 120.074 15.294 -13.048 858 HD3 ARG 126 HD1 ARG 126 120.853 16.870 -12.943 859 HE ARG 126 HE ARG 126 122.122 14.345 -13.638 860 HH11 ARG 126 HH11 ARG 126 124.276 14.528 -14.341 861 HH12 ARG 126 HH12 ARG 126 125.136 16.012 -14.099 862 HH21 ARG 126 HH21 ARG 126 122.487 17.601 -12.525 863 HH22 ARG 126 HH22 ARG 126 124.121 17.754 -13.078 864 H ASP 127 HN ASP 127 119.662 17.059 -6.722 865 HA ASP 127 HA ASP 127 117.211 17.210 -5.789 866 HB2 ASP 127 HB2 ASP 127 117.660 19.565 -5.001 867 HB3 ASP 127 HB1 ASP 127 118.919 18.387 -4.638 868 HA PRO 128 HA PRO 128 115.170 19.277 -9.339 869 HB2 PRO 128 HB2 PRO 128 112.895 17.820 -9.396 870 HB3 PRO 128 HB1 PRO 128 114.424 17.193 -10.046 871 HG2 PRO 128 HG2 PRO 128 113.069 16.572 -7.465 872 HG3 PRO 128 HG1 PRO 128 113.982 15.503 -8.546 873 HD2 PRO 128 HD2 PRO 128 114.997 16.695 -6.212 874 HD3 PRO 128 HD1 PRO 128 115.983 15.999 -7.513 875 H ALA 129 HN ALA 129 113.235 20.597 -9.487 876 HA ALA 129 HA ALA 129 111.917 21.230 -6.913 877 HB1 ALA 129 HB1 ALA 129 113.789 22.823 -7.352 878 HB2 ALA 129 HB2 ALA 129 112.204 23.595 -7.298 879 HB3 ALA 129 HB3 ALA 129 112.985 23.292 -8.850 880 HA PRO 130 HA PRO 130 108.944 20.861 -10.450 881 HB2 PRO 130 HB2 PRO 130 107.109 19.251 -9.257 882 HB3 PRO 130 HB1 PRO 130 108.593 18.613 -9.998 883 HG2 PRO 130 HG2 PRO 130 107.998 19.140 -7.118 884 HG3 PRO 130 HG1 PRO 130 108.835 17.763 -7.861 885 HD2 PRO 130 HD2 PRO 130 110.150 19.866 -6.671 886 HD3 PRO 130 HD1 PRO 130 110.865 18.887 -7.971 887 H ARG 131 HN ARG 131 106.821 21.766 -10.694 888 HA ARG 131 HA ARG 131 106.207 23.805 -8.678 889 HB2 ARG 131 HB2 ARG 131 106.380 24.252 -11.186 890 HB3 ARG 131 HB1 ARG 131 104.857 23.379 -11.346 891 HG2 ARG 131 HG2 ARG 131 103.750 24.954 -9.842 892 HG3 ARG 131 HG1 ARG 131 105.278 25.788 -9.554 893 HD2 ARG 131 HD2 ARG 131 104.015 27.034 -11.216 894 HD3 ARG 131 HD1 ARG 131 105.419 26.301 -11.984 895 HE ARG 131 HE ARG 131 103.991 24.887 -13.186 896 HH11 ARG 131 HH11 ARG 131 101.933 24.413 -14.022 897 HH12 ARG 131 HH12 ARG 131 100.520 25.015 -13.222 898 HH21 ARG 131 HH21 ARG 131 102.296 26.682 -10.756 899 HH22 ARG 131 HH22 ARG 131 100.725 26.308 -11.385 900 H GLY 132 HN GLY 132 104.896 23.203 -7.079 901 HA2 GLY 132 HA2 GLY 132 103.034 22.423 -5.982 902 HA3 GLY 132 HA1 GLY 132 102.250 22.265 -7.553 903 HA PRO 133 HA PRO 133 103.094 18.014 -5.757 904 HB2 PRO 133 HB2 PRO 133 100.293 17.543 -6.621 905 HB3 PRO 133 HB1 PRO 133 101.049 17.211 -5.055 906 HG2 PRO 133 HG2 PRO 133 99.283 19.210 -5.392 907 HG3 PRO 133 HG1 PRO 133 100.645 19.335 -4.262 908 HD2 PRO 133 HD2 PRO 133 100.349 20.543 -6.997 909 HD3 PRO 133 HD1 PRO 133 101.086 21.234 -5.533 910 H ALA 134 HN ALA 134 103.397 16.068 -7.004 911 HA ALA 134 HA ALA 134 103.879 16.516 -9.778 912 HB1 ALA 134 HB1 ALA 134 105.160 14.920 -8.309 913 HB2 ALA 134 HB2 ALA 134 104.625 14.239 -9.844 914 HB3 ALA 134 HB3 ALA 134 103.759 13.849 -8.359 915 H ARG 135 HN ARG 135 102.716 15.982 -11.547 916 HA ARG 135 HA ARG 135 99.909 15.350 -11.197 917 HB2 ARG 135 HB2 ARG 135 99.836 15.601 -13.680 918 HB3 ARG 135 HB1 ARG 135 100.521 17.001 -12.855 919 HG2 ARG 135 HG2 ARG 135 102.803 16.136 -13.317 920 HG3 ARG 135 HG1 ARG 135 102.095 14.785 -14.203 921 HD2 ARG 135 HD2 ARG 135 101.033 16.363 -15.771 922 HD3 ARG 135 HD1 ARG 135 101.725 17.715 -14.880 923 HE ARG 135 HE ARG 135 103.097 16.025 -16.769 924 HH11 ARG 135 HH11 ARG 135 105.279 16.521 -17.137 925 HH12 ARG 135 HH12 ARG 135 106.134 17.530 -16.018 926 HH21 ARG 135 HH21 ARG 135 103.397 17.993 -13.939 927 HH22 ARG 135 HH22 ARG 135 105.063 18.377 -14.216 928 H PHE 136 HN PHE 136 98.925 13.456 -11.565 929 HA PHE 136 HA PHE 136 100.576 11.177 -12.513 930 HB2 PHE 136 HB2 PHE 136 98.804 11.497 -10.138 931 HB3 PHE 136 HB1 PHE 136 98.698 9.952 -10.982 932 HD1 PHE 136 HD1 PHE 136 100.738 12.039 -8.778 933 HD2 PHE 136 HD2 PHE 136 100.776 8.610 -11.373 934 HE1 PHE 136 HE1 PHE 136 102.859 11.261 -7.739 935 HE2 PHE 136 HE2 PHE 136 102.884 7.840 -10.335 936 HZ PHE 136 HZ PHE 136 103.930 9.162 -8.526 937 H LEU 137 HN LEU 137 99.566 9.590 -13.714 938 HA LEU 137 HA LEU 137 96.926 10.237 -14.869 939 HB2 LEU 137 HB2 LEU 137 99.526 9.666 -16.272 940 HB3 LEU 137 HB1 LEU 137 97.979 9.408 -17.076 941 HG LEU 137 HG LEU 137 98.446 12.052 -15.707 942 HD11 LEU 137 HD11 LEU 137 99.501 12.949 -17.753 943 HD12 LEU 137 HD12 LEU 137 99.547 11.325 -18.440 944 HD13 LEU 137 HD13 LEU 137 100.507 11.705 -17.009 945 HD21 LEU 137 HD21 LEU 137 96.260 11.437 -16.760 946 HD22 LEU 137 HD22 LEU 137 97.086 11.279 -18.308 947 HD23 LEU 137 HD23 LEU 137 97.001 12.850 -17.512 948 HA PRO 138 HA PRO 138 96.832 5.806 -13.809 949 HB2 PRO 138 HB2 PRO 138 94.149 5.436 -13.817 950 HB3 PRO 138 HB1 PRO 138 94.975 6.293 -12.499 951 HG2 PRO 138 HG2 PRO 138 93.430 7.401 -14.799 952 HG3 PRO 138 HG1 PRO 138 93.472 7.935 -13.109 953 HD2 PRO 138 HD2 PRO 138 94.908 9.138 -15.166 954 HD3 PRO 138 HD1 PRO 138 95.340 9.256 -13.445 955 H LEU 139 HN LEU 139 97.026 4.074 -15.161 956 HA LEU 139 HA LEU 139 95.991 4.332 -17.916 957 HB2 LEU 139 HB2 LEU 139 97.999 2.229 -17.199 958 HB3 LEU 139 HB1 LEU 139 97.814 3.141 -18.691 959 HG LEU 139 HG LEU 139 98.835 4.303 -16.078 960 HD11 LEU 139 HD11 LEU 139 100.990 4.425 -17.454 961 HD12 LEU 139 HD12 LEU 139 100.223 3.290 -18.565 962 HD13 LEU 139 HD13 LEU 139 100.517 2.823 -16.890 963 HD21 LEU 139 HD21 LEU 139 99.432 6.220 -17.522 964 HD22 LEU 139 HD22 LEU 139 97.695 5.928 -17.553 965 HD23 LEU 139 HD23 LEU 139 98.700 5.404 -18.901 966 HA PRO 140 HA PRO 140 92.957 1.145 -16.924 967 HB2 PRO 140 HB2 PRO 140 93.494 0.183 -19.714 968 HB3 PRO 140 HB1 PRO 140 91.942 0.527 -18.921 969 HG2 PRO 140 HG2 PRO 140 92.996 2.205 -20.710 970 HG3 PRO 140 HG1 PRO 140 92.104 2.794 -19.295 971 HD2 PRO 140 HD2 PRO 140 95.049 2.839 -19.810 972 HD3 PRO 140 HD1 PRO 140 94.040 3.955 -18.863 973 H GLY 141 HN GLY 141 93.278 -0.726 -15.869 974 HA2 GLY 141 HA2 GLY 141 95.768 -2.201 -16.233 975 HA3 GLY 141 HA1 GLY 141 94.600 -2.417 -14.936 Start of MODEL 3 1 H1 GLY 13 HT1 GLY 13 83.846 0.623 -10.654 2 H2 GLY 13 HT2 GLY 13 82.972 1.521 -11.804 3 H3 GLY 13 HT3 GLY 13 82.676 -0.142 -11.617 4 HA2 GLY 13 HA2 GLY 13 81.151 1.716 -10.518 5 HA3 GLY 13 HA1 GLY 13 81.391 0.122 -9.805 6 H GLN 14 HN GLN 14 81.414 0.536 -7.663 7 HA GLN 14 HA GLN 14 82.491 2.835 -6.434 8 HB2 GLN 14 HB2 GLN 14 81.925 0.072 -5.331 9 HB3 GLN 14 HB1 GLN 14 82.353 1.468 -4.340 10 HG2 GLN 14 HG2 GLN 14 80.407 2.694 -5.137 11 HG3 GLN 14 HG1 GLN 14 80.009 1.390 -6.254 12 HE21 GLN 14 HE21 GLN 14 78.074 0.577 -5.373 13 HE22 GLN 14 HE22 GLN 14 77.917 0.025 -3.775 14 H VAL 15 HN VAL 15 83.887 -0.275 -7.289 15 HA VAL 15 HA VAL 15 86.561 0.764 -6.536 16 HB VAL 15 HB VAL 15 86.097 -0.857 -4.874 17 HG11 VAL 15 HG11 VAL 15 85.066 -2.568 -7.148 18 HG12 VAL 15 HG12 VAL 15 84.143 -1.925 -5.788 19 HG13 VAL 15 HG13 VAL 15 85.351 -3.183 -5.518 20 HG21 VAL 15 HG21 VAL 15 88.301 -1.074 -6.135 21 HG22 VAL 15 HG22 VAL 15 87.570 -2.421 -7.005 22 HG23 VAL 15 HG23 VAL 15 87.787 -2.512 -5.258 23 H ARG 16 HN ARG 16 88.072 0.584 -8.039 24 HA ARG 16 HA ARG 16 87.616 -1.149 -10.389 25 HB2 ARG 16 HB2 ARG 16 86.845 1.268 -10.784 26 HB3 ARG 16 HB1 ARG 16 88.547 1.707 -10.676 27 HG2 ARG 16 HG2 ARG 16 88.542 1.290 -12.943 28 HG3 ARG 16 HG1 ARG 16 88.712 -0.386 -12.442 29 HD2 ARG 16 HD2 ARG 16 86.053 0.982 -12.944 30 HD3 ARG 16 HD1 ARG 16 86.894 -0.020 -14.120 31 HE ARG 16 HE ARG 16 86.690 -1.601 -11.874 32 HH11 ARG 16 HH11 ARG 16 84.941 -3.020 -11.555 33 HH12 ARG 16 HH12 ARG 16 83.432 -2.711 -12.346 34 HH21 ARG 16 HH21 ARG 16 84.530 0.171 -13.923 35 HH22 ARG 16 HH22 ARG 16 83.195 -0.905 -13.673 36 H GLN 17 HN GLN 17 89.445 -1.865 -11.399 37 HA GLN 17 HA GLN 17 91.970 -1.524 -9.910 38 HB2 GLN 17 HB2 GLN 17 92.554 -3.596 -11.413 39 HB3 GLN 17 HB1 GLN 17 91.501 -3.812 -10.017 40 HG2 GLN 17 HG2 GLN 17 89.528 -3.691 -11.406 41 HG3 GLN 17 HG1 GLN 17 90.497 -3.277 -12.820 42 HE21 GLN 17 HE21 GLN 17 92.379 -5.065 -13.166 43 HE22 GLN 17 HE22 GLN 17 91.830 -6.669 -13.074 44 H ARG 18 HN ARG 18 93.478 -0.216 -10.781 45 HA ARG 18 HA ARG 18 93.746 -0.091 -13.718 46 HB2 ARG 18 HB2 ARG 18 93.812 2.471 -12.134 47 HB3 ARG 18 HB1 ARG 18 93.589 2.235 -13.866 48 HG2 ARG 18 HG2 ARG 18 91.365 1.252 -13.450 49 HG3 ARG 18 HG1 ARG 18 91.588 1.487 -11.714 50 HD2 ARG 18 HD2 ARG 18 91.903 3.934 -12.145 51 HD3 ARG 18 HD1 ARG 18 91.502 3.647 -13.836 52 HE ARG 18 HE ARG 18 89.451 2.601 -12.185 53 HH11 ARG 18 HH11 ARG 18 87.528 3.785 -11.974 54 HH12 ARG 18 HH12 ARG 18 87.504 5.468 -12.380 55 HH21 ARG 18 HH21 ARG 18 90.857 5.578 -13.254 56 HH22 ARG 18 HH22 ARG 18 89.390 6.484 -13.096 57 H TYR 19 HN TYR 19 95.743 1.016 -14.389 58 HA TYR 19 HA TYR 19 97.974 0.457 -12.514 59 HB2 TYR 19 HB2 TYR 19 97.942 0.951 -15.506 60 HB3 TYR 19 HB1 TYR 19 99.382 0.627 -14.552 61 HD1 TYR 19 HD1 TYR 19 96.170 -0.815 -15.736 62 HD2 TYR 19 HD2 TYR 19 99.973 -1.597 -13.897 63 HE1 TYR 19 HE1 TYR 19 95.824 -3.249 -16.058 64 HE2 TYR 19 HE2 TYR 19 99.627 -4.031 -14.214 65 HH TYR 19 HH TYR 19 96.776 -5.421 -14.774 66 H LEU 20 HN LEU 20 99.131 2.202 -11.688 67 HA LEU 20 HA LEU 20 98.298 4.883 -12.521 68 HB2 LEU 20 HB2 LEU 20 99.319 3.719 -10.109 69 HB3 LEU 20 HB1 LEU 20 100.479 4.939 -10.610 70 HG LEU 20 HG LEU 20 98.554 6.564 -10.837 71 HD11 LEU 20 HD11 LEU 20 96.600 5.278 -11.039 72 HD12 LEU 20 HD12 LEU 20 96.523 5.799 -9.360 73 HD13 LEU 20 HD13 LEU 20 97.074 4.174 -9.751 74 HD21 LEU 20 HD21 LEU 20 99.894 6.756 -8.882 75 HD22 LEU 20 HD22 LEU 20 99.244 5.268 -8.193 76 HD23 LEU 20 HD23 LEU 20 98.236 6.712 -8.282 77 H TYR 21 HN TYR 21 99.194 5.803 -14.212 78 HA TYR 21 HA TYR 21 102.089 5.349 -14.740 79 HB2 TYR 21 HB2 TYR 21 100.907 4.179 -16.423 80 HB3 TYR 21 HB1 TYR 21 99.738 5.480 -16.623 81 HD1 TYR 21 HD1 TYR 21 103.415 4.816 -16.894 82 HD2 TYR 21 HD2 TYR 21 100.050 7.032 -18.355 83 HE1 TYR 21 HE1 TYR 21 104.832 5.777 -18.686 84 HE2 TYR 21 HE2 TYR 21 101.463 8.000 -20.146 85 HH TYR 21 HH TYR 21 103.870 8.435 -20.555 86 H THR 22 HN THR 22 103.312 7.082 -14.805 87 HA THR 22 HA THR 22 102.136 9.732 -15.403 88 HB THR 22 HB THR 22 102.420 9.671 -12.999 89 HG1 THR 22 HG1 THR 22 103.250 11.503 -14.272 90 HG21 THR 22 HG21 THR 22 105.234 8.760 -13.607 91 HG22 THR 22 HG22 THR 22 103.947 7.751 -12.949 92 HG23 THR 22 HG23 THR 22 104.586 9.094 -12.003 93 H SER 23 HN SER 23 103.508 11.143 -16.513 94 HA SER 23 HA SER 23 106.171 10.106 -17.292 95 HB2 SER 23 HB2 SER 23 104.654 9.564 -19.127 96 HB3 SER 23 HB1 SER 23 104.067 11.225 -19.161 97 HG SER 23 HG SER 23 106.242 10.169 -20.323 98 H GLY 24 HN GLY 24 107.732 11.598 -17.176 99 HA2 GLY 24 HA2 GLY 24 107.437 14.328 -17.809 100 HA3 GLY 24 HA1 GLY 24 107.300 14.142 -16.064 101 HA PRO 25 HA PRO 25 111.797 14.668 -17.220 102 HB2 PRO 25 HB2 PRO 25 111.710 16.335 -14.747 103 HB3 PRO 25 HB1 PRO 25 112.393 16.719 -16.339 104 HG2 PRO 25 HG2 PRO 25 110.123 17.844 -15.495 105 HG3 PRO 25 HG1 PRO 25 110.357 17.397 -17.195 106 HD2 PRO 25 HD2 PRO 25 108.776 15.966 -15.076 107 HD3 PRO 25 HD1 PRO 25 108.383 16.224 -16.792 108 H HIS 26 HN HIS 26 113.600 13.774 -16.181 109 HA HIS 26 HA HIS 26 114.800 12.448 -14.755 110 HB2 HIS 26 HB2 HIS 26 113.836 13.918 -12.937 111 HB3 HIS 26 HB1 HIS 26 112.564 12.713 -12.736 112 HD2 HIS 26 HD2 HIS 26 114.030 12.427 -10.108 113 HE1 HIS 26 HE1 HIS 26 116.878 9.856 -11.868 114 HE2 HIS 26 HE2 HIS 26 115.927 10.685 -9.666 115 H GLY 27 HN GLY 27 113.450 11.229 -16.709 116 HA2 GLY 27 HA2 GLY 27 112.974 8.603 -15.577 117 HA3 GLY 27 HA1 GLY 27 111.570 9.317 -16.368 118 H LEU 28 HN LEU 28 114.008 7.234 -16.876 119 HA LEU 28 HA LEU 28 115.110 7.955 -19.366 120 HB2 LEU 28 HB2 LEU 28 116.020 6.157 -17.939 121 HB3 LEU 28 HB1 LEU 28 114.577 5.194 -18.244 122 HG LEU 28 HG LEU 28 115.106 5.168 -20.664 123 HD11 LEU 28 HD11 LEU 28 117.338 6.969 -19.749 124 HD12 LEU 28 HD12 LEU 28 116.301 7.109 -21.170 125 HD13 LEU 28 HD13 LEU 28 117.598 5.917 -21.140 126 HD21 LEU 28 HD21 LEU 28 117.153 3.749 -20.494 127 HD22 LEU 28 HD22 LEU 28 115.942 3.344 -19.278 128 HD23 LEU 28 HD23 LEU 28 117.359 4.295 -18.831 129 H SER 29 HN SER 29 112.258 6.014 -18.537 130 HA SER 29 HA SER 29 110.995 6.705 -21.048 131 HB2 SER 29 HB2 SER 29 110.710 4.425 -21.813 132 HB3 SER 29 HB1 SER 29 112.426 4.773 -21.653 133 HG SER 29 HG SER 29 112.356 3.730 -19.620 134 H SER 30 HN SER 30 109.016 4.770 -21.060 135 HA SER 30 HA SER 30 107.029 5.713 -19.503 136 HB2 SER 30 HB2 SER 30 106.703 3.956 -21.196 137 HB3 SER 30 HB1 SER 30 107.460 2.784 -20.120 138 HG SER 30 HG SER 30 105.663 2.662 -19.041 139 H CYS 31 HN CYS 31 106.371 5.669 -17.421 140 HA CYS 31 HA CYS 31 107.825 3.915 -15.525 141 HB2 CYS 31 HB2 CYS 31 107.608 6.859 -15.553 142 HB3 CYS 31 HB1 CYS 31 107.224 6.134 -13.997 143 H HIS 32 HN HIS 32 106.541 2.630 -14.482 144 HA HIS 32 HA HIS 32 103.721 3.401 -13.976 145 HB2 HIS 32 HB2 HIS 32 105.006 0.770 -14.692 146 HB3 HIS 32 HB1 HIS 32 103.539 0.774 -13.717 147 HD2 HIS 32 HD2 HIS 32 101.663 0.091 -15.632 148 HE1 HIS 32 HE1 HIS 32 102.689 3.016 -18.497 149 HE2 HIS 32 HE2 HIS 32 101.019 1.194 -17.911 150 H LEU 33 HN LEU 33 103.211 3.645 -11.904 151 HA LEU 33 HA LEU 33 105.115 3.476 -9.830 152 HB2 LEU 33 HB2 LEU 33 102.811 4.753 -10.037 153 HB3 LEU 33 HB1 LEU 33 102.157 3.302 -9.288 154 HG LEU 33 HG LEU 33 104.280 5.153 -8.168 155 HD11 LEU 33 HD11 LEU 33 102.606 5.326 -6.309 156 HD12 LEU 33 HD12 LEU 33 101.493 4.363 -7.280 157 HD13 LEU 33 HD13 LEU 33 102.013 5.949 -7.848 158 HD21 LEU 33 HD21 LEU 33 105.035 2.999 -7.530 159 HD22 LEU 33 HD22 LEU 33 103.388 2.403 -7.286 160 HD23 LEU 33 HD23 LEU 33 104.086 3.557 -6.154 161 H GLU 34 HN GLU 34 105.900 1.707 -8.815 162 HA GLU 34 HA GLU 34 104.220 -0.736 -8.699 163 HB2 GLU 34 HB2 GLU 34 106.208 -2.093 -8.928 164 HB3 GLU 34 HB1 GLU 34 106.135 -0.967 -10.282 165 HG2 GLU 34 HG2 GLU 34 107.710 0.537 -9.094 166 HG3 GLU 34 HG1 GLU 34 107.814 -0.619 -7.772 167 H ILE 35 HN ILE 35 104.224 -1.919 -6.832 168 HA ILE 35 HA ILE 35 105.498 -0.608 -4.481 169 HB ILE 35 HB ILE 35 102.997 -2.307 -4.629 170 HG12 ILE 35 HG12 ILE 35 103.391 0.587 -3.803 171 HG13 ILE 35 HG11 ILE 35 102.844 0.091 -5.403 172 HG21 ILE 35 HG21 ILE 35 104.071 -2.841 -2.566 173 HG22 ILE 35 HG22 ILE 35 102.876 -1.615 -2.156 174 HG23 ILE 35 HG23 ILE 35 104.575 -1.171 -2.310 175 HD11 ILE 35 HD11 ILE 35 100.856 0.557 -4.181 176 HD12 ILE 35 HD12 ILE 35 101.445 -0.294 -2.751 177 HD13 ILE 35 HD13 ILE 35 100.987 -1.203 -4.193 178 H ARG 36 HN ARG 36 106.961 -1.707 -3.363 179 HA ARG 36 HA ARG 36 107.626 -4.437 -4.183 180 HB2 ARG 36 HB2 ARG 36 108.958 -2.291 -2.568 181 HB3 ARG 36 HB1 ARG 36 109.535 -3.951 -2.451 182 HG2 ARG 36 HG2 ARG 36 110.878 -3.072 -4.159 183 HG3 ARG 36 HG1 ARG 36 109.599 -3.850 -5.079 184 HD2 ARG 36 HD2 ARG 36 108.410 -1.634 -5.170 185 HD3 ARG 36 HD1 ARG 36 109.812 -0.903 -4.393 186 HE ARG 36 HE ARG 36 109.643 -1.873 -7.142 187 HH11 ARG 36 HH11 ARG 36 111.413 -1.346 -8.449 188 HH12 ARG 36 HH12 ARG 36 112.855 -0.700 -7.735 189 HH21 ARG 36 HH21 ARG 36 111.615 -0.804 -4.498 190 HH22 ARG 36 HH22 ARG 36 112.969 -0.400 -5.499 191 H GLU 37 HN GLU 37 108.042 -6.087 -2.623 192 HA GLU 37 HA GLU 37 105.932 -6.398 -0.726 193 HB2 GLU 37 HB2 GLU 37 106.915 -8.306 -1.959 194 HB3 GLU 37 HB1 GLU 37 108.452 -8.036 -1.139 195 HG2 GLU 37 HG2 GLU 37 107.415 -8.459 1.025 196 HG3 GLU 37 HG1 GLU 37 105.839 -8.636 0.259 197 H ASP 38 HN ASP 38 109.222 -5.309 -0.684 198 HA ASP 38 HA ASP 38 109.587 -5.489 2.159 199 HB2 ASP 38 HB2 ASP 38 111.066 -4.038 -0.036 200 HB3 ASP 38 HB1 ASP 38 111.531 -3.920 1.658 201 H GLY 39 HN GLY 39 107.691 -3.578 0.228 202 HA2 GLY 39 HA2 GLY 39 106.224 -1.910 0.987 203 HA3 GLY 39 HA1 GLY 39 107.257 -1.653 2.391 204 H THR 40 HN THR 40 109.144 -1.799 -0.416 205 HA THR 40 HA THR 40 109.571 1.085 -0.300 206 HB THR 40 HB THR 40 111.289 0.540 -2.124 207 HG1 THR 40 HG1 THR 40 110.743 -2.079 -1.213 208 HG21 THR 40 HG21 THR 40 111.963 0.941 0.164 209 HG22 THR 40 HG22 THR 40 112.859 -0.450 -0.445 210 HG23 THR 40 HG23 THR 40 111.485 -0.690 0.632 211 H VAL 41 HN VAL 41 109.662 2.332 -2.372 212 HA VAL 41 HA VAL 41 107.579 1.440 -4.290 213 HB VAL 41 HB VAL 41 107.844 4.116 -2.906 214 HG11 VAL 41 HG11 VAL 41 106.271 3.311 -5.362 215 HG12 VAL 41 HG12 VAL 41 107.397 4.657 -5.194 216 HG13 VAL 41 HG13 VAL 41 105.838 4.706 -4.373 217 HG21 VAL 41 HG21 VAL 41 105.572 3.645 -2.173 218 HG22 VAL 41 HG22 VAL 41 106.592 2.265 -1.761 219 HG23 VAL 41 HG23 VAL 41 105.517 2.184 -3.157 220 H GLY 42 HN GLY 42 107.731 2.307 -6.370 221 HA2 GLY 42 HA2 GLY 42 109.745 4.099 -7.235 222 HA3 GLY 42 HA1 GLY 42 110.279 2.440 -7.501 223 H CYS 43 HN CYS 43 110.159 3.435 -9.794 224 HA CYS 43 HA CYS 43 107.421 3.189 -10.893 225 HB2 CYS 43 HB2 CYS 43 107.944 5.047 -12.079 226 HB3 CYS 43 HB1 CYS 43 109.541 5.067 -11.348 227 H ALA 44 HN ALA 44 107.207 2.106 -12.981 228 HA ALA 44 HA ALA 44 109.219 -0.011 -13.491 229 HB1 ALA 44 HB1 ALA 44 107.559 -1.238 -12.347 230 HB2 ALA 44 HB2 ALA 44 107.158 -1.483 -14.044 231 HB3 ALA 44 HB3 ALA 44 106.246 -0.323 -13.080 232 H ALA 45 HN ALA 45 109.513 -0.539 -15.624 233 HA ALA 45 HA ALA 45 108.059 1.122 -17.618 234 HB1 ALA 45 HB1 ALA 45 110.857 -0.034 -17.744 235 HB2 ALA 45 HB2 ALA 45 110.456 1.654 -17.428 236 HB3 ALA 45 HB3 ALA 45 110.084 0.938 -18.997 237 H ASP 46 HN ASP 46 108.402 -1.982 -16.420 238 HA ASP 46 HA ASP 46 108.007 -3.318 -19.009 239 HB2 ASP 46 HB2 ASP 46 108.335 -4.485 -16.239 240 HB3 ASP 46 HB1 ASP 46 108.288 -5.392 -17.750 241 H GLN 47 HN GLN 47 106.104 -1.799 -16.824 242 HA GLN 47 HA GLN 47 103.906 -1.999 -16.127 243 HB2 GLN 47 HB2 GLN 47 103.707 -3.091 -18.937 244 HB3 GLN 47 HB1 GLN 47 102.387 -2.402 -17.993 245 HG2 GLN 47 HG2 GLN 47 103.649 -0.253 -17.883 246 HG3 GLN 47 HG1 GLN 47 104.883 -0.954 -18.920 247 HE21 GLN 47 HE21 GLN 47 102.123 0.946 -19.031 248 HE22 GLN 47 HE22 GLN 47 101.676 0.659 -20.643 249 H SER 48 HN SER 48 104.005 -3.624 -14.517 250 HA SER 48 HA SER 48 103.045 -6.279 -15.413 251 HB2 SER 48 HB2 SER 48 105.568 -5.717 -14.252 252 HB3 SER 48 HB1 SER 48 104.635 -6.551 -13.015 253 HG SER 48 HG SER 48 105.425 -8.170 -14.209 254 HA PRO 49 HA PRO 49 99.885 -6.261 -12.352 255 HB2 PRO 49 HB2 PRO 49 101.251 -8.400 -10.759 256 HB3 PRO 49 HB1 PRO 49 99.591 -8.350 -11.386 257 HG2 PRO 49 HG2 PRO 49 101.447 -9.859 -12.542 258 HG3 PRO 49 HG1 PRO 49 100.237 -8.993 -13.508 259 HD2 PRO 49 HD2 PRO 49 103.138 -8.346 -13.104 260 HD3 PRO 49 HD1 PRO 49 102.116 -8.123 -14.540 261 H GLU 50 HN GLU 50 103.140 -6.404 -10.970 262 HA GLU 50 HA GLU 50 102.652 -5.631 -8.366 263 HB2 GLU 50 HB2 GLU 50 104.925 -4.757 -8.328 264 HB3 GLU 50 HB1 GLU 50 104.881 -6.258 -9.253 265 HG2 GLU 50 HG2 GLU 50 104.685 -4.892 -11.348 266 HG3 GLU 50 HG1 GLU 50 104.918 -3.442 -10.375 267 H SER 51 HN SER 51 102.415 -3.731 -11.267 268 HA SER 51 HA SER 51 102.287 -1.218 -9.799 269 HB2 SER 51 HB2 SER 51 102.203 -1.864 -12.744 270 HB3 SER 51 HB1 SER 51 102.045 -0.239 -12.091 271 HG SER 51 HG SER 51 104.099 -1.053 -10.890 272 H LEU 52 HN LEU 52 100.145 -3.628 -10.435 273 HA LEU 52 HA LEU 52 97.899 -2.001 -11.234 274 HB2 LEU 52 HB2 LEU 52 98.469 -4.702 -11.348 275 HB3 LEU 52 HB1 LEU 52 97.327 -4.644 -10.011 276 HG LEU 52 HG LEU 52 96.849 -3.435 -12.756 277 HD11 LEU 52 HD11 LEU 52 95.144 -5.317 -12.885 278 HD12 LEU 52 HD12 LEU 52 95.934 -6.018 -11.470 279 HD13 LEU 52 HD13 LEU 52 96.832 -5.825 -12.978 280 HD21 LEU 52 HD21 LEU 52 94.772 -3.965 -10.625 281 HD22 LEU 52 HD22 LEU 52 94.675 -2.897 -12.025 282 HD23 LEU 52 HD23 LEU 52 95.670 -2.451 -10.651 283 H LEU 53 HN LEU 53 96.841 -0.704 -9.899 284 HA LEU 53 HA LEU 53 96.839 -1.306 -6.989 285 HB2 LEU 53 HB2 LEU 53 96.453 1.374 -8.333 286 HB3 LEU 53 HB1 LEU 53 96.599 1.059 -6.604 287 HG LEU 53 HG LEU 53 98.748 0.514 -8.672 288 HD11 LEU 53 HD11 LEU 53 98.672 2.600 -6.476 289 HD12 LEU 53 HD12 LEU 53 98.255 2.932 -8.159 290 HD13 LEU 53 HD13 LEU 53 99.891 2.424 -7.739 291 HD21 LEU 53 HD21 LEU 53 98.499 -0.023 -5.715 292 HD22 LEU 53 HD22 LEU 53 100.085 0.355 -6.389 293 HD23 LEU 53 HD23 LEU 53 99.188 -1.041 -6.982 294 H GLN 54 HN GLN 54 94.953 -1.749 -6.079 295 HA GLN 54 HA GLN 54 92.527 -1.644 -7.665 296 HB2 GLN 54 HB2 GLN 54 93.371 -3.413 -5.818 297 HB3 GLN 54 HB1 GLN 54 92.486 -2.338 -4.746 298 HG2 GLN 54 HG2 GLN 54 90.464 -2.607 -6.077 299 HG3 GLN 54 HG1 GLN 54 91.338 -3.593 -7.248 300 HE21 GLN 54 HE21 GLN 54 90.548 -5.689 -6.951 301 HE22 GLN 54 HE22 GLN 54 90.446 -6.473 -5.449 302 H LEU 55 HN LEU 55 91.542 0.279 -7.868 303 HA LEU 55 HA LEU 55 91.798 2.296 -5.778 304 HB2 LEU 55 HB2 LEU 55 92.081 2.952 -8.105 305 HB3 LEU 55 HB1 LEU 55 90.469 2.367 -8.500 306 HG LEU 55 HG LEU 55 90.554 4.308 -6.233 307 HD11 LEU 55 HD11 LEU 55 91.116 5.262 -9.056 308 HD12 LEU 55 HD12 LEU 55 92.292 5.253 -7.742 309 HD13 LEU 55 HD13 LEU 55 90.861 6.275 -7.636 310 HD21 LEU 55 HD21 LEU 55 88.441 3.486 -7.233 311 HD22 LEU 55 HD22 LEU 55 88.919 4.165 -8.790 312 HD23 LEU 55 HD23 LEU 55 88.602 5.232 -7.421 313 H LYS 56 HN LYS 56 90.387 2.557 -4.221 314 HA LYS 56 HA LYS 56 87.596 1.586 -4.596 315 HB2 LYS 56 HB2 LYS 56 89.300 1.600 -2.089 316 HB3 LYS 56 HB1 LYS 56 87.594 1.154 -2.149 317 HG2 LYS 56 HG2 LYS 56 88.142 -0.644 -3.773 318 HG3 LYS 56 HG1 LYS 56 89.847 -0.218 -3.645 319 HD2 LYS 56 HD2 LYS 56 89.781 -0.717 -1.220 320 HD3 LYS 56 HD1 LYS 56 88.084 -1.178 -1.373 321 HE2 LYS 56 HE2 LYS 56 89.446 -3.195 -1.468 322 HE3 LYS 56 HE1 LYS 56 88.748 -2.898 -3.061 323 HZ1 LYS 56 HZ1 LYS 56 91.169 -1.503 -2.870 324 HZ2 LYS 56 HZ2 LYS 56 90.776 -2.792 -3.903 325 HZ3 LYS 56 HZ3 LYS 56 91.452 -3.099 -2.375 326 H ALA 57 HN ALA 57 85.974 2.889 -3.937 327 HA ALA 57 HA ALA 57 86.686 5.690 -3.379 328 HB1 ALA 57 HB1 ALA 57 84.123 4.364 -4.272 329 HB2 ALA 57 HB2 ALA 57 85.197 5.371 -5.242 330 HB3 ALA 57 HB3 ALA 57 84.271 6.086 -3.922 331 H LEU 58 HN LEU 58 86.997 5.956 -1.226 332 HA LEU 58 HA LEU 58 85.417 4.602 0.763 333 HB2 LEU 58 HB2 LEU 58 87.157 7.053 1.112 334 HB3 LEU 58 HB1 LEU 58 86.626 5.938 2.371 335 HG LEU 58 HG LEU 58 88.481 5.279 0.060 336 HD11 LEU 58 HD11 LEU 58 88.881 5.943 2.961 337 HD12 LEU 58 HD12 LEU 58 89.872 6.361 1.565 338 HD13 LEU 58 HD13 LEU 58 89.939 4.734 2.236 339 HD21 LEU 58 HD21 LEU 58 87.291 3.276 0.454 340 HD22 LEU 58 HD22 LEU 58 87.171 3.580 2.188 341 HD23 LEU 58 HD23 LEU 58 88.714 3.107 1.478 342 H LYS 59 HN LYS 59 85.877 8.074 0.255 343 HA LYS 59 HA LYS 59 82.983 8.520 0.722 344 HB2 LYS 59 HB2 LYS 59 85.240 10.372 1.504 345 HB3 LYS 59 HB1 LYS 59 83.538 10.560 1.893 346 HG2 LYS 59 HG2 LYS 59 83.889 9.403 3.823 347 HG3 LYS 59 HG1 LYS 59 84.241 7.972 2.861 348 HD2 LYS 59 HD2 LYS 59 86.105 8.387 4.351 349 HD3 LYS 59 HD1 LYS 59 86.626 8.718 2.701 350 HE2 LYS 59 HE2 LYS 59 87.290 10.777 3.421 351 HE3 LYS 59 HE1 LYS 59 85.592 11.182 3.676 352 HZ1 LYS 59 HZ1 LYS 59 87.403 9.882 5.637 353 HZ2 LYS 59 HZ2 LYS 59 85.750 10.187 5.888 354 HZ3 LYS 59 HZ3 LYS 59 86.837 11.479 5.698 355 HA PRO 60 HA PRO 60 82.826 10.573 -3.213 356 HB2 PRO 60 HB2 PRO 60 81.757 12.998 -1.814 357 HB3 PRO 60 HB1 PRO 60 81.099 12.122 -3.210 358 HG2 PRO 60 HG2 PRO 60 80.056 11.895 -0.731 359 HG3 PRO 60 HG1 PRO 60 80.034 10.569 -1.904 360 HD2 PRO 60 HD2 PRO 60 81.664 10.849 0.561 361 HD3 PRO 60 HD1 PRO 60 81.200 9.384 -0.328 362 H GLY 61 HN GLY 61 84.682 11.245 -4.116 363 HA2 GLY 61 HA2 GLY 61 86.253 12.887 -4.734 364 HA3 GLY 61 HA1 GLY 61 85.924 13.752 -3.238 365 H VAL 62 HN VAL 62 86.213 10.812 -2.031 366 HA VAL 62 HA VAL 62 89.181 10.896 -1.844 367 HB VAL 62 HB VAL 62 87.196 10.087 0.291 368 HG11 VAL 62 HG11 VAL 62 89.194 10.077 1.743 369 HG12 VAL 62 HG12 VAL 62 90.207 10.417 0.342 370 HG13 VAL 62 HG13 VAL 62 89.335 8.889 0.451 371 HG21 VAL 62 HG21 VAL 62 88.230 12.198 1.394 372 HG22 VAL 62 HG22 VAL 62 87.034 12.445 0.123 373 HG23 VAL 62 HG23 VAL 62 88.751 12.623 -0.237 374 H ILE 63 HN ILE 63 90.225 9.082 -2.362 375 HA ILE 63 HA ILE 63 88.737 6.520 -2.474 376 HB ILE 63 HB ILE 63 89.769 5.995 -4.589 377 HG12 ILE 63 HG12 ILE 63 91.066 8.082 -5.661 378 HG13 ILE 63 HG11 ILE 63 91.368 8.483 -3.977 379 HG21 ILE 63 HG21 ILE 63 87.703 7.458 -4.511 380 HG22 ILE 63 HG22 ILE 63 88.651 7.589 -5.992 381 HG23 ILE 63 HG23 ILE 63 88.763 8.844 -4.760 382 HD11 ILE 63 HD11 ILE 63 92.728 6.581 -5.626 383 HD12 ILE 63 HD12 ILE 63 91.968 5.689 -4.311 384 HD13 ILE 63 HD13 ILE 63 93.068 7.014 -3.955 385 H GLN 64 HN GLN 64 90.247 4.646 -2.677 386 HA GLN 64 HA GLN 64 92.829 5.071 -1.276 387 HB2 GLN 64 HB2 GLN 64 91.181 4.247 0.345 388 HB3 GLN 64 HB1 GLN 64 90.803 2.889 -0.709 389 HG2 GLN 64 HG2 GLN 64 93.078 2.043 -0.507 390 HG3 GLN 64 HG1 GLN 64 93.553 3.461 0.431 391 HE21 GLN 64 HE21 GLN 64 94.049 1.243 1.819 392 HE22 GLN 64 HE22 GLN 64 92.846 0.895 2.964 393 H ILE 65 HN ILE 65 94.474 3.613 -1.835 394 HA ILE 65 HA ILE 65 93.926 1.940 -4.222 395 HB ILE 65 HB ILE 65 96.555 2.463 -4.529 396 HG12 ILE 65 HG12 ILE 65 95.446 4.908 -3.095 397 HG13 ILE 65 HG11 ILE 65 96.709 3.844 -2.486 398 HG21 ILE 65 HG21 ILE 65 94.366 4.419 -5.310 399 HG22 ILE 65 HG22 ILE 65 94.739 2.924 -6.167 400 HG23 ILE 65 HG23 ILE 65 95.924 4.224 -6.112 401 HD11 ILE 65 HD11 ILE 65 96.828 5.934 -4.600 402 HD12 ILE 65 HD12 ILE 65 97.799 4.488 -4.877 403 HD13 ILE 65 HD13 ILE 65 98.051 5.456 -3.424 404 H LEU 66 HN LEU 66 94.337 -0.125 -4.039 405 HA LEU 66 HA LEU 66 96.201 -1.095 -1.951 406 HB2 LEU 66 HB2 LEU 66 93.974 -1.419 -1.124 407 HB3 LEU 66 HB1 LEU 66 93.425 -2.069 -2.651 408 HG LEU 66 HG LEU 66 93.885 -3.721 -0.739 409 HD11 LEU 66 HD11 LEU 66 93.889 -4.136 -3.406 410 HD12 LEU 66 HD12 LEU 66 94.209 -5.410 -2.235 411 HD13 LEU 66 HD13 LEU 66 95.544 -4.611 -3.041 412 HD21 LEU 66 HD21 LEU 66 96.127 -4.350 -0.255 413 HD22 LEU 66 HD22 LEU 66 96.095 -2.589 -0.160 414 HD23 LEU 66 HD23 LEU 66 96.766 -3.385 -1.580 415 H GLY 67 HN GLY 67 97.848 -2.059 -2.916 416 HA2 GLY 67 HA2 GLY 67 97.894 -2.867 -5.641 417 HA3 GLY 67 HA1 GLY 67 99.128 -3.224 -4.439 418 H VAL 68 HN VAL 68 97.022 -4.637 -6.521 419 HA VAL 68 HA VAL 68 95.862 -6.702 -4.982 420 HB VAL 68 HB VAL 68 95.337 -7.734 -7.070 421 HG11 VAL 68 HG11 VAL 68 94.198 -5.588 -6.522 422 HG12 VAL 68 HG12 VAL 68 94.331 -5.851 -8.262 423 HG13 VAL 68 HG13 VAL 68 95.425 -4.725 -7.453 424 HG21 VAL 68 HG21 VAL 68 97.609 -6.033 -8.112 425 HG22 VAL 68 HG22 VAL 68 96.397 -6.730 -9.186 426 HG23 VAL 68 HG23 VAL 68 97.423 -7.784 -8.216 427 H LYS 69 HN LYS 69 98.903 -6.612 -6.844 428 HA LYS 69 HA LYS 69 99.573 -9.322 -6.387 429 HB2 LYS 69 HB2 LYS 69 100.622 -7.950 -8.152 430 HB3 LYS 69 HB1 LYS 69 101.435 -6.998 -6.912 431 HG2 LYS 69 HG2 LYS 69 102.578 -9.039 -6.093 432 HG3 LYS 69 HG1 LYS 69 101.761 -9.984 -7.336 433 HD2 LYS 69 HD2 LYS 69 102.858 -8.645 -9.080 434 HD3 LYS 69 HD1 LYS 69 103.662 -7.680 -7.840 435 HE2 LYS 69 HE2 LYS 69 104.778 -9.703 -6.985 436 HE3 LYS 69 HE1 LYS 69 103.981 -10.670 -8.226 437 HZ1 LYS 69 HZ1 LYS 69 105.237 -8.443 -9.413 438 HZ2 LYS 69 HZ2 LYS 69 105.533 -10.095 -9.675 439 HZ3 LYS 69 HZ3 LYS 69 106.364 -9.264 -8.447 440 H THR 70 HN THR 70 100.556 -6.356 -4.692 441 HA THR 70 HA THR 70 102.044 -7.910 -2.722 442 HB THR 70 HB THR 70 102.369 -5.506 -1.761 443 HG1 THR 70 HG1 THR 70 100.592 -4.757 -3.151 444 HG21 THR 70 HG21 THR 70 103.430 -6.472 -4.419 445 HG22 THR 70 HG22 THR 70 104.195 -6.587 -2.833 446 HG23 THR 70 HG23 THR 70 104.041 -5.020 -3.624 447 H SER 71 HN SER 71 98.889 -6.474 -3.005 448 HA SER 71 HA SER 71 97.115 -6.417 -1.536 449 HB2 SER 71 HB2 SER 71 96.881 -8.245 -0.154 450 HB3 SER 71 HB1 SER 71 98.260 -8.818 -1.088 451 HG SER 71 HG SER 71 99.616 -8.021 0.543 452 H ARG 72 HN ARG 72 99.585 -4.674 -1.294 453 HA ARG 72 HA ARG 72 99.410 -3.871 1.539 454 HB2 ARG 72 HB2 ARG 72 101.427 -3.310 -0.641 455 HB3 ARG 72 HB1 ARG 72 101.418 -2.456 0.899 456 HG2 ARG 72 HG2 ARG 72 101.673 -4.566 2.110 457 HG3 ARG 72 HG1 ARG 72 101.586 -5.462 0.596 458 HD2 ARG 72 HD2 ARG 72 103.647 -4.417 -0.189 459 HD3 ARG 72 HD1 ARG 72 103.696 -3.378 1.225 460 HE ARG 72 HE ARG 72 104.751 -5.105 2.312 461 HH11 ARG 72 HH11 ARG 72 105.249 -7.248 2.789 462 HH12 ARG 72 HH12 ARG 72 104.605 -8.526 1.810 463 HH21 ARG 72 HH21 ARG 72 102.839 -6.395 -0.273 464 HH22 ARG 72 HH22 ARG 72 103.223 -8.041 0.092 465 H PHE 73 HN PHE 73 98.702 -1.878 2.120 466 HA PHE 73 HA PHE 73 97.231 -0.343 0.107 467 HB2 PHE 73 HB2 PHE 73 97.509 0.083 3.099 468 HB3 PHE 73 HB1 PHE 73 96.377 0.910 2.032 469 HD1 PHE 73 HD1 PHE 73 97.077 -2.147 3.899 470 HD2 PHE 73 HD2 PHE 73 94.561 -0.373 0.896 471 HE1 PHE 73 HE1 PHE 73 95.443 -3.993 4.170 472 HE2 PHE 73 HE2 PHE 73 92.932 -2.220 1.168 473 HZ PHE 73 HZ PHE 73 93.372 -4.031 2.806 474 H LEU 74 HN LEU 74 98.245 1.225 -0.977 475 HA LEU 74 HA LEU 74 100.799 2.231 -0.170 476 HB2 LEU 74 HB2 LEU 74 100.411 2.115 -2.508 477 HB3 LEU 74 HB1 LEU 74 98.871 2.956 -2.376 478 HG LEU 74 HG LEU 74 99.964 5.044 -1.865 479 HD11 LEU 74 HD11 LEU 74 101.755 4.434 -0.422 480 HD12 LEU 74 HD12 LEU 74 102.537 5.055 -1.865 481 HD13 LEU 74 HD13 LEU 74 102.431 3.315 -1.604 482 HD21 LEU 74 HD21 LEU 74 101.015 5.466 -3.935 483 HD22 LEU 74 HD22 LEU 74 99.995 4.075 -4.286 484 HD23 LEU 74 HD23 LEU 74 101.722 3.853 -4.015 485 H CYS 75 HN CYS 75 100.951 3.467 1.578 486 HA CYS 75 HA CYS 75 99.062 5.728 1.894 487 HB2 CYS 75 HB2 CYS 75 100.524 4.398 4.160 488 HB3 CYS 75 HB1 CYS 75 99.146 5.492 4.245 489 H GLN 76 HN GLN 76 99.887 7.701 2.514 490 HA GLN 76 HA GLN 76 102.792 8.039 2.101 491 HB2 GLN 76 HB2 GLN 76 101.344 9.224 0.536 492 HB3 GLN 76 HB1 GLN 76 100.500 10.001 1.874 493 HG2 GLN 76 HG2 GLN 76 102.464 11.222 2.516 494 HG3 GLN 76 HG1 GLN 76 103.480 10.285 1.424 495 HE21 GLN 76 HE21 GLN 76 100.763 10.639 -0.376 496 HE22 GLN 76 HE22 GLN 76 101.099 12.107 -1.152 497 H ARG 77 HN ARG 77 104.054 8.791 3.693 498 HA ARG 77 HA ARG 77 102.885 9.175 6.322 499 HB2 ARG 77 HB2 ARG 77 105.678 9.636 6.508 500 HB3 ARG 77 HB1 ARG 77 104.829 8.145 6.906 501 HG2 ARG 77 HG2 ARG 77 105.064 7.399 4.569 502 HG3 ARG 77 HG1 ARG 77 105.909 8.895 4.181 503 HD2 ARG 77 HD2 ARG 77 107.503 7.054 4.607 504 HD3 ARG 77 HD1 ARG 77 107.668 8.335 5.807 505 HE ARG 77 HE ARG 77 105.872 6.167 6.551 506 HH11 ARG 77 HH11 ARG 77 106.488 5.033 8.416 507 HH12 ARG 77 HH12 ARG 77 108.098 5.196 9.031 508 HH21 ARG 77 HH21 ARG 77 109.093 7.442 6.583 509 HH22 ARG 77 HH22 ARG 77 109.562 6.582 8.012 510 HA PRO 78 HA PRO 78 103.008 13.565 6.740 511 HB2 PRO 78 HB2 PRO 78 105.158 13.409 8.823 512 HB3 PRO 78 HB1 PRO 78 103.563 14.185 8.906 513 HG2 PRO 78 HG2 PRO 78 104.023 11.888 10.157 514 HG3 PRO 78 HG1 PRO 78 102.471 12.196 9.354 515 HD2 PRO 78 HD2 PRO 78 104.755 10.479 8.441 516 HD3 PRO 78 HD1 PRO 78 103.007 10.217 8.275 517 H ASP 79 HN ASP 79 106.124 11.972 6.601 518 HA ASP 79 HA ASP 79 107.703 14.193 5.810 519 HB2 ASP 79 HB2 ASP 79 108.038 11.211 5.437 520 HB3 ASP 79 HB1 ASP 79 109.260 12.390 4.970 521 H GLY 80 HN GLY 80 105.293 12.404 4.248 522 HA2 GLY 80 HA2 GLY 80 104.354 12.856 2.159 523 HA3 GLY 80 HA1 GLY 80 105.779 13.798 1.735 524 H ALA 81 HN ALA 81 106.564 10.798 3.100 525 HA ALA 81 HA ALA 81 107.519 9.823 0.517 526 HB1 ALA 81 HB1 ALA 81 109.178 9.414 2.068 527 HB2 ALA 81 HB2 ALA 81 108.303 7.891 2.219 528 HB3 ALA 81 HB3 ALA 81 108.038 9.184 3.390 529 H LEU 82 HN LEU 82 106.865 7.965 -0.490 530 HA LEU 82 HA LEU 82 104.214 6.938 0.284 531 HB2 LEU 82 HB2 LEU 82 105.754 7.215 -2.259 532 HB3 LEU 82 HB1 LEU 82 104.671 5.835 -2.154 533 HG LEU 82 HG LEU 82 102.809 7.368 -1.558 534 HD11 LEU 82 HD11 LEU 82 104.065 9.154 -0.504 535 HD12 LEU 82 HD12 LEU 82 103.188 9.820 -1.882 536 HD13 LEU 82 HD13 LEU 82 104.918 9.496 -2.008 537 HD21 LEU 82 HD21 LEU 82 103.579 6.783 -3.998 538 HD22 LEU 82 HD22 LEU 82 104.085 8.474 -4.059 539 HD23 LEU 82 HD23 LEU 82 102.395 8.066 -3.759 540 H TYR 83 HN TYR 83 103.884 4.873 0.941 541 HA TYR 83 HA TYR 83 105.844 2.800 0.379 542 HB2 TYR 83 HB2 TYR 83 106.414 2.287 2.641 543 HB3 TYR 83 HB1 TYR 83 106.697 4.015 2.434 544 HD1 TYR 83 HD1 TYR 83 104.963 1.522 4.335 545 HD2 TYR 83 HD2 TYR 83 104.773 5.629 3.094 546 HE1 TYR 83 HE1 TYR 83 103.359 1.996 6.164 547 HE2 TYR 83 HE2 TYR 83 103.167 6.106 4.929 548 HH TYR 83 HH TYR 83 102.678 4.987 7.275 549 H GLY 84 HN GLY 84 105.087 0.687 0.842 550 HA2 GLY 84 HA2 GLY 84 102.191 0.442 0.813 551 HA3 GLY 84 HA1 GLY 84 103.357 -0.870 0.648 552 H SER 85 HN SER 85 100.930 -0.437 2.449 553 HA SER 85 HA SER 85 102.285 -1.118 5.002 554 HB2 SER 85 HB2 SER 85 100.583 0.105 6.221 555 HB3 SER 85 HB1 SER 85 101.360 1.188 5.073 556 HG SER 85 HG SER 85 99.213 -0.183 4.055 557 H LEU 86 HN LEU 86 101.148 -2.537 6.374 558 HA LEU 86 HA LEU 86 99.446 -4.431 4.935 559 HB2 LEU 86 HB2 LEU 86 100.877 -4.462 7.587 560 HB3 LEU 86 HB1 LEU 86 99.664 -5.678 7.202 561 HG LEU 86 HG LEU 86 102.017 -6.369 6.662 562 HD11 LEU 86 HD11 LEU 86 101.387 -7.571 4.797 563 HD12 LEU 86 HD12 LEU 86 100.610 -6.199 4.018 564 HD13 LEU 86 HD13 LEU 86 99.797 -7.042 5.337 565 HD21 LEU 86 HD21 LEU 86 101.830 -4.338 4.425 566 HD22 LEU 86 HD22 LEU 86 103.221 -5.325 4.875 567 HD23 LEU 86 HD23 LEU 86 102.682 -4.024 5.939 568 H HIS 87 HN HIS 87 99.069 -1.742 6.961 569 HA HIS 87 HA HIS 87 96.314 -2.585 7.689 570 HB2 HIS 87 HB2 HIS 87 97.878 -0.504 9.205 571 HB3 HIS 87 HB1 HIS 87 96.476 -1.437 9.727 572 HD2 HIS 87 HD2 HIS 87 99.940 -1.470 10.759 573 HE1 HIS 87 HE1 HIS 87 99.122 -5.590 10.345 574 HE2 HIS 87 HE2 HIS 87 100.737 -3.892 11.320 575 H PHE 88 HN PHE 88 94.673 -1.087 7.463 576 HA PHE 88 HA PHE 88 95.194 1.011 5.507 577 HB2 PHE 88 HB2 PHE 88 93.303 -0.313 4.994 578 HB3 PHE 88 HB1 PHE 88 92.691 -0.234 6.642 579 HD1 PHE 88 HD1 PHE 88 93.905 2.393 4.226 580 HD2 PHE 88 HD2 PHE 88 90.677 0.961 6.677 581 HE1 PHE 88 HE1 PHE 88 92.569 4.380 3.624 582 HE2 PHE 88 HE2 PHE 88 89.336 2.954 6.066 583 HZ PHE 88 HZ PHE 88 90.282 4.664 4.543 584 H ASP 89 HN ASP 89 95.432 3.072 5.995 585 HA ASP 89 HA ASP 89 94.470 4.098 8.608 586 HB2 ASP 89 HB2 ASP 89 96.998 3.692 8.378 587 HB3 ASP 89 HB1 ASP 89 96.990 5.047 7.254 588 HA PRO 90 HA PRO 90 92.383 6.563 5.302 589 HB2 PRO 90 HB2 PRO 90 91.195 7.817 7.751 590 HB3 PRO 90 HB1 PRO 90 90.391 7.225 6.284 591 HG2 PRO 90 HG2 PRO 90 90.322 5.870 8.599 592 HG3 PRO 90 HG1 PRO 90 90.339 5.054 7.029 593 HD2 PRO 90 HD2 PRO 90 92.522 5.303 9.043 594 HD3 PRO 90 HD1 PRO 90 92.237 4.022 7.843 595 H GLU 91 HN GLU 91 93.728 7.809 8.321 596 HA GLU 91 HA GLU 91 94.013 10.506 7.542 597 HB2 GLU 91 HB2 GLU 91 95.495 8.852 9.581 598 HB3 GLU 91 HB1 GLU 91 95.671 10.599 9.418 599 HG2 GLU 91 HG2 GLU 91 93.276 10.906 9.832 600 HG3 GLU 91 HG1 GLU 91 93.052 9.159 9.928 601 H ALA 92 HN ALA 92 95.659 7.839 6.288 602 HA ALA 92 HA ALA 92 97.808 9.620 5.284 603 HB1 ALA 92 HB1 ALA 92 99.451 7.813 5.577 604 HB2 ALA 92 HB2 ALA 92 98.222 6.827 6.367 605 HB3 ALA 92 HB3 ALA 92 98.771 8.324 7.124 606 H CYS 93 HN CYS 93 95.872 6.712 4.863 607 HA CYS 93 HA CYS 93 96.930 6.345 2.164 608 HB2 CYS 93 HB2 CYS 93 95.951 4.583 4.164 609 HB3 CYS 93 HB1 CYS 93 94.856 4.448 2.792 610 H SER 94 HN SER 94 94.510 8.167 3.498 611 HA SER 94 HA SER 94 92.575 7.767 1.356 612 HB2 SER 94 HB2 SER 94 91.317 9.530 2.441 613 HB3 SER 94 HB1 SER 94 91.869 8.408 3.678 614 HG SER 94 HG SER 94 93.639 9.863 4.017 615 H PHE 95 HN PHE 95 92.506 8.939 -0.497 616 HA PHE 95 HA PHE 95 94.271 11.314 -0.709 617 HB2 PHE 95 HB2 PHE 95 93.959 9.157 -2.807 618 HB3 PHE 95 HB1 PHE 95 94.975 10.594 -2.910 619 HD1 PHE 95 HD1 PHE 95 94.643 7.228 -1.535 620 HD2 PHE 95 HD2 PHE 95 96.953 10.851 -1.416 621 HE1 PHE 95 HE1 PHE 95 96.499 6.007 -0.437 622 HE2 PHE 95 HE2 PHE 95 98.810 9.633 -0.312 623 HZ PHE 95 HZ PHE 95 98.590 7.207 0.172 624 H ARG 96 HN ARG 96 93.610 12.909 -2.067 625 HA ARG 96 HA ARG 96 90.781 12.846 -2.896 626 HB2 ARG 96 HB2 ARG 96 91.526 14.702 -1.415 627 HB3 ARG 96 HB1 ARG 96 92.690 15.190 -2.647 628 HG2 ARG 96 HG2 ARG 96 90.880 15.582 -4.246 629 HG3 ARG 96 HG1 ARG 96 89.691 15.021 -3.070 630 HD2 ARG 96 HD2 ARG 96 90.401 16.855 -1.536 631 HD3 ARG 96 HD1 ARG 96 91.486 17.446 -2.791 632 HE ARG 96 HE ARG 96 89.632 18.269 -3.954 633 HH11 ARG 96 HH11 ARG 96 87.421 18.804 -4.080 634 HH12 ARG 96 HH12 ARG 96 86.299 18.082 -2.976 635 HH21 ARG 96 HH21 ARG 96 88.704 16.176 -1.362 636 HH22 ARG 96 HH22 ARG 96 87.023 16.586 -1.443 637 H GLU 97 HN GLU 97 90.225 13.025 -5.037 638 HA GLU 97 HA GLU 97 92.416 12.730 -6.956 639 HB2 GLU 97 HB2 GLU 97 90.589 12.240 -8.580 640 HB3 GLU 97 HB1 GLU 97 90.611 11.156 -7.193 641 HG2 GLU 97 HG2 GLU 97 88.856 12.613 -6.121 642 HG3 GLU 97 HG1 GLU 97 88.758 13.511 -7.635 643 H LEU 98 HN LEU 98 93.239 14.357 -8.016 644 HA LEU 98 HA LEU 98 91.644 16.834 -8.394 645 HB2 LEU 98 HB2 LEU 98 94.642 16.559 -8.642 646 HB3 LEU 98 HB1 LEU 98 93.697 18.035 -8.480 647 HG LEU 98 HG LEU 98 94.002 15.888 -6.365 648 HD11 LEU 98 HD11 LEU 98 95.068 18.719 -6.572 649 HD12 LEU 98 HD12 LEU 98 96.023 17.238 -6.632 650 HD13 LEU 98 HD13 LEU 98 95.202 17.698 -5.143 651 HD21 LEU 98 HD21 LEU 98 92.393 18.445 -6.509 652 HD22 LEU 98 HD22 LEU 98 92.863 17.733 -4.965 653 HD23 LEU 98 HD23 LEU 98 91.836 16.828 -6.076 654 H LEU 99 HN LEU 99 90.838 16.991 -10.385 655 HA LEU 99 HA LEU 99 92.265 15.652 -12.620 656 HB2 LEU 99 HB2 LEU 99 89.761 15.158 -11.799 657 HB3 LEU 99 HB1 LEU 99 89.409 16.539 -12.825 658 HG LEU 99 HG LEU 99 89.186 14.518 -14.131 659 HD11 LEU 99 HD11 LEU 99 90.211 16.538 -15.196 660 HD12 LEU 99 HD12 LEU 99 90.672 15.021 -15.966 661 HD13 LEU 99 HD13 LEU 99 91.802 15.838 -14.889 662 HD21 LEU 99 HD21 LEU 99 90.621 12.748 -14.127 663 HD22 LEU 99 HD22 LEU 99 91.039 13.369 -12.535 664 HD23 LEU 99 HD23 LEU 99 92.060 13.746 -13.927 665 H LEU 100 HN LEU 100 93.379 17.012 -13.849 666 HA LEU 100 HA LEU 100 92.800 19.851 -13.870 667 HB2 LEU 100 HB2 LEU 100 94.871 18.243 -15.383 668 HB3 LEU 100 HB1 LEU 100 94.799 20.002 -15.297 669 HG LEU 100 HG LEU 100 95.134 18.142 -12.921 670 HD11 LEU 100 HD11 LEU 100 97.420 19.375 -12.879 671 HD12 LEU 100 HD12 LEU 100 97.073 19.780 -14.559 672 HD13 LEU 100 HD13 LEU 100 97.198 18.091 -14.066 673 HD21 LEU 100 HD21 LEU 100 94.139 20.025 -11.975 674 HD22 LEU 100 HD22 LEU 100 94.765 21.116 -13.211 675 HD23 LEU 100 HD23 LEU 100 95.827 20.525 -11.933 676 H GLU 101 HN GLU 101 92.230 21.081 -15.635 677 HA GLU 101 HA GLU 101 90.269 20.071 -17.365 678 HB2 GLU 101 HB2 GLU 101 92.014 22.529 -17.671 679 HB3 GLU 101 HB1 GLU 101 90.504 22.228 -18.538 680 HG2 GLU 101 HG2 GLU 101 90.718 22.265 -15.528 681 HG3 GLU 101 HG1 GLU 101 90.261 23.677 -16.481 682 H ASP 102 HN ASP 102 93.724 20.370 -17.643 683 HA ASP 102 HA ASP 102 93.959 19.968 -20.437 684 HB2 ASP 102 HB2 ASP 102 95.846 19.534 -18.125 685 HB3 ASP 102 HB1 ASP 102 96.315 19.252 -19.801 686 H GLY 103 HN GLY 103 92.851 17.934 -18.025 687 HA2 GLY 103 HA2 GLY 103 92.013 15.768 -18.368 688 HA3 GLY 103 HA1 GLY 103 92.993 15.627 -19.819 689 H TYR 104 HN TYR 104 94.617 16.733 -16.964 690 HA TYR 104 HA TYR 104 95.946 14.093 -16.722 691 HB2 TYR 104 HB2 TYR 104 96.852 16.900 -16.063 692 HB3 TYR 104 HB1 TYR 104 97.705 15.472 -15.473 693 HD1 TYR 104 HD1 TYR 104 97.189 17.675 -18.280 694 HD2 TYR 104 HD2 TYR 104 98.490 13.734 -17.186 695 HE1 TYR 104 HE1 TYR 104 98.309 17.438 -20.478 696 HE2 TYR 104 HE2 TYR 104 99.614 13.496 -19.382 697 HH TYR 104 HH TYR 104 100.574 15.592 -21.194 698 H ASN 105 HN ASN 105 95.964 13.012 -14.797 699 HA ASN 105 HA ASN 105 94.248 14.140 -12.654 700 HB2 ASN 105 HB2 ASN 105 94.895 11.224 -12.684 701 HB3 ASN 105 HB1 ASN 105 93.381 12.045 -12.295 702 HD21 ASN 105 HD21 ASN 105 91.871 11.250 -13.736 703 HD22 ASN 105 HD22 ASN 105 92.100 11.120 -15.415 704 H VAL 106 HN VAL 106 94.936 14.198 -10.571 705 HA VAL 106 HA VAL 106 97.591 13.108 -9.904 706 HB VAL 106 HB VAL 106 96.821 15.882 -9.009 707 HG11 VAL 106 HG11 VAL 106 99.302 16.077 -8.823 708 HG12 VAL 106 HG12 VAL 106 99.446 14.394 -9.335 709 HG13 VAL 106 HG13 VAL 106 98.645 14.789 -7.814 710 HG21 VAL 106 HG21 VAL 106 98.127 15.033 -11.598 711 HG22 VAL 106 HG22 VAL 106 98.378 16.635 -10.906 712 HG23 VAL 106 HG23 VAL 106 96.758 16.121 -11.379 713 H TYR 107 HN TYR 107 97.928 12.859 -7.607 714 HA TYR 107 HA TYR 107 95.394 12.736 -6.056 715 HB2 TYR 107 HB2 TYR 107 97.736 10.820 -6.019 716 HB3 TYR 107 HB1 TYR 107 96.352 10.751 -4.926 717 HD1 TYR 107 HD1 TYR 107 97.615 9.829 -8.168 718 HD2 TYR 107 HD2 TYR 107 94.006 10.573 -5.959 719 HE1 TYR 107 HE1 TYR 107 96.312 8.595 -9.880 720 HE2 TYR 107 HE2 TYR 107 92.707 9.337 -7.670 721 HH TYR 107 HH TYR 107 94.128 8.323 -10.684 722 H GLN 108 HN GLN 108 95.456 13.253 -3.902 723 HA GLN 108 HA GLN 108 97.963 14.135 -2.668 724 HB2 GLN 108 HB2 GLN 108 97.220 16.152 -3.805 725 HB3 GLN 108 HB1 GLN 108 95.597 15.966 -3.150 726 HG2 GLN 108 HG2 GLN 108 96.428 16.314 -0.881 727 HG3 GLN 108 HG1 GLN 108 98.089 16.366 -1.469 728 HE21 GLN 108 HE21 GLN 108 96.409 18.525 -0.110 729 HE22 GLN 108 HE22 GLN 108 96.479 19.844 -1.175 730 H SER 109 HN SER 109 97.910 13.973 -0.432 731 HA SER 109 HA SER 109 95.905 12.330 0.714 732 HB2 SER 109 HB2 SER 109 98.236 12.493 1.584 733 HB3 SER 109 HB1 SER 109 97.874 14.117 2.159 734 HG SER 109 HG SER 109 96.396 11.798 2.858 735 H GLU 110 HN GLU 110 93.919 12.879 1.311 736 HA GLU 110 HA GLU 110 93.043 15.589 1.323 737 HB2 GLU 110 HB2 GLU 110 90.886 14.716 1.704 738 HB3 GLU 110 HB1 GLU 110 91.696 13.491 0.738 739 HG2 GLU 110 HG2 GLU 110 90.743 12.186 2.428 740 HG3 GLU 110 HG1 GLU 110 92.359 12.467 3.071 741 H ALA 111 HN ALA 111 94.104 13.351 3.783 742 HA ALA 111 HA ALA 111 93.041 14.813 5.997 743 HB1 ALA 111 HB1 ALA 111 94.086 13.222 7.361 744 HB2 ALA 111 HB2 ALA 111 95.362 12.912 6.183 745 HB3 ALA 111 HB3 ALA 111 93.724 12.331 5.883 746 H HIS 112 HN HIS 112 96.422 14.417 4.870 747 HA HIS 112 HA HIS 112 97.224 16.668 6.566 748 HB2 HIS 112 HB2 HIS 112 98.759 14.637 4.950 749 HB3 HIS 112 HB1 HIS 112 99.526 15.977 5.798 750 HD2 HIS 112 HD2 HIS 112 98.258 15.909 8.714 751 HE1 HIS 112 HE1 HIS 112 98.826 11.726 8.689 752 HE2 HIS 112 HE2 HIS 112 98.386 13.743 10.167 753 H GLY 113 HN GLY 113 96.478 16.096 3.240 754 HA2 GLY 113 HA2 GLY 113 96.394 17.643 1.498 755 HA3 GLY 113 HA1 GLY 113 97.023 18.855 2.607 756 H LEU 114 HN LEU 114 98.805 15.930 2.438 757 HA LEU 114 HA LEU 114 101.109 17.297 1.402 758 HB2 LEU 114 HB2 LEU 114 100.511 14.580 2.486 759 HB3 LEU 114 HB1 LEU 114 101.987 14.784 1.547 760 HG LEU 114 HG LEU 114 101.369 16.770 3.731 761 HD11 LEU 114 HD11 LEU 114 101.083 14.517 4.754 762 HD12 LEU 114 HD12 LEU 114 102.486 15.377 5.384 763 HD13 LEU 114 HD13 LEU 114 102.700 14.088 4.199 764 HD21 LEU 114 HD21 LEU 114 103.715 17.104 3.735 765 HD22 LEU 114 HD22 LEU 114 103.325 16.879 2.030 766 HD23 LEU 114 HD23 LEU 114 104.026 15.553 2.954 767 HA PRO 115 HA PRO 115 99.982 16.289 -2.915 768 HB2 PRO 115 HB2 PRO 115 102.849 16.987 -3.421 769 HB3 PRO 115 HB1 PRO 115 101.384 17.596 -4.217 770 HG2 PRO 115 HG2 PRO 115 102.752 19.090 -2.474 771 HG3 PRO 115 HG1 PRO 115 100.984 19.163 -2.581 772 HD2 PRO 115 HD2 PRO 115 102.688 17.850 -0.496 773 HD3 PRO 115 HD1 PRO 115 101.109 18.656 -0.338 774 H LEU 116 HN LEU 116 100.370 14.521 -4.281 775 HA LEU 116 HA LEU 116 101.980 12.363 -3.109 776 HB2 LEU 116 HB2 LEU 116 99.590 12.021 -3.819 777 HB3 LEU 116 HB1 LEU 116 100.110 12.259 -5.483 778 HG LEU 116 HG LEU 116 101.811 10.291 -4.090 779 HD11 LEU 116 HD11 LEU 116 99.899 9.632 -2.832 780 HD12 LEU 116 HD12 LEU 116 100.014 8.486 -4.166 781 HD13 LEU 116 HD13 LEU 116 98.833 9.795 -4.227 782 HD21 LEU 116 HD21 LEU 116 101.630 10.686 -6.580 783 HD22 LEU 116 HD22 LEU 116 100.028 9.953 -6.515 784 HD23 LEU 116 HD23 LEU 116 101.451 9.003 -6.092 785 H HIS 117 HN HIS 117 103.868 11.733 -3.904 786 HA HIS 117 HA HIS 117 104.557 12.084 -6.704 787 HB2 HIS 117 HB2 HIS 117 106.717 13.275 -6.042 788 HB3 HIS 117 HB1 HIS 117 105.244 14.242 -5.984 789 HD2 HIS 117 HD2 HIS 117 107.909 12.786 -3.512 790 HE1 HIS 117 HE1 HIS 117 105.079 14.944 -1.241 791 HE2 HIS 117 HE2 HIS 117 107.320 13.753 -1.158 792 H LEU 118 HN LEU 118 106.385 10.811 -7.320 793 HA LEU 118 HA LEU 118 106.689 8.425 -5.891 794 HB2 LEU 118 HB2 LEU 118 108.282 9.715 -8.093 795 HB3 LEU 118 HB1 LEU 118 108.818 8.198 -7.378 796 HG LEU 118 HG LEU 118 106.067 8.647 -8.587 797 HD11 LEU 118 HD11 LEU 118 108.037 8.734 -10.198 798 HD12 LEU 118 HD12 LEU 118 106.846 7.474 -10.531 799 HD13 LEU 118 HD13 LEU 118 108.373 7.060 -9.745 800 HD21 LEU 118 HD21 LEU 118 106.428 5.954 -8.586 801 HD22 LEU 118 HD22 LEU 118 105.691 6.808 -7.236 802 HD23 LEU 118 HD23 LEU 118 107.394 6.364 -7.169 803 HA PRO 119 HA PRO 119 109.657 9.348 -2.714 804 HB2 PRO 119 HB2 PRO 119 111.403 7.109 -3.663 805 HB3 PRO 119 HB1 PRO 119 110.700 7.385 -2.057 806 HG2 PRO 119 HG2 PRO 119 109.733 5.508 -3.680 807 HG3 PRO 119 HG1 PRO 119 108.665 6.474 -2.646 808 HD2 PRO 119 HD2 PRO 119 109.145 6.712 -5.601 809 HD3 PRO 119 HD1 PRO 119 107.645 6.922 -4.671 810 H GLY 120 HN GLY 120 111.492 10.592 -2.445 811 HA2 GLY 120 HA2 GLY 120 113.388 10.864 -4.702 812 HA3 GLY 120 HA1 GLY 120 112.597 12.297 -4.048 813 H ASN 121 HN ASN 121 112.882 10.294 -1.501 814 HA ASN 121 HA ASN 121 114.185 10.313 0.382 815 HB2 ASN 121 HB2 ASN 121 116.480 10.549 -1.574 816 HB3 ASN 121 HB1 ASN 121 116.548 9.930 0.076 817 HD21 ASN 121 HD21 ASN 121 113.631 8.959 -1.404 818 HD22 ASN 121 HD22 ASN 121 114.118 7.407 -1.885 819 H LYS 122 HN LYS 122 113.176 12.834 -0.583 820 HA LYS 122 HA LYS 122 113.484 15.117 -0.383 821 HB2 LYS 122 HB2 LYS 122 114.954 14.275 2.116 822 HB3 LYS 122 HB1 LYS 122 114.058 15.772 1.849 823 HG2 LYS 122 HG2 LYS 122 112.873 12.978 1.922 824 HG3 LYS 122 HG1 LYS 122 112.709 14.203 3.179 825 HD2 LYS 122 HD2 LYS 122 111.700 15.697 1.315 826 HD3 LYS 122 HD1 LYS 122 111.541 14.200 0.397 827 HE2 LYS 122 HE2 LYS 122 110.205 13.204 2.193 828 HE3 LYS 122 HE1 LYS 122 110.373 14.676 3.150 829 HZ1 LYS 122 HZ1 LYS 122 109.435 15.150 0.476 830 HZ2 LYS 122 HZ2 LYS 122 108.819 15.710 1.956 831 HZ3 LYS 122 HZ3 LYS 122 108.385 14.172 1.380 832 H SER 123 HN SER 123 115.361 16.688 0.742 833 HA SER 123 HA SER 123 118.014 16.064 -0.207 834 HB2 SER 123 HB2 SER 123 116.126 17.375 -1.964 835 HB3 SER 123 HB1 SER 123 117.457 18.470 -1.611 836 HG SER 123 HG SER 123 118.505 16.088 -1.984 837 HA PRO 124 HA PRO 124 119.144 19.022 2.847 838 HB2 PRO 124 HB2 PRO 124 121.058 20.603 1.578 839 HB3 PRO 124 HB1 PRO 124 121.370 18.988 2.247 840 HG2 PRO 124 HG2 PRO 124 120.807 19.786 -0.576 841 HG3 PRO 124 HG1 PRO 124 121.969 18.599 0.051 842 HD2 PRO 124 HD2 PRO 124 119.622 17.826 -1.032 843 HD3 PRO 124 HD1 PRO 124 120.331 16.953 0.342 844 H HIS 125 HN HIS 125 118.565 21.045 3.614 845 HA HIS 125 HA HIS 125 116.512 22.433 2.313 846 HB2 HIS 125 HB2 HIS 125 118.322 23.597 4.434 847 HB3 HIS 125 HB1 HIS 125 116.636 24.005 4.109 848 HD2 HIS 125 HD2 HIS 125 114.757 21.889 4.853 849 HE1 HIS 125 HE1 HIS 125 117.538 19.898 7.330 850 HE2 HIS 125 HE2 HIS 125 115.085 20.061 6.690 851 H ARG 126 HN ARG 126 116.520 23.863 0.719 852 HA ARG 126 HA ARG 126 118.582 25.852 0.449 853 HB2 ARG 126 HB2 ARG 126 119.301 25.219 -1.801 854 HB3 ARG 126 HB1 ARG 126 119.686 23.947 -0.643 855 HG2 ARG 126 HG2 ARG 126 117.629 22.740 -1.304 856 HG3 ARG 126 HG1 ARG 126 117.287 23.997 -2.495 857 HD2 ARG 126 HD2 ARG 126 119.813 22.329 -2.453 858 HD3 ARG 126 HD1 ARG 126 118.425 22.006 -3.489 859 HE ARG 126 HE ARG 126 119.238 24.686 -3.855 860 HH11 ARG 126 HH11 ARG 126 120.437 25.215 -5.701 861 HH12 ARG 126 HH12 ARG 126 121.283 23.978 -6.566 862 HH21 ARG 126 HH21 ARG 126 120.266 21.432 -4.444 863 HH22 ARG 126 HH22 ARG 126 121.187 21.834 -5.854 864 H ASP 127 HN ASP 127 118.161 27.165 -1.651 865 HA ASP 127 HA ASP 127 115.731 28.372 -1.552 866 HB2 ASP 127 HB2 ASP 127 117.016 28.003 -4.246 867 HB3 ASP 127 HB1 ASP 127 116.287 29.450 -3.553 868 HA PRO 128 HA PRO 128 112.614 25.710 -3.209 869 HB2 PRO 128 HB2 PRO 128 111.837 27.660 -5.328 870 HB3 PRO 128 HB1 PRO 128 110.858 26.964 -4.023 871 HG2 PRO 128 HG2 PRO 128 111.707 29.511 -3.969 872 HG3 PRO 128 HG1 PRO 128 111.535 28.542 -2.494 873 HD2 PRO 128 HD2 PRO 128 114.029 29.319 -3.961 874 HD3 PRO 128 HD1 PRO 128 113.759 29.102 -2.219 875 H ALA 129 HN ALA 129 112.247 24.196 -4.837 876 HA ALA 129 HA ALA 129 113.058 24.274 -7.481 877 HB1 ALA 129 HB1 ALA 129 115.326 24.172 -7.375 878 HB2 ALA 129 HB2 ALA 129 115.152 22.535 -6.744 879 HB3 ALA 129 HB3 ALA 129 115.289 23.899 -5.636 880 HA PRO 130 HA PRO 130 112.422 19.677 -5.847 881 HB2 PRO 130 HB2 PRO 130 110.951 20.398 -3.336 882 HB3 PRO 130 HB1 PRO 130 112.089 19.065 -3.634 883 HG2 PRO 130 HG2 PRO 130 112.857 21.164 -2.234 884 HG3 PRO 130 HG1 PRO 130 113.951 20.450 -3.437 885 HD2 PRO 130 HD2 PRO 130 112.248 22.917 -3.674 886 HD3 PRO 130 HD1 PRO 130 113.940 22.678 -4.176 887 H ARG 131 HN ARG 131 110.267 22.409 -5.517 888 HA ARG 131 HA ARG 131 107.753 21.252 -5.650 889 HB2 ARG 131 HB2 ARG 131 108.643 23.686 -7.218 890 HB3 ARG 131 HB1 ARG 131 107.000 23.301 -6.713 891 HG2 ARG 131 HG2 ARG 131 109.279 23.730 -4.766 892 HG3 ARG 131 HG1 ARG 131 108.184 25.013 -5.270 893 HD2 ARG 131 HD2 ARG 131 106.274 23.504 -4.488 894 HD3 ARG 131 HD1 ARG 131 107.510 22.499 -3.731 895 HE ARG 131 HE ARG 131 107.883 25.200 -2.967 896 HH11 ARG 131 HH11 ARG 131 107.182 25.866 -0.922 897 HH12 ARG 131 HH12 ARG 131 106.057 24.893 -0.034 898 HH21 ARG 131 HH21 ARG 131 105.811 22.462 -2.495 899 HH22 ARG 131 HH22 ARG 131 105.279 22.968 -0.927 900 H GLY 132 HN GLY 132 106.615 20.167 -7.159 901 HA2 GLY 132 HA2 GLY 132 106.414 20.287 -9.800 902 HA3 GLY 132 HA1 GLY 132 107.961 19.456 -9.664 903 HA PRO 133 HA PRO 133 104.591 16.554 -7.671 904 HB2 PRO 133 HB2 PRO 133 102.120 17.653 -8.917 905 HB3 PRO 133 HB1 PRO 133 102.395 17.130 -7.246 906 HG2 PRO 133 HG2 PRO 133 102.167 19.723 -7.883 907 HG3 PRO 133 HG1 PRO 133 103.268 19.168 -6.608 908 HD2 PRO 133 HD2 PRO 133 103.915 20.010 -9.420 909 HD3 PRO 133 HD1 PRO 133 104.814 20.320 -7.916 910 H ALA 134 HN ALA 134 104.040 14.619 -8.703 911 HA ALA 134 HA ALA 134 104.532 14.557 -11.583 912 HB1 ALA 134 HB1 ALA 134 105.693 12.923 -10.208 913 HB2 ALA 134 HB2 ALA 134 104.547 12.098 -11.264 914 HB3 ALA 134 HB3 ALA 134 104.158 12.338 -9.562 915 H ARG 135 HN ARG 135 102.983 14.431 -13.067 916 HA ARG 135 HA ARG 135 100.204 14.222 -12.292 917 HB2 ARG 135 HB2 ARG 135 101.542 14.367 -15.007 918 HB3 ARG 135 HB1 ARG 135 99.797 14.397 -14.751 919 HG2 ARG 135 HG2 ARG 135 100.027 16.424 -13.366 920 HG3 ARG 135 HG1 ARG 135 101.773 16.396 -13.612 921 HD2 ARG 135 HD2 ARG 135 99.761 16.565 -15.868 922 HD3 ARG 135 HD1 ARG 135 100.553 17.968 -15.154 923 HE ARG 135 HE ARG 135 102.552 16.141 -15.898 924 HH11 ARG 135 HH11 ARG 135 103.697 16.484 -17.822 925 HH12 ARG 135 HH12 ARG 135 103.000 17.447 -19.082 926 HH21 ARG 135 HH21 ARG 135 100.076 18.089 -17.333 927 HH22 ARG 135 HH22 ARG 135 100.950 18.354 -18.805 928 H PHE 136 HN PHE 136 98.955 12.425 -12.344 929 HA PHE 136 HA PHE 136 100.158 9.941 -13.446 930 HB2 PHE 136 HB2 PHE 136 98.753 10.526 -10.874 931 HB3 PHE 136 HB1 PHE 136 98.400 8.969 -11.629 932 HD1 PHE 136 HD1 PHE 136 100.814 10.878 -9.714 933 HD2 PHE 136 HD2 PHE 136 100.341 7.469 -12.286 934 HE1 PHE 136 HE1 PHE 136 102.979 9.961 -8.907 935 HE2 PHE 136 HE2 PHE 136 102.501 6.559 -11.481 936 HZ PHE 136 HZ PHE 136 103.818 7.803 -9.797 937 H LEU 137 HN LEU 137 98.933 8.573 -14.586 938 HA LEU 137 HA LEU 137 96.185 9.411 -15.325 939 HB2 LEU 137 HB2 LEU 137 98.576 8.824 -17.036 940 HB3 LEU 137 HB1 LEU 137 96.992 8.342 -17.639 941 HG LEU 137 HG LEU 137 97.320 11.132 -16.547 942 HD11 LEU 137 HD11 LEU 137 98.278 10.182 -19.260 943 HD12 LEU 137 HD12 LEU 137 99.212 11.025 -18.024 944 HD13 LEU 137 HD13 LEU 137 97.926 11.871 -18.887 945 HD21 LEU 137 HD21 LEU 137 95.100 10.249 -17.235 946 HD22 LEU 137 HD22 LEU 137 95.729 9.967 -18.857 947 HD23 LEU 137 HD23 LEU 137 95.602 11.613 -18.235 948 HA PRO 138 HA PRO 138 96.079 5.052 -13.784 949 HB2 PRO 138 HB2 PRO 138 93.158 5.703 -13.799 950 HB3 PRO 138 HB1 PRO 138 94.138 4.951 -12.522 951 HG2 PRO 138 HG2 PRO 138 93.318 7.480 -12.325 952 HG3 PRO 138 HG1 PRO 138 94.919 6.982 -11.745 953 HD2 PRO 138 HD2 PRO 138 94.204 8.483 -14.247 954 HD3 PRO 138 HD1 PRO 138 95.617 8.669 -13.183 955 H LEU 139 HN LEU 139 95.889 3.272 -15.103 956 HA LEU 139 HA LEU 139 94.497 3.618 -17.692 957 HB2 LEU 139 HB2 LEU 139 96.357 1.326 -17.128 958 HB3 LEU 139 HB1 LEU 139 95.980 2.107 -18.660 959 HG LEU 139 HG LEU 139 97.583 3.351 -16.410 960 HD11 LEU 139 HD11 LEU 139 98.355 2.146 -19.077 961 HD12 LEU 139 HD12 LEU 139 98.911 1.658 -17.477 962 HD13 LEU 139 HD13 LEU 139 99.423 3.202 -18.155 963 HD21 LEU 139 HD21 LEU 139 98.053 5.081 -18.177 964 HD22 LEU 139 HD22 LEU 139 96.377 5.055 -17.635 965 HD23 LEU 139 HD23 LEU 139 96.818 4.320 -19.177 966 HA PRO 140 HA PRO 140 91.347 0.939 -15.792 967 HB2 PRO 140 HB2 PRO 140 90.696 0.284 -18.639 968 HB3 PRO 140 HB1 PRO 140 89.620 0.818 -17.331 969 HG2 PRO 140 HG2 PRO 140 90.403 2.458 -19.325 970 HG3 PRO 140 HG1 PRO 140 90.069 3.036 -17.684 971 HD2 PRO 140 HD2 PRO 140 92.693 2.722 -19.061 972 HD3 PRO 140 HD1 PRO 140 92.234 3.803 -17.726 973 H GLY 141 HN GLY 141 91.727 -1.064 -15.048 974 HA2 GLY 141 HA2 GLY 141 93.504 -2.870 -16.569 975 HA3 GLY 141 HA1 GLY 141 93.166 -2.958 -14.842 Start of MODEL 4 1 H1 GLY 13 HT1 GLY 13 80.284 -3.905 -4.581 2 H2 GLY 13 HT2 GLY 13 79.422 -3.060 -5.776 3 H3 GLY 13 HT3 GLY 13 80.542 -2.243 -4.794 4 HA2 GLY 13 HA2 GLY 13 82.217 -3.955 -5.772 5 HA3 GLY 13 HA1 GLY 13 81.014 -4.052 -7.057 6 H GLN 14 HN GLN 14 82.334 -1.404 -5.040 7 HA GLN 14 HA GLN 14 82.582 0.262 -7.468 8 HB2 GLN 14 HB2 GLN 14 82.887 1.130 -4.589 9 HB3 GLN 14 HB1 GLN 14 82.659 2.153 -6.007 10 HG2 GLN 14 HG2 GLN 14 80.520 2.031 -4.968 11 HG3 GLN 14 HG1 GLN 14 80.432 0.935 -6.346 12 HE21 GLN 14 HE21 GLN 14 78.796 -0.425 -5.300 13 HE22 GLN 14 HE22 GLN 14 79.195 -1.423 -3.987 14 H VAL 15 HN VAL 15 84.459 -1.622 -7.547 15 HA VAL 15 HA VAL 15 86.929 -0.156 -6.871 16 HB VAL 15 HB VAL 15 86.769 -1.767 -5.130 17 HG11 VAL 15 HG11 VAL 15 85.046 -3.192 -6.171 18 HG12 VAL 15 HG12 VAL 15 86.393 -4.161 -5.573 19 HG13 VAL 15 HG13 VAL 15 86.248 -3.822 -7.298 20 HG21 VAL 15 HG21 VAL 15 88.979 -1.565 -6.342 21 HG22 VAL 15 HG22 VAL 15 88.551 -3.019 -7.241 22 HG23 VAL 15 HG23 VAL 15 88.753 -3.092 -5.492 23 H ARG 16 HN ARG 16 88.512 -0.257 -8.380 24 HA ARG 16 HA ARG 16 88.249 -2.140 -10.633 25 HB2 ARG 16 HB2 ARG 16 86.989 -0.078 -11.242 26 HB3 ARG 16 HB1 ARG 16 88.474 0.849 -11.036 27 HG2 ARG 16 HG2 ARG 16 89.572 -0.383 -12.799 28 HG3 ARG 16 HG1 ARG 16 88.218 -1.508 -12.922 29 HD2 ARG 16 HD2 ARG 16 86.752 0.461 -13.509 30 HD3 ARG 16 HD1 ARG 16 88.211 1.441 -13.588 31 HE ARG 16 HE ARG 16 88.651 -0.763 -15.232 32 HH11 ARG 16 HH11 ARG 16 88.186 -0.703 -17.454 33 HH12 ARG 16 HH12 ARG 16 87.101 0.496 -18.075 34 HH21 ARG 16 HH21 ARG 16 86.500 1.939 -14.981 35 HH22 ARG 16 HH22 ARG 16 86.151 1.992 -16.677 36 H GLN 17 HN GLN 17 90.178 -2.399 -11.855 37 HA GLN 17 HA GLN 17 92.601 -1.737 -10.323 38 HB2 GLN 17 HB2 GLN 17 93.213 -3.465 -12.539 39 HB3 GLN 17 HB1 GLN 17 93.209 -3.861 -10.824 40 HG2 GLN 17 HG2 GLN 17 90.843 -4.410 -10.909 41 HG3 GLN 17 HG1 GLN 17 90.756 -3.915 -12.598 42 HE21 GLN 17 HE21 GLN 17 93.445 -5.121 -13.223 43 HE22 GLN 17 HE22 GLN 17 93.189 -6.798 -13.244 44 H ARG 18 HN ARG 18 94.020 -0.262 -10.953 45 HA ARG 18 HA ARG 18 94.279 0.443 -13.790 46 HB2 ARG 18 HB2 ARG 18 93.616 2.476 -11.640 47 HB3 ARG 18 HB1 ARG 18 94.079 2.859 -13.295 48 HG2 ARG 18 HG2 ARG 18 92.106 1.591 -14.114 49 HG3 ARG 18 HG1 ARG 18 91.622 1.298 -12.450 50 HD2 ARG 18 HD2 ARG 18 91.469 3.720 -12.058 51 HD3 ARG 18 HD1 ARG 18 91.955 4.026 -13.720 52 HE ARG 18 HE ARG 18 89.352 3.051 -12.816 53 HH11 ARG 18 HH11 ARG 18 87.737 3.109 -14.408 54 HH12 ARG 18 HH12 ARG 18 88.168 3.360 -16.067 55 HH21 ARG 18 HH21 ARG 18 91.568 3.584 -15.429 56 HH22 ARG 18 HH22 ARG 18 90.334 3.623 -16.644 57 H TYR 19 HN TYR 19 96.252 1.459 -14.308 58 HA TYR 19 HA TYR 19 98.391 1.137 -12.295 59 HB2 TYR 19 HB2 TYR 19 98.414 1.651 -15.284 60 HB3 TYR 19 HB1 TYR 19 99.868 1.694 -14.297 61 HD1 TYR 19 HD1 TYR 19 97.031 -0.482 -15.341 62 HD2 TYR 19 HD2 TYR 19 100.994 -0.309 -13.680 63 HE1 TYR 19 HE1 TYR 19 97.229 -2.944 -15.554 64 HE2 TYR 19 HE2 TYR 19 101.186 -2.770 -13.892 65 HH TYR 19 HH TYR 19 100.247 -4.592 -15.062 66 H LEU 20 HN LEU 20 99.349 2.939 -11.343 67 HA LEU 20 HA LEU 20 98.300 5.576 -12.094 68 HB2 LEU 20 HB2 LEU 20 99.078 4.437 -9.651 69 HB3 LEU 20 HB1 LEU 20 100.390 5.544 -10.013 70 HG LEU 20 HG LEU 20 98.612 7.325 -10.443 71 HD11 LEU 20 HD11 LEU 20 96.576 6.192 -10.733 72 HD12 LEU 20 HD12 LEU 20 96.446 6.754 -9.070 73 HD13 LEU 20 HD13 LEU 20 96.888 5.081 -9.401 74 HD21 LEU 20 HD21 LEU 20 99.000 6.065 -7.721 75 HD22 LEU 20 HD22 LEU 20 98.179 7.610 -7.942 76 HD23 LEU 20 HD23 LEU 20 99.869 7.434 -8.413 77 H TYR 21 HN TYR 21 99.290 6.754 -13.586 78 HA TYR 21 HA TYR 21 102.200 6.359 -14.050 79 HB2 TYR 21 HB2 TYR 21 101.003 5.227 -15.776 80 HB3 TYR 21 HB1 TYR 21 99.916 6.591 -16.008 81 HD1 TYR 21 HD1 TYR 21 103.276 5.256 -16.640 82 HD2 TYR 21 HD2 TYR 21 100.660 8.617 -17.154 83 HE1 TYR 21 HE1 TYR 21 104.795 6.185 -18.356 84 HE2 TYR 21 HE2 TYR 21 102.190 9.553 -18.863 85 HH TYR 21 HH TYR 21 105.127 8.953 -19.221 86 H THR 22 HN THR 22 103.441 8.104 -14.336 87 HA THR 22 HA THR 22 102.295 10.697 -15.010 88 HB THR 22 HB THR 22 102.185 10.720 -12.554 89 HG1 THR 22 HG1 THR 22 102.978 12.681 -12.522 90 HG21 THR 22 HG21 THR 22 103.970 9.076 -12.143 91 HG22 THR 22 HG22 THR 22 104.245 10.571 -11.248 92 HG23 THR 22 HG23 THR 22 105.165 10.240 -12.709 93 H SER 23 HN SER 23 104.050 12.327 -15.381 94 HA SER 23 HA SER 23 106.477 10.995 -16.459 95 HB2 SER 23 HB2 SER 23 105.153 13.586 -17.306 96 HB3 SER 23 HB1 SER 23 106.629 12.917 -17.996 97 HG SER 23 HG SER 23 104.041 11.742 -17.977 98 H GLY 24 HN GLY 24 108.490 11.921 -16.060 99 HA2 GLY 24 HA2 GLY 24 108.716 14.332 -14.451 100 HA3 GLY 24 HA1 GLY 24 109.173 12.850 -13.622 101 HA PRO 25 HA PRO 25 113.128 12.623 -15.562 102 HB2 PRO 25 HB2 PRO 25 112.465 10.345 -17.372 103 HB3 PRO 25 HB1 PRO 25 113.677 10.438 -16.078 104 HG2 PRO 25 HG2 PRO 25 111.426 9.023 -15.790 105 HG3 PRO 25 HG1 PRO 25 112.150 9.904 -14.431 106 HD2 PRO 25 HD2 PRO 25 109.770 10.653 -16.108 107 HD3 PRO 25 HD1 PRO 25 110.023 10.846 -14.358 108 H HIS 26 HN HIS 26 114.290 13.466 -17.308 109 HA HIS 26 HA HIS 26 112.768 14.802 -19.339 110 HB2 HIS 26 HB2 HIS 26 114.835 15.772 -18.405 111 HB3 HIS 26 HB1 HIS 26 115.763 14.431 -19.077 112 HD2 HIS 26 HD2 HIS 26 116.604 17.230 -20.388 113 HE1 HIS 26 HE1 HIS 26 113.958 16.328 -23.552 114 HE2 HIS 26 HE2 HIS 26 115.910 17.790 -22.843 115 H GLY 27 HN GLY 27 111.713 13.141 -20.483 116 HA2 GLY 27 HA2 GLY 27 111.456 11.616 -22.188 117 HA3 GLY 27 HA1 GLY 27 113.015 12.182 -22.785 118 H LEU 28 HN LEU 28 113.990 10.274 -23.292 119 HA LEU 28 HA LEU 28 115.116 8.300 -22.996 120 HB2 LEU 28 HB2 LEU 28 116.169 9.653 -21.148 121 HB3 LEU 28 HB1 LEU 28 114.995 8.948 -20.046 122 HG LEU 28 HG LEU 28 115.839 6.651 -20.925 123 HD11 LEU 28 HD11 LEU 28 118.007 8.521 -21.909 124 HD12 LEU 28 HD12 LEU 28 117.165 7.260 -22.807 125 HD13 LEU 28 HD13 LEU 28 118.323 6.825 -21.556 126 HD21 LEU 28 HD21 LEU 28 116.276 7.362 -18.663 127 HD22 LEU 28 HD22 LEU 28 117.527 8.482 -19.202 128 HD23 LEU 28 HD23 LEU 28 117.789 6.742 -19.325 129 H SER 29 HN SER 29 113.153 8.419 -20.039 130 HA SER 29 HA SER 29 111.456 6.234 -20.980 131 HB2 SER 29 HB2 SER 29 113.378 5.998 -18.666 132 HB3 SER 29 HB1 SER 29 111.954 4.979 -18.819 133 HG SER 29 HG SER 29 114.154 4.370 -19.808 134 H SER 30 HN SER 30 109.577 5.948 -19.700 135 HA SER 30 HA SER 30 108.798 8.352 -18.238 136 HB2 SER 30 HB2 SER 30 107.056 5.988 -18.870 137 HB3 SER 30 HB1 SER 30 106.570 7.647 -18.527 138 HG SER 30 HG SER 30 106.528 7.484 -20.709 139 H CYS 31 HN CYS 31 107.376 8.045 -16.286 140 HA CYS 31 HA CYS 31 108.636 6.061 -14.476 141 HB2 CYS 31 HB2 CYS 31 107.930 8.918 -14.222 142 HB3 CYS 31 HB1 CYS 31 107.493 7.947 -12.821 143 H HIS 32 HN HIS 32 107.452 4.561 -13.575 144 HA HIS 32 HA HIS 32 104.489 4.770 -13.547 145 HB2 HIS 32 HB2 HIS 32 106.303 2.379 -13.930 146 HB3 HIS 32 HB1 HIS 32 104.594 2.229 -13.527 147 HD2 HIS 32 HD2 HIS 32 102.996 2.208 -15.758 148 HE1 HIS 32 HE1 HIS 32 105.675 4.045 -18.449 149 HE2 HIS 32 HE2 HIS 32 103.363 3.018 -18.212 150 H LEU 33 HN LEU 33 103.591 4.718 -11.534 151 HA LEU 33 HA LEU 33 105.276 4.611 -9.234 152 HB2 LEU 33 HB2 LEU 33 102.883 5.714 -9.627 153 HB3 LEU 33 HB1 LEU 33 102.312 4.171 -8.999 154 HG LEU 33 HG LEU 33 104.195 6.110 -7.626 155 HD11 LEU 33 HD11 LEU 33 102.330 6.064 -5.908 156 HD12 LEU 33 HD12 LEU 33 101.361 5.195 -7.099 157 HD13 LEU 33 HD13 LEU 33 101.919 6.832 -7.441 158 HD21 LEU 33 HD21 LEU 33 103.835 4.407 -5.685 159 HD22 LEU 33 HD22 LEU 33 105.026 4.039 -6.929 160 HD23 LEU 33 HD23 LEU 33 103.436 3.270 -6.974 161 H GLU 34 HN GLU 34 105.935 2.920 -8.082 162 HA GLU 34 HA GLU 34 104.499 0.350 -8.280 163 HB2 GLU 34 HB2 GLU 34 106.776 -0.766 -8.298 164 HB3 GLU 34 HB1 GLU 34 106.299 0.024 -9.797 165 HG2 GLU 34 HG2 GLU 34 108.576 0.654 -9.384 166 HG3 GLU 34 HG1 GLU 34 107.596 2.066 -9.001 167 H ILE 35 HN ILE 35 104.552 -0.927 -6.456 168 HA ILE 35 HA ILE 35 105.664 0.385 -4.023 169 HB ILE 35 HB ILE 35 103.287 -1.480 -4.246 170 HG12 ILE 35 HG12 ILE 35 103.512 1.505 -3.718 171 HG13 ILE 35 HG11 ILE 35 102.862 0.762 -5.178 172 HG21 ILE 35 HG21 ILE 35 102.957 -0.898 -1.853 173 HG22 ILE 35 HG22 ILE 35 104.440 0.051 -1.884 174 HG23 ILE 35 HG23 ILE 35 104.506 -1.697 -2.091 175 HD11 ILE 35 HD11 ILE 35 101.197 -0.432 -3.603 176 HD12 ILE 35 HD12 ILE 35 100.948 1.290 -3.893 177 HD13 ILE 35 HD13 ILE 35 101.700 0.750 -2.392 178 H ARG 36 HN ARG 36 107.073 -0.640 -2.814 179 HA ARG 36 HA ARG 36 108.063 -3.259 -3.637 180 HB2 ARG 36 HB2 ARG 36 109.005 -1.002 -1.941 181 HB3 ARG 36 HB1 ARG 36 109.581 -2.598 -1.475 182 HG2 ARG 36 HG2 ARG 36 111.168 -1.575 -3.018 183 HG3 ARG 36 HG1 ARG 36 110.394 -2.955 -3.796 184 HD2 ARG 36 HD2 ARG 36 108.983 -1.559 -5.095 185 HD3 ARG 36 HD1 ARG 36 109.363 -0.136 -4.128 186 HE ARG 36 HE ARG 36 111.329 0.114 -5.358 187 HH11 ARG 36 HH11 ARG 36 112.792 -0.492 -6.999 188 HH12 ARG 36 HH12 ARG 36 112.635 -2.043 -7.755 189 HH21 ARG 36 HH21 ARG 36 109.893 -2.990 -5.859 190 HH22 ARG 36 HH22 ARG 36 110.993 -3.453 -7.115 191 H GLU 37 HN GLU 37 108.288 -5.024 -2.198 192 HA GLU 37 HA GLU 37 106.023 -5.523 -0.535 193 HB2 GLU 37 HB2 GLU 37 108.673 -6.970 -0.818 194 HB3 GLU 37 HB1 GLU 37 107.293 -7.583 0.093 195 HG2 GLU 37 HG2 GLU 37 105.922 -7.617 -1.911 196 HG3 GLU 37 HG1 GLU 37 107.216 -6.860 -2.841 197 H ASP 38 HN ASP 38 109.256 -4.380 -0.115 198 HA ASP 38 HA ASP 38 109.412 -4.606 2.724 199 HB2 ASP 38 HB2 ASP 38 110.893 -2.848 0.753 200 HB3 ASP 38 HB1 ASP 38 111.294 -2.978 2.464 201 H GLY 39 HN GLY 39 107.542 -2.716 0.717 202 HA2 GLY 39 HA2 GLY 39 105.907 -1.181 1.427 203 HA3 GLY 39 HA1 GLY 39 106.816 -0.913 2.912 204 H THR 40 HN THR 40 108.852 -0.880 0.207 205 HA THR 40 HA THR 40 109.251 1.979 0.478 206 HB THR 40 HB THR 40 110.648 0.590 -1.742 207 HG1 THR 40 HG1 THR 40 111.758 -0.125 0.609 208 HG21 THR 40 HG21 THR 40 111.156 2.874 -0.647 209 HG22 THR 40 HG22 THR 40 112.516 1.791 -0.940 210 HG23 THR 40 HG23 THR 40 111.836 1.934 0.681 211 H VAL 41 HN VAL 41 109.215 3.445 -1.361 212 HA VAL 41 HA VAL 41 107.302 2.676 -3.491 213 HB VAL 41 HB VAL 41 107.225 5.147 -1.749 214 HG11 VAL 41 HG11 VAL 41 105.820 4.470 -4.337 215 HG12 VAL 41 HG12 VAL 41 106.759 5.913 -3.956 216 HG13 VAL 41 HG13 VAL 41 105.182 5.664 -3.206 217 HG21 VAL 41 HG21 VAL 41 104.837 4.268 -1.427 218 HG22 VAL 41 HG22 VAL 41 106.116 3.324 -0.668 219 HG23 VAL 41 HG23 VAL 41 105.390 2.773 -2.177 220 H GLY 42 HN GLY 42 107.748 3.455 -5.494 221 HA2 GLY 42 HA2 GLY 42 109.469 5.708 -5.967 222 HA3 GLY 42 HA1 GLY 42 110.282 4.175 -6.274 223 H CYS 43 HN CYS 43 110.257 5.427 -8.466 224 HA CYS 43 HA CYS 43 107.757 4.896 -9.944 225 HB2 CYS 43 HB2 CYS 43 108.195 6.912 -10.885 226 HB3 CYS 43 HB1 CYS 43 109.688 7.026 -9.970 227 H ALA 44 HN ALA 44 107.911 3.908 -12.072 228 HA ALA 44 HA ALA 44 110.256 2.141 -12.482 229 HB1 ALA 44 HB1 ALA 44 108.888 0.437 -11.788 230 HB2 ALA 44 HB2 ALA 44 108.174 0.585 -13.395 231 HB3 ALA 44 HB3 ALA 44 107.427 1.392 -12.017 232 H ALA 45 HN ALA 45 110.772 1.700 -14.616 233 HA ALA 45 HA ALA 45 109.383 3.369 -16.655 234 HB1 ALA 45 HB1 ALA 45 112.249 2.666 -16.145 235 HB2 ALA 45 HB2 ALA 45 111.542 4.206 -16.632 236 HB3 ALA 45 HB3 ALA 45 111.743 2.913 -17.817 237 H ASP 46 HN ASP 46 109.881 0.164 -15.650 238 HA ASP 46 HA ASP 46 109.571 -0.907 -18.399 239 HB2 ASP 46 HB2 ASP 46 110.569 -2.173 -15.853 240 HB3 ASP 46 HB1 ASP 46 110.226 -3.085 -17.322 241 H GLN 47 HN GLN 47 107.500 0.105 -16.243 242 HA GLN 47 HA GLN 47 105.417 -0.539 -15.473 243 HB2 GLN 47 HB2 GLN 47 105.356 -1.999 -18.109 244 HB3 GLN 47 HB1 GLN 47 103.998 -1.290 -17.239 245 HG2 GLN 47 HG2 GLN 47 105.078 0.952 -17.518 246 HG3 GLN 47 HG1 GLN 47 106.303 0.194 -18.522 247 HE21 GLN 47 HE21 GLN 47 103.722 2.075 -18.944 248 HE22 GLN 47 HE22 GLN 47 103.058 1.413 -20.358 249 H SER 48 HN SER 48 105.671 -1.927 -13.744 250 HA SER 48 HA SER 48 105.811 -4.831 -14.350 251 HB2 SER 48 HB2 SER 48 106.754 -4.999 -12.006 252 HB3 SER 48 HB1 SER 48 107.784 -4.186 -13.176 253 HG SER 48 HG SER 48 107.005 -2.206 -12.376 254 HA PRO 49 HA PRO 49 101.829 -5.525 -12.517 255 HB2 PRO 49 HB2 PRO 49 103.105 -7.443 -10.594 256 HB3 PRO 49 HB1 PRO 49 101.707 -7.681 -11.665 257 HG2 PRO 49 HG2 PRO 49 104.079 -8.729 -12.250 258 HG3 PRO 49 HG1 PRO 49 103.026 -8.073 -13.517 259 HD2 PRO 49 HD2 PRO 49 105.517 -6.900 -12.344 260 HD3 PRO 49 HD1 PRO 49 104.879 -6.784 -13.997 261 H GLU 50 HN GLU 50 104.505 -5.199 -10.201 262 HA GLU 50 HA GLU 50 103.041 -4.591 -7.913 263 HB2 GLU 50 HB2 GLU 50 105.089 -3.237 -7.241 264 HB3 GLU 50 HB1 GLU 50 105.378 -4.926 -7.660 265 HG2 GLU 50 HG2 GLU 50 106.033 -4.255 -9.934 266 HG3 GLU 50 HG1 GLU 50 105.745 -2.566 -9.528 267 H SER 51 HN SER 51 103.319 -2.799 -10.807 268 HA SER 51 HA SER 51 102.694 -0.231 -9.583 269 HB2 SER 51 HB2 SER 51 102.897 -1.060 -12.489 270 HB3 SER 51 HB1 SER 51 102.710 0.589 -11.906 271 HG SER 51 HG SER 51 104.679 0.070 -10.625 272 H LEU 52 HN LEU 52 101.037 -2.965 -10.430 273 HA LEU 52 HA LEU 52 98.598 -1.753 -11.406 274 HB2 LEU 52 HB2 LEU 52 99.621 -4.164 -11.822 275 HB3 LEU 52 HB1 LEU 52 98.789 -4.559 -10.324 276 HG LEU 52 HG LEU 52 97.532 -3.427 -12.838 277 HD11 LEU 52 HD11 LEU 52 98.154 -5.845 -12.858 278 HD12 LEU 52 HD12 LEU 52 96.414 -5.580 -12.967 279 HD13 LEU 52 HD13 LEU 52 97.138 -6.079 -11.438 280 HD21 LEU 52 HD21 LEU 52 95.384 -3.813 -11.586 281 HD22 LEU 52 HD22 LEU 52 96.360 -2.487 -10.956 282 HD23 LEU 52 HD23 LEU 52 96.345 -4.044 -10.124 283 H LEU 53 HN LEU 53 97.371 -0.647 -10.010 284 HA LEU 53 HA LEU 53 97.217 -1.566 -7.189 285 HB2 LEU 53 HB2 LEU 53 96.926 1.242 -8.240 286 HB3 LEU 53 HB1 LEU 53 96.923 0.739 -6.553 287 HG LEU 53 HG LEU 53 99.313 -0.027 -8.207 288 HD11 LEU 53 HD11 LEU 53 98.722 2.769 -7.219 289 HD12 LEU 53 HD12 LEU 53 99.100 2.264 -8.865 290 HD13 LEU 53 HD13 LEU 53 100.343 2.202 -7.619 291 HD21 LEU 53 HD21 LEU 53 98.880 -0.583 -5.719 292 HD22 LEU 53 HD22 LEU 53 99.200 1.119 -5.413 293 HD23 LEU 53 HD23 LEU 53 100.451 0.104 -6.129 294 H GLN 54 HN GLN 54 95.290 -2.053 -6.400 295 HA GLN 54 HA GLN 54 92.954 -1.847 -8.072 296 HB2 GLN 54 HB2 GLN 54 93.369 -2.818 -5.248 297 HB3 GLN 54 HB1 GLN 54 91.777 -2.738 -6.002 298 HG2 GLN 54 HG2 GLN 54 92.597 -4.171 -7.849 299 HG3 GLN 54 HG1 GLN 54 94.158 -4.287 -7.042 300 HE21 GLN 54 HE21 GLN 54 94.355 -5.800 -5.310 301 HE22 GLN 54 HE22 GLN 54 93.066 -6.761 -4.766 302 H LEU 55 HN LEU 55 91.754 -0.090 -8.256 303 HA LEU 55 HA LEU 55 91.971 2.055 -6.278 304 HB2 LEU 55 HB2 LEU 55 92.034 2.643 -8.661 305 HB3 LEU 55 HB1 LEU 55 90.458 1.895 -8.903 306 HG LEU 55 HG LEU 55 90.502 3.895 -6.702 307 HD11 LEU 55 HD11 LEU 55 92.018 5.091 -8.149 308 HD12 LEU 55 HD12 LEU 55 90.426 5.833 -8.296 309 HD13 LEU 55 HD13 LEU 55 91.016 4.755 -9.561 310 HD21 LEU 55 HD21 LEU 55 88.750 3.652 -9.169 311 HD22 LEU 55 HD22 LEU 55 88.401 4.587 -7.716 312 HD23 LEU 55 HD23 LEU 55 88.440 2.829 -7.642 313 H LYS 56 HN LYS 56 90.679 2.002 -4.571 314 HA LYS 56 HA LYS 56 87.980 0.779 -4.822 315 HB2 LYS 56 HB2 LYS 56 89.825 1.058 -2.442 316 HB3 LYS 56 HB1 LYS 56 88.159 0.496 -2.334 317 HG2 LYS 56 HG2 LYS 56 88.679 -1.369 -3.844 318 HG3 LYS 56 HG1 LYS 56 90.340 -0.794 -3.999 319 HD2 LYS 56 HD2 LYS 56 90.666 -1.080 -1.567 320 HD3 LYS 56 HD1 LYS 56 89.010 -1.668 -1.417 321 HE2 LYS 56 HE2 LYS 56 89.538 -3.541 -2.934 322 HE3 LYS 56 HE1 LYS 56 91.197 -2.957 -3.074 323 HZ1 LYS 56 HZ1 LYS 56 91.265 -3.126 -0.567 324 HZ2 LYS 56 HZ2 LYS 56 91.249 -4.595 -1.422 325 HZ3 LYS 56 HZ3 LYS 56 89.831 -4.027 -0.679 326 H ALA 57 HN ALA 57 86.269 2.031 -4.489 327 HA ALA 57 HA ALA 57 86.722 4.847 -3.753 328 HB1 ALA 57 HB1 ALA 57 84.698 5.316 -4.838 329 HB2 ALA 57 HB2 ALA 57 84.109 3.662 -4.663 330 HB3 ALA 57 HB3 ALA 57 85.395 4.023 -5.814 331 H LEU 58 HN LEU 58 86.788 5.049 -1.566 332 HA LEU 58 HA LEU 58 85.163 3.480 0.202 333 HB2 LEU 58 HB2 LEU 58 86.552 6.095 0.813 334 HB3 LEU 58 HB1 LEU 58 86.043 4.864 1.966 335 HG LEU 58 HG LEU 58 88.150 4.510 -0.187 336 HD11 LEU 58 HD11 LEU 58 89.605 4.224 1.907 337 HD12 LEU 58 HD12 LEU 58 88.263 4.925 2.806 338 HD13 LEU 58 HD13 LEU 58 89.065 5.864 1.547 339 HD21 LEU 58 HD21 LEU 58 87.209 2.365 0.109 340 HD22 LEU 58 HD22 LEU 58 86.906 2.631 1.827 341 HD23 LEU 58 HD23 LEU 58 88.553 2.367 1.248 342 H LYS 59 HN LYS 59 85.118 6.899 -0.742 343 HA LYS 59 HA LYS 59 82.204 6.977 -0.415 344 HB2 LYS 59 HB2 LYS 59 84.015 9.067 0.805 345 HB3 LYS 59 HB1 LYS 59 82.271 8.950 0.956 346 HG2 LYS 59 HG2 LYS 59 82.530 6.794 2.158 347 HG3 LYS 59 HG1 LYS 59 84.281 6.968 2.059 348 HD2 LYS 59 HD2 LYS 59 82.641 9.203 3.249 349 HD3 LYS 59 HD1 LYS 59 83.010 7.785 4.225 350 HE2 LYS 59 HE2 LYS 59 85.425 8.120 3.791 351 HE3 LYS 59 HE1 LYS 59 85.046 9.549 2.831 352 HZ1 LYS 59 HZ1 LYS 59 85.515 10.408 4.908 353 HZ2 LYS 59 HZ2 LYS 59 84.738 9.143 5.734 354 HZ3 LYS 59 HZ3 LYS 59 83.822 10.322 4.923 355 HA PRO 60 HA PRO 60 82.267 9.309 -4.200 356 HB2 PRO 60 HB2 PRO 60 80.852 11.469 -2.652 357 HB3 PRO 60 HB1 PRO 60 80.466 10.796 -4.250 358 HG2 PRO 60 HG2 PRO 60 79.092 10.082 -2.076 359 HG3 PRO 60 HG1 PRO 60 79.456 8.921 -3.366 360 HD2 PRO 60 HD2 PRO 60 80.616 9.099 -0.631 361 HD3 PRO 60 HD1 PRO 60 80.482 7.694 -1.712 362 H GLY 61 HN GLY 61 84.316 10.011 -4.652 363 HA2 GLY 61 HA2 GLY 61 85.768 11.859 -5.029 364 HA3 GLY 61 HA1 GLY 61 85.167 12.615 -3.559 365 H VAL 62 HN VAL 62 85.488 9.815 -2.258 366 HA VAL 62 HA VAL 62 88.369 10.116 -1.636 367 HB VAL 62 HB VAL 62 86.188 8.796 -0.007 368 HG11 VAL 62 HG11 VAL 62 87.956 8.989 1.794 369 HG12 VAL 62 HG12 VAL 62 89.099 9.440 0.528 370 HG13 VAL 62 HG13 VAL 62 88.342 7.847 0.507 371 HG21 VAL 62 HG21 VAL 62 87.489 11.529 0.197 372 HG22 VAL 62 HG22 VAL 62 86.487 10.814 1.464 373 HG23 VAL 62 HG23 VAL 62 85.785 11.187 -0.111 374 H ILE 63 HN ILE 63 89.723 8.516 -2.165 375 HA ILE 63 HA ILE 63 88.614 5.827 -2.713 376 HB ILE 63 HB ILE 63 89.945 5.631 -4.705 377 HG12 ILE 63 HG12 ILE 63 90.966 8.122 -5.361 378 HG13 ILE 63 HG11 ILE 63 91.243 8.095 -3.622 379 HG21 ILE 63 HG21 ILE 63 87.689 6.808 -4.726 380 HG22 ILE 63 HG22 ILE 63 88.735 7.143 -6.106 381 HG23 ILE 63 HG23 ILE 63 88.580 8.329 -4.811 382 HD11 ILE 63 HD11 ILE 63 92.209 5.685 -4.108 383 HD12 ILE 63 HD12 ILE 63 93.196 7.111 -4.427 384 HD13 ILE 63 HD13 ILE 63 92.365 6.301 -5.754 385 H GLN 64 HN GLN 64 90.303 4.169 -2.869 386 HA GLN 64 HA GLN 64 92.689 4.681 -1.193 387 HB2 GLN 64 HB2 GLN 64 91.219 3.644 0.345 388 HB3 GLN 64 HB1 GLN 64 90.562 2.559 -0.863 389 HG2 GLN 64 HG2 GLN 64 91.991 1.268 0.584 390 HG3 GLN 64 HG1 GLN 64 92.832 1.415 -0.944 391 HE21 GLN 64 HE21 GLN 64 93.680 1.217 2.075 392 HE22 GLN 64 HE22 GLN 64 94.877 2.413 2.199 393 H ILE 65 HN ILE 65 94.485 3.399 -1.769 394 HA ILE 65 HA ILE 65 94.201 1.897 -4.313 395 HB ILE 65 HB ILE 65 96.924 2.792 -4.017 396 HG12 ILE 65 HG12 ILE 65 96.597 5.249 -4.001 397 HG13 ILE 65 HG11 ILE 65 94.885 5.019 -3.666 398 HG21 ILE 65 HG21 ILE 65 95.466 2.431 -6.125 399 HG22 ILE 65 HG22 ILE 65 96.574 3.795 -6.136 400 HG23 ILE 65 HG23 ILE 65 94.858 4.056 -5.830 401 HD11 ILE 65 HD11 ILE 65 95.359 4.987 -1.474 402 HD12 ILE 65 HD12 ILE 65 97.083 5.092 -1.814 403 HD13 ILE 65 HD13 ILE 65 96.302 3.517 -1.702 404 H LEU 66 HN LEU 66 94.727 -0.175 -4.234 405 HA LEU 66 HA LEU 66 96.542 -1.142 -2.102 406 HB2 LEU 66 HB2 LEU 66 94.245 -1.596 -1.469 407 HB3 LEU 66 HB1 LEU 66 93.899 -2.296 -3.034 408 HG LEU 66 HG LEU 66 94.310 -3.883 -1.042 409 HD11 LEU 66 HD11 LEU 66 94.448 -4.398 -3.626 410 HD12 LEU 66 HD12 LEU 66 94.979 -5.586 -2.444 411 HD13 LEU 66 HD13 LEU 66 96.161 -4.597 -3.281 412 HD21 LEU 66 HD21 LEU 66 96.386 -2.606 -0.319 413 HD22 LEU 66 HD22 LEU 66 97.218 -3.365 -1.674 414 HD23 LEU 66 HD23 LEU 66 96.546 -4.358 -0.386 415 H GLY 67 HN GLY 67 98.256 -2.143 -2.934 416 HA2 GLY 67 HA2 GLY 67 98.417 -2.840 -5.732 417 HA3 GLY 67 HA1 GLY 67 99.686 -3.032 -4.537 418 H VAL 68 HN VAL 68 98.061 -4.733 -6.658 419 HA VAL 68 HA VAL 68 96.970 -6.906 -5.186 420 HB VAL 68 HB VAL 68 96.882 -8.045 -7.328 421 HG11 VAL 68 HG11 VAL 68 95.199 -6.346 -6.989 422 HG12 VAL 68 HG12 VAL 68 95.746 -6.233 -8.661 423 HG13 VAL 68 HG13 VAL 68 96.319 -5.068 -7.466 424 HG21 VAL 68 HG21 VAL 68 97.888 -6.758 -9.323 425 HG22 VAL 68 HG22 VAL 68 99.018 -7.628 -8.285 426 HG23 VAL 68 HG23 VAL 68 98.836 -5.881 -8.122 427 H LYS 69 HN LYS 69 100.116 -6.412 -6.760 428 HA LYS 69 HA LYS 69 101.101 -9.005 -6.210 429 HB2 LYS 69 HB2 LYS 69 102.025 -7.386 -7.910 430 HB3 LYS 69 HB1 LYS 69 102.738 -6.484 -6.577 431 HG2 LYS 69 HG2 LYS 69 103.313 -9.429 -6.668 432 HG3 LYS 69 HG1 LYS 69 104.082 -8.431 -7.894 433 HD2 LYS 69 HD2 LYS 69 104.986 -6.961 -6.091 434 HD3 LYS 69 HD1 LYS 69 104.296 -8.052 -4.891 435 HE2 LYS 69 HE2 LYS 69 106.264 -8.901 -7.031 436 HE3 LYS 69 HE1 LYS 69 106.704 -8.532 -5.363 437 HZ1 LYS 69 HZ1 LYS 69 105.151 -10.268 -4.641 438 HZ2 LYS 69 HZ2 LYS 69 106.389 -10.887 -5.627 439 HZ3 LYS 69 HZ3 LYS 69 104.831 -10.654 -6.262 440 H THR 70 HN THR 70 101.436 -5.920 -4.494 441 HA THR 70 HA THR 70 102.979 -7.168 -2.354 442 HB THR 70 HB THR 70 102.774 -4.742 -1.436 443 HG1 THR 70 HG1 THR 70 101.039 -4.137 -2.733 444 HG21 THR 70 HG21 THR 70 104.123 -5.270 -4.098 445 HG22 THR 70 HG22 THR 70 104.801 -5.646 -2.514 446 HG23 THR 70 HG23 THR 70 104.529 -3.967 -2.982 447 H SER 71 HN SER 71 99.670 -6.134 -2.930 448 HA SER 71 HA SER 71 97.772 -6.326 -1.635 449 HB2 SER 71 HB2 SER 71 97.574 -8.314 -0.527 450 HB3 SER 71 HB1 SER 71 99.172 -8.644 -1.186 451 HG SER 71 HG SER 71 98.607 -8.665 1.277 452 H ARG 72 HN ARG 72 100.043 -4.414 -1.057 453 HA ARG 72 HA ARG 72 99.511 -3.791 1.786 454 HB2 ARG 72 HB2 ARG 72 101.724 -2.976 -0.111 455 HB3 ARG 72 HB1 ARG 72 101.505 -2.274 1.488 456 HG2 ARG 72 HG2 ARG 72 101.784 -4.457 2.537 457 HG3 ARG 72 HG1 ARG 72 101.872 -5.233 0.958 458 HD2 ARG 72 HD2 ARG 72 103.901 -3.919 0.431 459 HD3 ARG 72 HD1 ARG 72 103.817 -3.170 2.019 460 HE ARG 72 HE ARG 72 104.804 -5.073 2.875 461 HH11 ARG 72 HH11 ARG 72 105.674 -7.169 2.738 462 HH12 ARG 72 HH12 ARG 72 105.294 -8.163 1.370 463 HH21 ARG 72 HH21 ARG 72 103.303 -5.779 -0.150 464 HH22 ARG 72 HH22 ARG 72 103.951 -7.379 -0.257 465 H PHE 73 HN PHE 73 98.516 -1.912 2.334 466 HA PHE 73 HA PHE 73 97.248 -0.371 0.223 467 HB2 PHE 73 HB2 PHE 73 97.153 -0.037 3.234 468 HB3 PHE 73 HB1 PHE 73 96.118 0.784 2.069 469 HD1 PHE 73 HD1 PHE 73 96.668 -2.273 3.956 470 HD2 PHE 73 HD2 PHE 73 94.582 -0.572 0.605 471 HE1 PHE 73 HE1 PHE 73 95.097 -4.190 3.957 472 HE2 PHE 73 HE2 PHE 73 93.012 -2.491 0.608 473 HZ PHE 73 HZ PHE 73 93.269 -4.299 2.285 474 H LEU 74 HN LEU 74 97.874 1.589 -0.509 475 HA LEU 74 HA LEU 74 100.378 2.712 0.481 476 HB2 LEU 74 HB2 LEU 74 100.232 2.635 -1.876 477 HB3 LEU 74 HB1 LEU 74 98.596 3.275 -1.886 478 HG LEU 74 HG LEU 74 99.392 5.473 -1.197 479 HD11 LEU 74 HD11 LEU 74 102.058 4.059 -0.952 480 HD12 LEU 74 HD12 LEU 74 101.181 4.934 0.305 481 HD13 LEU 74 HD13 LEU 74 101.908 5.814 -1.036 482 HD21 LEU 74 HD21 LEU 74 101.183 4.345 -3.368 483 HD22 LEU 74 HD22 LEU 74 100.742 6.040 -3.153 484 HD23 LEU 74 HD23 LEU 74 99.513 4.858 -3.608 485 H CYS 75 HN CYS 75 100.339 4.013 2.163 486 HA CYS 75 HA CYS 75 98.231 6.081 2.357 487 HB2 CYS 75 HB2 CYS 75 99.430 4.634 4.724 488 HB3 CYS 75 HB1 CYS 75 98.060 5.744 4.720 489 H GLN 76 HN GLN 76 98.906 8.086 3.104 490 HA GLN 76 HA GLN 76 101.831 8.486 3.135 491 HB2 GLN 76 HB2 GLN 76 100.609 9.728 1.423 492 HB3 GLN 76 HB1 GLN 76 99.572 10.442 2.657 493 HG2 GLN 76 HG2 GLN 76 101.434 11.610 3.649 494 HG3 GLN 76 HG1 GLN 76 102.584 10.749 2.630 495 HE21 GLN 76 HE21 GLN 76 103.266 11.960 0.872 496 HE22 GLN 76 HE22 GLN 76 102.348 13.154 0.092 497 H ARG 77 HN ARG 77 102.845 9.159 4.894 498 HA ARG 77 HA ARG 77 101.349 9.432 7.358 499 HB2 ARG 77 HB2 ARG 77 104.124 9.977 7.840 500 HB3 ARG 77 HB1 ARG 77 103.234 8.502 8.216 501 HG2 ARG 77 HG2 ARG 77 103.698 7.638 5.973 502 HG3 ARG 77 HG1 ARG 77 104.512 9.143 5.560 503 HD2 ARG 77 HD2 ARG 77 106.079 7.297 6.203 504 HD3 ARG 77 HD1 ARG 77 106.241 8.747 7.188 505 HE ARG 77 HE ARG 77 105.114 6.168 8.036 506 HH11 ARG 77 HH11 ARG 77 104.991 5.907 10.276 507 HH12 ARG 77 HH12 ARG 77 105.237 7.266 11.322 508 HH21 ARG 77 HH21 ARG 77 105.787 9.501 8.730 509 HH22 ARG 77 HH22 ARG 77 105.704 9.295 10.446 510 HA PRO 78 HA PRO 78 101.297 13.793 8.065 511 HB2 PRO 78 HB2 PRO 78 103.293 13.520 10.286 512 HB3 PRO 78 HB1 PRO 78 101.694 14.292 10.297 513 HG2 PRO 78 HG2 PRO 78 102.075 11.917 11.431 514 HG3 PRO 78 HG1 PRO 78 100.580 12.286 10.551 515 HD2 PRO 78 HD2 PRO 78 102.891 10.581 9.701 516 HD3 PRO 78 HD1 PRO 78 101.159 10.398 9.354 517 H ASP 79 HN ASP 79 104.442 12.254 8.012 518 HA ASP 79 HA ASP 79 105.994 14.593 7.509 519 HB2 ASP 79 HB2 ASP 79 106.528 11.652 7.053 520 HB3 ASP 79 HB1 ASP 79 107.722 12.916 6.780 521 H GLY 80 HN GLY 80 103.782 12.887 5.627 522 HA2 GLY 80 HA2 GLY 80 103.118 13.345 3.437 523 HA3 GLY 80 HA1 GLY 80 104.543 14.363 3.246 524 H ALA 81 HN ALA 81 105.257 11.331 4.586 525 HA ALA 81 HA ALA 81 106.595 10.514 2.117 526 HB1 ALA 81 HB1 ALA 81 107.833 9.012 3.463 527 HB2 ALA 81 HB2 ALA 81 106.637 9.047 4.754 528 HB3 ALA 81 HB3 ALA 81 107.645 10.458 4.453 529 H LEU 82 HN LEU 82 106.172 8.667 0.986 530 HA LEU 82 HA LEU 82 103.503 7.486 1.370 531 HB2 LEU 82 HB2 LEU 82 105.480 7.625 -0.900 532 HB3 LEU 82 HB1 LEU 82 104.187 6.434 -0.929 533 HG LEU 82 HG LEU 82 102.493 8.113 -0.898 534 HD11 LEU 82 HD11 LEU 82 103.183 10.571 -0.833 535 HD12 LEU 82 HD12 LEU 82 104.753 10.015 -0.249 536 HD13 LEU 82 HD13 LEU 82 103.294 9.694 0.690 537 HD21 LEU 82 HD21 LEU 82 103.312 7.869 -3.114 538 HD22 LEU 82 HD22 LEU 82 104.793 8.758 -2.759 539 HD23 LEU 82 HD23 LEU 82 103.259 9.609 -2.858 540 H TYR 83 HN TYR 83 103.203 5.382 2.000 541 HA TYR 83 HA TYR 83 105.377 3.458 1.718 542 HB2 TYR 83 HB2 TYR 83 105.629 2.945 4.037 543 HB3 TYR 83 HB1 TYR 83 105.801 4.693 3.889 544 HD1 TYR 83 HD1 TYR 83 104.045 2.051 5.529 545 HD2 TYR 83 HD2 TYR 83 103.630 6.114 4.197 546 HE1 TYR 83 HE1 TYR 83 102.141 2.365 7.085 547 HE2 TYR 83 HE2 TYR 83 101.722 6.426 5.753 548 HH TYR 83 HH TYR 83 100.929 5.367 7.922 549 H GLY 84 HN GLY 84 104.720 1.335 1.776 550 HA2 GLY 84 HA2 GLY 84 101.895 0.852 1.416 551 HA3 GLY 84 HA1 GLY 84 103.182 -0.352 1.345 552 H SER 85 HN SER 85 100.486 0.062 2.898 553 HA SER 85 HA SER 85 101.537 -0.809 5.537 554 HB2 SER 85 HB2 SER 85 99.851 0.376 6.649 555 HB3 SER 85 HB1 SER 85 100.359 1.502 5.393 556 HG SER 85 HG SER 85 98.305 -0.361 4.905 557 H LEU 86 HN LEU 86 100.653 -2.613 6.411 558 HA LEU 86 HA LEU 86 99.097 -4.303 4.674 559 HB2 LEU 86 HB2 LEU 86 100.953 -4.792 6.627 560 HB3 LEU 86 HB1 LEU 86 99.473 -5.122 7.512 561 HG LEU 86 HG LEU 86 100.245 -7.187 6.510 562 HD11 LEU 86 HD11 LEU 86 97.741 -6.479 6.426 563 HD12 LEU 86 HD12 LEU 86 98.255 -7.883 5.492 564 HD13 LEU 86 HD13 LEU 86 98.002 -6.338 4.686 565 HD21 LEU 86 HD21 LEU 86 101.005 -7.441 4.345 566 HD22 LEU 86 HD22 LEU 86 101.415 -5.743 4.560 567 HD23 LEU 86 HD23 LEU 86 99.947 -6.194 3.694 568 H HIS 87 HN HIS 87 98.511 -2.220 7.392 569 HA HIS 87 HA HIS 87 95.720 -3.159 7.631 570 HB2 HIS 87 HB2 HIS 87 97.052 -3.003 9.707 571 HB3 HIS 87 HB1 HIS 87 97.295 -1.282 9.410 572 HD2 HIS 87 HD2 HIS 87 93.954 -3.480 9.476 573 HE1 HIS 87 HE1 HIS 87 93.341 0.074 11.669 574 HE2 HIS 87 HE2 HIS 87 92.258 -2.085 10.889 575 H PHE 88 HN PHE 88 94.009 -1.571 7.752 576 HA PHE 88 HA PHE 88 94.427 0.581 5.803 577 HB2 PHE 88 HB2 PHE 88 92.552 -0.902 5.396 578 HB3 PHE 88 HB1 PHE 88 91.899 -0.572 7.002 579 HD1 PHE 88 HD1 PHE 88 93.048 1.235 3.927 580 HD2 PHE 88 HD2 PHE 88 90.305 1.146 7.233 581 HE1 PHE 88 HE1 PHE 88 91.915 3.250 3.042 582 HE2 PHE 88 HE2 PHE 88 89.170 3.165 6.344 583 HZ PHE 88 HZ PHE 88 89.975 4.217 4.246 584 H ASP 89 HN ASP 89 94.295 2.690 6.219 585 HA ASP 89 HA ASP 89 93.356 3.618 8.859 586 HB2 ASP 89 HB2 ASP 89 95.901 3.387 8.751 587 HB3 ASP 89 HB1 ASP 89 95.863 4.696 7.573 588 HA PRO 90 HA PRO 90 91.518 6.197 5.570 589 HB2 PRO 90 HB2 PRO 90 89.528 7.376 7.037 590 HB3 PRO 90 HB1 PRO 90 89.406 5.735 6.374 591 HG2 PRO 90 HG2 PRO 90 90.057 6.609 9.150 592 HG3 PRO 90 HG1 PRO 90 89.064 5.249 8.600 593 HD2 PRO 90 HD2 PRO 90 91.659 4.975 9.473 594 HD3 PRO 90 HD1 PRO 90 90.896 3.853 8.321 595 H GLU 91 HN GLU 91 92.749 7.201 8.652 596 HA GLU 91 HA GLU 91 92.618 10.026 8.216 597 HB2 GLU 91 HB2 GLU 91 92.893 8.733 10.439 598 HB3 GLU 91 HB1 GLU 91 94.601 8.654 10.023 599 HG2 GLU 91 HG2 GLU 91 94.319 10.598 11.393 600 HG3 GLU 91 HG1 GLU 91 94.540 11.180 9.747 601 H ALA 92 HN ALA 92 94.513 7.622 6.800 602 HA ALA 92 HA ALA 92 96.407 9.665 5.813 603 HB1 ALA 92 HB1 ALA 92 97.712 8.633 7.496 604 HB2 ALA 92 HB2 ALA 92 98.217 7.865 5.991 605 HB3 ALA 92 HB3 ALA 92 97.117 7.024 7.084 606 H CYS 93 HN CYS 93 94.837 6.550 5.404 607 HA CYS 93 HA CYS 93 95.959 6.115 2.782 608 HB2 CYS 93 HB2 CYS 93 93.635 4.676 4.046 609 HB3 CYS 93 HB1 CYS 93 94.695 4.105 2.761 610 H SER 94 HN SER 94 93.281 7.912 3.966 611 HA SER 94 HA SER 94 91.662 7.602 1.583 612 HB2 SER 94 HB2 SER 94 91.471 9.639 3.810 613 HB3 SER 94 HB1 SER 94 90.253 9.338 2.575 614 HG SER 94 HG SER 94 91.235 7.227 4.144 615 H PHE 95 HN PHE 95 91.556 8.935 -0.159 616 HA PHE 95 HA PHE 95 93.204 11.385 -0.206 617 HB2 PHE 95 HB2 PHE 95 93.256 9.240 -2.338 618 HB3 PHE 95 HB1 PHE 95 94.102 10.778 -2.396 619 HD1 PHE 95 HD1 PHE 95 94.031 7.420 -0.916 620 HD2 PHE 95 HD2 PHE 95 96.031 11.221 -0.939 621 HE1 PHE 95 HE1 PHE 95 95.964 6.407 0.258 622 HE2 PHE 95 HE2 PHE 95 97.966 10.211 0.237 623 HZ PHE 95 HZ PHE 95 97.942 7.803 0.830 624 H ARG 96 HN ARG 96 92.416 12.976 -1.506 625 HA ARG 96 HA ARG 96 89.707 12.600 -2.590 626 HB2 ARG 96 HB2 ARG 96 90.112 14.501 -1.038 627 HB3 ARG 96 HB1 ARG 96 91.297 15.146 -2.174 628 HG2 ARG 96 HG2 ARG 96 89.560 15.331 -3.906 629 HG3 ARG 96 HG1 ARG 96 88.368 14.651 -2.798 630 HD2 ARG 96 HD2 ARG 96 89.940 17.182 -2.255 631 HD3 ARG 96 HD1 ARG 96 88.309 17.158 -2.920 632 HE ARG 96 HE ARG 96 88.220 15.634 -0.599 633 HH11 ARG 96 HH11 ARG 96 87.604 16.537 1.384 634 HH12 ARG 96 HH12 ARG 96 87.725 18.248 1.629 635 HH21 ARG 96 HH21 ARG 96 88.967 18.872 -1.555 636 HH22 ARG 96 HH22 ARG 96 88.507 19.574 -0.040 637 H GLU 97 HN GLU 97 89.271 12.817 -4.771 638 HA GLU 97 HA GLU 97 91.603 12.787 -6.542 639 HB2 GLU 97 HB2 GLU 97 89.962 12.171 -8.295 640 HB3 GLU 97 HB1 GLU 97 89.921 11.080 -6.913 641 HG2 GLU 97 HG2 GLU 97 88.001 12.444 -6.000 642 HG3 GLU 97 HG1 GLU 97 87.978 13.320 -7.529 643 H LEU 98 HN LEU 98 92.315 14.496 -7.574 644 HA LEU 98 HA LEU 98 90.569 16.884 -7.850 645 HB2 LEU 98 HB2 LEU 98 93.586 16.773 -7.902 646 HB3 LEU 98 HB1 LEU 98 92.570 18.203 -7.760 647 HG LEU 98 HG LEU 98 92.796 15.969 -5.724 648 HD11 LEU 98 HD11 LEU 98 93.780 18.834 -5.742 649 HD12 LEU 98 HD12 LEU 98 94.772 17.376 -5.726 650 HD13 LEU 98 HD13 LEU 98 93.789 17.790 -4.321 651 HD21 LEU 98 HD21 LEU 98 90.587 16.787 -5.528 652 HD22 LEU 98 HD22 LEU 98 91.073 18.445 -5.883 653 HD23 LEU 98 HD23 LEU 98 91.485 17.715 -4.331 654 H LEU 99 HN LEU 99 90.120 17.599 -9.860 655 HA LEU 99 HA LEU 99 91.638 16.447 -12.137 656 HB2 LEU 99 HB2 LEU 99 88.751 16.720 -11.635 657 HB3 LEU 99 HB1 LEU 99 89.221 17.387 -13.192 658 HG LEU 99 HG LEU 99 88.577 14.973 -13.293 659 HD11 LEU 99 HD11 LEU 99 90.145 14.459 -14.912 660 HD12 LEU 99 HD12 LEU 99 91.502 15.042 -13.956 661 HD13 LEU 99 HD13 LEU 99 90.436 16.191 -14.762 662 HD21 LEU 99 HD21 LEU 99 89.775 14.598 -10.952 663 HD22 LEU 99 HD22 LEU 99 91.166 14.230 -11.970 664 HD23 LEU 99 HD23 LEU 99 89.683 13.299 -12.137 665 H LEU 100 HN LEU 100 92.677 17.761 -13.418 666 HA LEU 100 HA LEU 100 92.415 20.666 -13.002 667 HB2 LEU 100 HB2 LEU 100 94.541 19.013 -14.388 668 HB3 LEU 100 HB1 LEU 100 94.571 20.770 -14.240 669 HG LEU 100 HG LEU 100 94.455 18.855 -11.888 670 HD11 LEU 100 HD11 LEU 100 96.843 19.526 -11.559 671 HD12 LEU 100 HD12 LEU 100 96.788 20.349 -13.117 672 HD13 LEU 100 HD13 LEU 100 96.581 18.600 -13.039 673 HD21 LEU 100 HD21 LEU 100 95.342 21.096 -10.787 674 HD22 LEU 100 HD22 LEU 100 93.620 20.880 -11.066 675 HD23 LEU 100 HD23 LEU 100 94.576 21.854 -12.183 676 H GLU 101 HN GLU 101 91.938 22.065 -14.658 677 HA GLU 101 HA GLU 101 90.191 21.246 -16.662 678 HB2 GLU 101 HB2 GLU 101 90.577 23.481 -17.649 679 HB3 GLU 101 HB1 GLU 101 90.345 23.561 -15.902 680 HG2 GLU 101 HG2 GLU 101 92.803 23.603 -15.592 681 HG3 GLU 101 HG1 GLU 101 93.012 23.593 -17.343 682 H ASP 102 HN ASP 102 93.600 21.076 -16.520 683 HA ASP 102 HA ASP 102 94.109 21.038 -19.342 684 HB2 ASP 102 HB2 ASP 102 95.748 20.178 -16.953 685 HB3 ASP 102 HB1 ASP 102 96.340 20.140 -18.612 686 H GLY 103 HN GLY 103 92.624 18.852 -17.274 687 HA2 GLY 103 HA2 GLY 103 91.715 16.784 -17.894 688 HA3 GLY 103 HA1 GLY 103 92.822 16.719 -19.260 689 H TYR 104 HN TYR 104 94.179 17.544 -16.196 690 HA TYR 104 HA TYR 104 95.422 14.853 -16.019 691 HB2 TYR 104 HB2 TYR 104 96.349 17.592 -15.146 692 HB3 TYR 104 HB1 TYR 104 97.109 16.110 -14.566 693 HD1 TYR 104 HD1 TYR 104 96.237 18.010 -17.655 694 HD2 TYR 104 HD2 TYR 104 98.647 14.907 -15.925 695 HE1 TYR 104 HE1 TYR 104 97.574 17.885 -19.740 696 HE2 TYR 104 HE2 TYR 104 99.982 14.779 -18.008 697 HH TYR 104 HH TYR 104 100.313 15.616 -20.032 698 H ASN 105 HN ASN 105 95.330 13.702 -14.141 699 HA ASN 105 HA ASN 105 93.500 14.739 -12.053 700 HB2 ASN 105 HB2 ASN 105 94.207 11.833 -12.378 701 HB3 ASN 105 HB1 ASN 105 92.750 12.556 -11.699 702 HD21 ASN 105 HD21 ASN 105 91.035 12.076 -13.069 703 HD22 ASN 105 HD22 ASN 105 91.091 12.162 -14.762 704 H VAL 106 HN VAL 106 94.134 14.801 -9.956 705 HA VAL 106 HA VAL 106 96.791 13.695 -9.256 706 HB VAL 106 HB VAL 106 95.845 16.349 -8.179 707 HG11 VAL 106 HG11 VAL 106 97.691 15.211 -7.030 708 HG12 VAL 106 HG12 VAL 106 98.284 16.650 -7.859 709 HG13 VAL 106 HG13 VAL 106 98.563 15.055 -8.556 710 HG21 VAL 106 HG21 VAL 106 97.461 17.296 -9.973 711 HG22 VAL 106 HG22 VAL 106 95.847 16.821 -10.499 712 HG23 VAL 106 HG23 VAL 106 97.218 15.760 -10.805 713 H TYR 107 HN TYR 107 97.079 13.336 -6.963 714 HA TYR 107 HA TYR 107 94.511 12.907 -5.527 715 HB2 TYR 107 HB2 TYR 107 97.050 11.265 -5.446 716 HB3 TYR 107 HB1 TYR 107 95.620 10.976 -4.455 717 HD1 TYR 107 HD1 TYR 107 97.079 10.739 -7.803 718 HD2 TYR 107 HD2 TYR 107 93.485 10.265 -5.496 719 HE1 TYR 107 HE1 TYR 107 96.043 9.485 -9.674 720 HE2 TYR 107 HE2 TYR 107 92.448 9.011 -7.369 721 HH TYR 107 HH TYR 107 93.683 9.001 -10.479 722 H GLN 108 HN GLN 108 94.339 13.604 -3.492 723 HA GLN 108 HA GLN 108 96.714 14.708 -2.109 724 HB2 GLN 108 HB2 GLN 108 95.457 16.537 -3.259 725 HB3 GLN 108 HB1 GLN 108 94.020 16.078 -2.348 726 HG2 GLN 108 HG2 GLN 108 95.252 16.499 -0.230 727 HG3 GLN 108 HG1 GLN 108 96.648 17.021 -1.170 728 HE21 GLN 108 HE21 GLN 108 95.162 18.729 0.680 729 HE22 GLN 108 HE22 GLN 108 94.480 19.982 -0.238 730 H SER 109 HN SER 109 96.701 14.384 0.096 731 HA SER 109 HA SER 109 94.863 12.450 1.149 732 HB2 SER 109 HB2 SER 109 96.723 14.196 2.767 733 HB3 SER 109 HB1 SER 109 96.133 12.583 3.158 734 HG SER 109 HG SER 109 97.852 13.306 1.014 735 H GLU 110 HN GLU 110 93.011 12.781 2.302 736 HA GLU 110 HA GLU 110 91.958 15.482 2.413 737 HB2 GLU 110 HB2 GLU 110 89.887 14.417 3.065 738 HB3 GLU 110 HB1 GLU 110 90.581 13.530 1.712 739 HG2 GLU 110 HG2 GLU 110 91.569 11.915 3.336 740 HG3 GLU 110 HG1 GLU 110 90.742 12.758 4.642 741 H ALA 111 HN ALA 111 93.252 13.113 4.628 742 HA ALA 111 HA ALA 111 92.255 14.243 7.028 743 HB1 ALA 111 HB1 ALA 111 93.140 11.920 6.764 744 HB2 ALA 111 HB2 ALA 111 93.813 12.788 8.145 745 HB3 ALA 111 HB3 ALA 111 94.760 12.611 6.667 746 H HIS 112 HN HIS 112 95.511 14.484 5.557 747 HA HIS 112 HA HIS 112 96.121 16.709 7.404 748 HB2 HIS 112 HB2 HIS 112 97.866 14.922 5.724 749 HB3 HIS 112 HB1 HIS 112 98.465 16.268 6.685 750 HD2 HIS 112 HD2 HIS 112 98.504 15.804 9.489 751 HE1 HIS 112 HE1 HIS 112 97.087 11.832 9.314 752 HE2 HIS 112 HE2 HIS 112 98.074 13.608 10.836 753 H GLY 113 HN GLY 113 95.480 16.080 4.054 754 HA2 GLY 113 HA2 GLY 113 95.205 17.671 2.353 755 HA3 GLY 113 HA1 GLY 113 95.829 18.900 3.443 756 H LEU 114 HN LEU 114 97.747 16.087 3.308 757 HA LEU 114 HA LEU 114 99.962 17.505 2.205 758 HB2 LEU 114 HB2 LEU 114 99.568 14.588 2.859 759 HB3 LEU 114 HB1 LEU 114 101.107 15.269 2.347 760 HG LEU 114 HG LEU 114 99.662 16.527 4.680 761 HD11 LEU 114 HD11 LEU 114 100.588 14.992 6.242 762 HD12 LEU 114 HD12 LEU 114 101.575 14.205 5.014 763 HD13 LEU 114 HD13 LEU 114 99.830 13.978 5.021 764 HD21 LEU 114 HD21 LEU 114 102.616 16.044 4.184 765 HD22 LEU 114 HD22 LEU 114 101.894 17.150 5.351 766 HD23 LEU 114 HD23 LEU 114 101.776 17.489 3.625 767 HA PRO 115 HA PRO 115 99.092 16.352 -2.063 768 HB2 PRO 115 HB2 PRO 115 101.369 17.205 -3.251 769 HB3 PRO 115 HB1 PRO 115 100.179 18.351 -2.596 770 HG2 PRO 115 HG2 PRO 115 102.717 17.362 -1.352 771 HG3 PRO 115 HG1 PRO 115 102.105 19.023 -1.475 772 HD2 PRO 115 HD2 PRO 115 101.805 17.531 0.790 773 HD3 PRO 115 HD1 PRO 115 100.605 18.746 0.288 774 H LEU 116 HN LEU 116 99.706 14.672 -3.553 775 HA LEU 116 HA LEU 116 101.426 12.618 -2.341 776 HB2 LEU 116 HB2 LEU 116 99.075 12.159 -3.235 777 HB3 LEU 116 HB1 LEU 116 99.748 12.364 -4.848 778 HG LEU 116 HG LEU 116 101.136 10.466 -2.963 779 HD11 LEU 116 HD11 LEU 116 99.649 8.631 -3.754 780 HD12 LEU 116 HD12 LEU 116 98.579 9.848 -4.444 781 HD13 LEU 116 HD13 LEU 116 98.836 9.787 -2.701 782 HD21 LEU 116 HD21 LEU 116 100.641 10.550 -5.956 783 HD22 LEU 116 HD22 LEU 116 101.417 9.200 -5.134 784 HD23 LEU 116 HD23 LEU 116 102.179 10.787 -5.124 785 H HIS 117 HN HIS 117 103.442 12.274 -3.006 786 HA HIS 117 HA HIS 117 104.240 12.804 -5.767 787 HB2 HIS 117 HB2 HIS 117 106.128 14.239 -5.086 788 HB3 HIS 117 HB1 HIS 117 104.578 14.981 -4.683 789 HD2 HIS 117 HD2 HIS 117 107.645 13.349 -2.823 790 HE1 HIS 117 HE1 HIS 117 105.081 15.030 0.080 791 HE2 HIS 117 HE2 HIS 117 107.338 13.926 -0.294 792 H LEU 118 HN LEU 118 106.436 12.026 -6.214 793 HA LEU 118 HA LEU 118 106.940 9.538 -4.843 794 HB2 LEU 118 HB2 LEU 118 108.532 10.844 -7.054 795 HB3 LEU 118 HB1 LEU 118 108.620 9.159 -6.549 796 HG LEU 118 HG LEU 118 106.153 10.510 -7.688 797 HD11 LEU 118 HD11 LEU 118 108.094 8.510 -8.894 798 HD12 LEU 118 HD12 LEU 118 107.922 10.201 -9.373 799 HD13 LEU 118 HD13 LEU 118 106.601 9.067 -9.655 800 HD21 LEU 118 HD21 LEU 118 106.752 7.731 -6.663 801 HD22 LEU 118 HD22 LEU 118 105.513 7.985 -7.890 802 HD23 LEU 118 HD23 LEU 118 105.360 8.758 -6.316 803 HA PRO 119 HA PRO 119 109.910 11.753 -2.228 804 HB2 PRO 119 HB2 PRO 119 110.458 9.786 -0.441 805 HB3 PRO 119 HB1 PRO 119 108.928 10.685 -0.415 806 HG2 PRO 119 HG2 PRO 119 109.504 7.968 -1.513 807 HG3 PRO 119 HG1 PRO 119 108.102 8.534 -0.586 808 HD2 PRO 119 HD2 PRO 119 108.104 8.254 -3.335 809 HD3 PRO 119 HD1 PRO 119 107.040 9.384 -2.465 810 H GLY 120 HN GLY 120 112.087 11.984 -2.381 811 HA2 GLY 120 HA2 GLY 120 113.574 10.024 -3.991 812 HA3 GLY 120 HA1 GLY 120 114.071 11.675 -3.631 813 H ASN 121 HN ASN 121 114.203 11.998 -1.077 814 HA ASN 121 HA ASN 121 115.708 11.658 0.650 815 HB2 ASN 121 HB2 ASN 121 114.313 8.973 0.535 816 HB3 ASN 121 HB1 ASN 121 115.240 9.582 1.904 817 HD21 ASN 121 HD21 ASN 121 113.384 11.917 0.072 818 HD22 ASN 121 HD22 ASN 121 112.156 12.125 1.223 819 H LYS 122 HN LYS 122 117.046 9.451 1.585 820 HA LYS 122 HA LYS 122 118.917 8.166 1.283 821 HB2 LYS 122 HB2 LYS 122 117.367 7.315 -0.697 822 HB3 LYS 122 HB1 LYS 122 118.551 8.144 -1.703 823 HG2 LYS 122 HG2 LYS 122 120.359 6.813 -0.761 824 HG3 LYS 122 HG1 LYS 122 119.258 6.062 0.393 825 HD2 LYS 122 HD2 LYS 122 117.976 5.073 -1.470 826 HD3 LYS 122 HD1 LYS 122 119.088 5.812 -2.624 827 HE2 LYS 122 HE2 LYS 122 120.959 4.542 -1.662 828 HE3 LYS 122 HE1 LYS 122 119.874 3.827 -0.469 829 HZ1 LYS 122 HZ1 LYS 122 119.946 3.401 -3.388 830 HZ2 LYS 122 HZ2 LYS 122 118.536 3.080 -2.498 831 HZ3 LYS 122 HZ3 LYS 122 119.973 2.246 -2.145 832 H SER 123 HN SER 123 118.426 11.049 -0.576 833 HA SER 123 HA SER 123 121.123 11.878 -0.145 834 HB2 SER 123 HB2 SER 123 121.378 10.366 -2.107 835 HB3 SER 123 HB1 SER 123 120.289 11.417 -3.008 836 HG SER 123 HG SER 123 122.646 11.813 -3.183 837 HA PRO 124 HA PRO 124 118.735 15.718 -0.222 838 HB2 PRO 124 HB2 PRO 124 121.320 16.998 -1.027 839 HB3 PRO 124 HB1 PRO 124 120.224 17.417 0.304 840 HG2 PRO 124 HG2 PRO 124 122.568 16.152 0.706 841 HG3 PRO 124 HG1 PRO 124 121.146 15.873 1.726 842 HD2 PRO 124 HD2 PRO 124 122.352 14.091 -0.337 843 HD3 PRO 124 HD1 PRO 124 121.384 13.683 1.099 844 H HIS 125 HN HIS 125 117.650 16.806 -1.846 845 HA HIS 125 HA HIS 125 118.041 15.944 -4.542 846 HB2 HIS 125 HB2 HIS 125 116.287 17.871 -4.925 847 HB3 HIS 125 HB1 HIS 125 115.810 16.412 -4.059 848 HD2 HIS 125 HD2 HIS 125 115.223 16.780 -1.331 849 HE1 HIS 125 HE1 HIS 125 116.049 20.918 -1.201 850 HE2 HIS 125 HE2 HIS 125 115.099 18.957 0.104 851 H ARG 126 HN ARG 126 119.684 16.594 -5.728 852 HA ARG 126 HA ARG 126 121.059 19.082 -5.324 853 HB2 ARG 126 HB2 ARG 126 121.266 16.915 -7.418 854 HB3 ARG 126 HB1 ARG 126 122.304 18.341 -7.398 855 HG2 ARG 126 HG2 ARG 126 123.090 17.768 -5.147 856 HG3 ARG 126 HG1 ARG 126 122.011 16.374 -5.110 857 HD2 ARG 126 HD2 ARG 126 123.192 15.390 -7.029 858 HD3 ARG 126 HD1 ARG 126 124.261 16.790 -7.098 859 HE ARG 126 HE ARG 126 124.550 15.873 -4.536 860 HH11 ARG 126 HH11 ARG 126 126.082 14.306 -3.938 861 HH12 ARG 126 HH12 ARG 126 126.677 13.189 -5.120 862 HH21 ARG 126 HH21 ARG 126 124.756 14.492 -7.698 863 HH22 ARG 126 HH22 ARG 126 125.928 13.298 -7.255 864 H ASP 127 HN ASP 127 118.927 17.778 -7.844 865 HA ASP 127 HA ASP 127 118.952 20.254 -9.332 866 HB2 ASP 127 HB2 ASP 127 117.222 17.798 -9.675 867 HB3 ASP 127 HB1 ASP 127 117.414 19.100 -10.844 868 HA PRO 128 HA PRO 128 115.523 22.295 -7.368 869 HB2 PRO 128 HB2 PRO 128 114.180 22.569 -10.030 870 HB3 PRO 128 HB1 PRO 128 114.599 23.822 -8.845 871 HG2 PRO 128 HG2 PRO 128 115.987 23.500 -11.115 872 HG3 PRO 128 HG1 PRO 128 116.761 24.009 -9.604 873 HD2 PRO 128 HD2 PRO 128 116.866 21.352 -10.971 874 HD3 PRO 128 HD1 PRO 128 118.083 22.161 -9.958 875 H ALA 129 HN ALA 129 113.642 21.614 -6.408 876 HA ALA 129 HA ALA 129 112.661 19.006 -7.060 877 HB1 ALA 129 HB1 ALA 129 112.631 20.685 -4.800 878 HB2 ALA 129 HB2 ALA 129 111.922 19.075 -4.907 879 HB3 ALA 129 HB3 ALA 129 110.932 20.499 -5.229 880 HA PRO 130 HA PRO 130 109.160 19.820 -9.622 881 HB2 PRO 130 HB2 PRO 130 107.166 19.026 -7.545 882 HB3 PRO 130 HB1 PRO 130 107.449 18.334 -9.154 883 HG2 PRO 130 HG2 PRO 130 108.190 17.052 -6.928 884 HG3 PRO 130 HG1 PRO 130 109.156 16.973 -8.413 885 HD2 PRO 130 HD2 PRO 130 109.663 18.568 -5.918 886 HD3 PRO 130 HD1 PRO 130 110.815 17.737 -6.986 887 H ARG 131 HN ARG 131 107.916 21.575 -10.176 888 HA ARG 131 HA ARG 131 107.879 23.863 -8.511 889 HB2 ARG 131 HB2 ARG 131 107.787 23.943 -10.999 890 HB3 ARG 131 HB1 ARG 131 106.150 23.290 -10.932 891 HG2 ARG 131 HG2 ARG 131 105.410 25.225 -9.608 892 HG3 ARG 131 HG1 ARG 131 107.049 25.874 -9.625 893 HD2 ARG 131 HD2 ARG 131 106.967 26.032 -12.082 894 HD3 ARG 131 HD1 ARG 131 105.329 25.380 -12.072 895 HE ARG 131 HE ARG 131 105.622 27.728 -10.422 896 HH11 ARG 131 HH11 ARG 131 104.578 29.601 -11.160 897 HH12 ARG 131 HH12 ARG 131 104.016 29.687 -12.797 898 HH21 ARG 131 HH21 ARG 131 105.118 26.495 -13.611 899 HH22 ARG 131 HH22 ARG 131 104.314 27.916 -14.187 900 H GLY 132 HN GLY 132 105.451 21.420 -9.305 901 HA2 GLY 132 HA2 GLY 132 103.890 22.229 -6.933 902 HA3 GLY 132 HA1 GLY 132 103.076 22.109 -8.491 903 HA PRO 133 HA PRO 133 102.839 17.991 -6.315 904 HB2 PRO 133 HB2 PRO 133 100.097 18.061 -7.465 905 HB3 PRO 133 HB1 PRO 133 100.607 17.726 -5.800 906 HG2 PRO 133 HG2 PRO 133 99.400 20.024 -6.467 907 HG3 PRO 133 HG1 PRO 133 100.668 19.958 -5.228 908 HD2 PRO 133 HD2 PRO 133 100.867 20.897 -8.079 909 HD3 PRO 133 HD1 PRO 133 101.623 21.571 -6.616 910 H ALA 134 HN ALA 134 102.899 15.924 -7.292 911 HA ALA 134 HA ALA 134 103.582 15.903 -10.080 912 HB1 ALA 134 HB1 ALA 134 103.864 13.469 -9.738 913 HB2 ALA 134 HB2 ALA 134 103.188 13.633 -8.118 914 HB3 ALA 134 HB3 ALA 134 104.718 14.414 -8.519 915 H ARG 135 HN ARG 135 102.183 15.860 -11.687 916 HA ARG 135 HA ARG 135 99.405 15.191 -11.315 917 HB2 ARG 135 HB2 ARG 135 101.030 15.788 -13.800 918 HB3 ARG 135 HB1 ARG 135 99.281 15.562 -13.779 919 HG2 ARG 135 HG2 ARG 135 99.036 17.434 -12.210 920 HG3 ARG 135 HG1 ARG 135 100.786 17.653 -12.183 921 HD2 ARG 135 HD2 ARG 135 99.103 17.839 -14.693 922 HD3 ARG 135 HD1 ARG 135 99.583 19.232 -13.729 923 HE ARG 135 HE ARG 135 101.876 17.701 -14.397 924 HH11 ARG 135 HH11 ARG 135 103.208 18.422 -16.095 925 HH12 ARG 135 HH12 ARG 135 102.597 19.574 -17.235 926 HH21 ARG 135 HH21 ARG 135 99.482 19.812 -15.736 927 HH22 ARG 135 HH22 ARG 135 100.494 20.365 -17.028 928 H PHE 136 HN PHE 136 98.358 13.349 -11.867 929 HA PHE 136 HA PHE 136 99.972 11.124 -12.978 930 HB2 PHE 136 HB2 PHE 136 98.416 11.321 -10.449 931 HB3 PHE 136 HB1 PHE 136 98.218 9.817 -11.347 932 HD1 PHE 136 HD1 PHE 136 100.534 11.890 -9.381 933 HD2 PHE 136 HD2 PHE 136 100.154 8.380 -11.832 934 HE1 PHE 136 HE1 PHE 136 102.715 11.053 -8.532 935 HE2 PHE 136 HE2 PHE 136 102.324 7.546 -10.979 936 HZ PHE 136 HZ PHE 136 103.605 8.879 -9.335 937 H LEU 137 HN LEU 137 98.946 9.640 -14.217 938 HA LEU 137 HA LEU 137 96.193 10.243 -15.113 939 HB2 LEU 137 HB2 LEU 137 98.705 9.773 -16.687 940 HB3 LEU 137 HB1 LEU 137 97.161 9.282 -17.377 941 HG LEU 137 HG LEU 137 97.444 12.063 -16.238 942 HD11 LEU 137 HD11 LEU 137 98.418 11.123 -18.950 943 HD12 LEU 137 HD12 LEU 137 99.369 11.916 -17.695 944 HD13 LEU 137 HD13 LEU 137 98.115 12.813 -18.552 945 HD21 LEU 137 HD21 LEU 137 95.694 12.576 -17.792 946 HD22 LEU 137 HD22 LEU 137 95.247 11.030 -17.071 947 HD23 LEU 137 HD23 LEU 137 95.954 11.079 -18.684 948 HA PRO 138 HA PRO 138 96.359 5.879 -13.798 949 HB2 PRO 138 HB2 PRO 138 93.728 5.475 -13.336 950 HB3 PRO 138 HB1 PRO 138 94.737 6.430 -12.233 951 HG2 PRO 138 HG2 PRO 138 92.835 7.366 -14.338 952 HG3 PRO 138 HG1 PRO 138 93.083 7.981 -12.693 953 HD2 PRO 138 HD2 PRO 138 94.184 9.146 -14.945 954 HD3 PRO 138 HD1 PRO 138 94.891 9.291 -13.319 955 H LEU 139 HN LEU 139 96.563 4.218 -15.199 956 HA LEU 139 HA LEU 139 95.108 4.258 -17.745 957 HB2 LEU 139 HB2 LEU 139 97.030 2.054 -17.091 958 HB3 LEU 139 HB1 LEU 139 96.793 2.917 -18.601 959 HG LEU 139 HG LEU 139 98.155 4.048 -16.139 960 HD11 LEU 139 HD11 LEU 139 100.197 3.860 -17.499 961 HD12 LEU 139 HD12 LEU 139 99.265 3.156 -18.819 962 HD13 LEU 139 HD13 LEU 139 99.445 2.276 -17.303 963 HD21 LEU 139 HD21 LEU 139 98.846 5.791 -17.931 964 HD22 LEU 139 HD22 LEU 139 97.200 5.883 -17.307 965 HD23 LEU 139 HD23 LEU 139 97.506 5.150 -18.881 966 HA PRO 140 HA PRO 140 92.233 1.169 -16.361 967 HB2 PRO 140 HB2 PRO 140 91.643 -0.136 -18.697 968 HB3 PRO 140 HB1 PRO 140 91.058 1.499 -18.327 969 HG2 PRO 140 HG2 PRO 140 93.369 0.660 -20.026 970 HG3 PRO 140 HG1 PRO 140 92.159 1.924 -20.316 971 HD2 PRO 140 HD2 PRO 140 94.665 2.485 -19.387 972 HD3 PRO 140 HD1 PRO 140 93.248 3.468 -18.959 973 H GLY 141 HN GLY 141 92.817 -0.568 -15.146 974 HA2 GLY 141 HA2 GLY 141 94.982 -2.324 -16.012 975 HA3 GLY 141 HA1 GLY 141 94.179 -2.341 -14.445 Start of MODEL 5 1 H1 GLY 13 HT1 GLY 13 82.421 2.479 -13.510 2 H2 GLY 13 HT2 GLY 13 82.963 3.438 -12.216 3 H3 GLY 13 HT3 GLY 13 81.323 3.007 -12.331 4 HA2 GLY 13 HA2 GLY 13 81.669 0.859 -11.649 5 HA3 GLY 13 HA1 GLY 13 83.355 0.891 -12.169 6 H GLN 14 HN GLN 14 81.990 0.312 -9.508 7 HA GLN 14 HA GLN 14 82.630 2.379 -7.678 8 HB2 GLN 14 HB2 GLN 14 82.226 -0.598 -7.372 9 HB3 GLN 14 HB1 GLN 14 82.598 0.442 -5.997 10 HG2 GLN 14 HG2 GLN 14 80.174 0.177 -6.202 11 HG3 GLN 14 HG1 GLN 14 80.625 1.845 -6.552 12 HE21 GLN 14 HE21 GLN 14 78.985 2.384 -8.063 13 HE22 GLN 14 HE22 GLN 14 78.767 1.569 -9.535 14 H VAL 15 HN VAL 15 84.419 -0.414 -8.882 15 HA VAL 15 HA VAL 15 86.917 0.744 -7.794 16 HB VAL 15 HB VAL 15 86.388 -1.020 -6.293 17 HG11 VAL 15 HG11 VAL 15 84.685 -2.229 -7.418 18 HG12 VAL 15 HG12 VAL 15 86.017 -3.372 -7.236 19 HG13 VAL 15 HG13 VAL 15 85.738 -2.582 -8.789 20 HG21 VAL 15 HG21 VAL 15 88.741 -0.946 -7.315 21 HG22 VAL 15 HG22 VAL 15 88.240 -2.318 -8.299 22 HG23 VAL 15 HG23 VAL 15 88.276 -2.461 -6.542 23 H ARG 16 HN ARG 16 88.655 0.623 -9.105 24 HA ARG 16 HA ARG 16 88.461 -0.884 -11.643 25 HB2 ARG 16 HB2 ARG 16 88.984 2.080 -11.348 26 HB3 ARG 16 HB1 ARG 16 89.346 1.174 -12.817 27 HG2 ARG 16 HG2 ARG 16 87.002 0.542 -13.055 28 HG3 ARG 16 HG1 ARG 16 86.608 1.309 -11.517 29 HD2 ARG 16 HD2 ARG 16 87.776 2.791 -13.884 30 HD3 ARG 16 HD1 ARG 16 86.054 2.719 -13.519 31 HE ARG 16 HE ARG 16 87.404 3.578 -11.207 32 HH11 ARG 16 HH11 ARG 16 87.465 5.777 -10.696 33 HH12 ARG 16 HH12 ARG 16 87.174 6.961 -11.925 34 HH21 ARG 16 HH21 ARG 16 86.718 4.608 -14.439 35 HH22 ARG 16 HH22 ARG 16 86.733 6.295 -14.051 36 H GLN 17 HN GLN 17 90.469 -1.352 -12.620 37 HA GLN 17 HA GLN 17 92.801 -1.107 -10.807 38 HB2 GLN 17 HB2 GLN 17 93.453 -2.953 -12.835 39 HB3 GLN 17 HB1 GLN 17 92.985 -3.345 -11.183 40 HG2 GLN 17 HG2 GLN 17 90.634 -3.440 -11.860 41 HG3 GLN 17 HG1 GLN 17 91.076 -2.990 -13.505 42 HE21 GLN 17 HE21 GLN 17 93.570 -4.647 -13.457 43 HE22 GLN 17 HE22 GLN 17 93.050 -6.258 -13.576 44 H ARG 18 HN ARG 18 94.354 0.320 -11.359 45 HA ARG 18 HA ARG 18 94.969 0.715 -14.198 46 HB2 ARG 18 HB2 ARG 18 94.335 3.064 -12.397 47 HB3 ARG 18 HB1 ARG 18 94.784 3.126 -14.100 48 HG2 ARG 18 HG2 ARG 18 92.734 1.735 -14.598 49 HG3 ARG 18 HG1 ARG 18 92.258 1.955 -12.917 50 HD2 ARG 18 HD2 ARG 18 92.812 4.224 -14.844 51 HD3 ARG 18 HD1 ARG 18 91.204 3.616 -14.462 52 HE ARG 18 HE ARG 18 92.557 4.279 -12.061 53 HH11 ARG 18 HH11 ARG 18 92.046 6.245 -11.038 54 HH12 ARG 18 HH12 ARG 18 91.240 7.494 -11.925 55 HH21 ARG 18 HH21 ARG 18 91.124 5.676 -14.880 56 HH22 ARG 18 HH22 ARG 18 90.718 7.172 -14.107 57 H TYR 19 HN TYR 19 97.022 1.651 -14.597 58 HA TYR 19 HA TYR 19 98.941 1.282 -12.395 59 HB2 TYR 19 HB2 TYR 19 99.283 1.769 -15.365 60 HB3 TYR 19 HB1 TYR 19 100.627 1.689 -14.234 61 HD1 TYR 19 HD1 TYR 19 97.682 -0.267 -15.475 62 HD2 TYR 19 HD2 TYR 19 101.550 -0.381 -13.608 63 HE1 TYR 19 HE1 TYR 19 97.705 -2.744 -15.655 64 HE2 TYR 19 HE2 TYR 19 101.564 -2.847 -13.796 65 HH TYR 19 HH TYR 19 100.111 -4.567 -15.644 66 H LEU 20 HN LEU 20 100.051 2.970 -11.449 67 HA LEU 20 HA LEU 20 99.184 5.681 -12.147 68 HB2 LEU 20 HB2 LEU 20 100.033 4.339 -9.741 69 HB3 LEU 20 HB1 LEU 20 101.120 5.694 -10.014 70 HG LEU 20 HG LEU 20 99.113 7.176 -10.289 71 HD11 LEU 20 HD11 LEU 20 96.999 6.057 -9.126 72 HD12 LEU 20 HD12 LEU 20 97.717 4.571 -9.744 73 HD13 LEU 20 HD13 LEU 20 97.279 5.868 -10.854 74 HD21 LEU 20 HD21 LEU 20 99.457 5.639 -7.698 75 HD22 LEU 20 HD22 LEU 20 98.525 7.129 -7.832 76 HD23 LEU 20 HD23 LEU 20 100.257 7.141 -8.162 77 H TYR 21 HN TYR 21 100.228 6.792 -13.618 78 HA TYR 21 HA TYR 21 103.186 6.534 -13.821 79 HB2 TYR 21 HB2 TYR 21 102.280 5.375 -15.715 80 HB3 TYR 21 HB1 TYR 21 101.127 6.670 -16.031 81 HD1 TYR 21 HD1 TYR 21 104.709 5.708 -16.169 82 HD2 TYR 21 HD2 TYR 21 101.779 8.697 -17.139 83 HE1 TYR 21 HE1 TYR 21 106.353 6.854 -17.636 84 HE2 TYR 21 HE2 TYR 21 103.424 9.839 -18.597 85 HH TYR 21 HH TYR 21 105.512 9.885 -19.318 86 H THR 22 HN THR 22 104.300 8.432 -13.884 87 HA THR 22 HA THR 22 102.803 10.940 -14.359 88 HB THR 22 HB THR 22 102.926 10.792 -11.964 89 HG1 THR 22 HG1 THR 22 105.123 12.390 -12.287 90 HG21 THR 22 HG21 THR 22 105.058 10.466 -10.809 91 HG22 THR 22 HG22 THR 22 105.878 10.300 -12.363 92 HG23 THR 22 HG23 THR 22 104.696 9.092 -11.856 93 H SER 23 HN SER 23 104.099 12.724 -15.009 94 HA SER 23 HA SER 23 106.488 11.894 -16.510 95 HB2 SER 23 HB2 SER 23 104.846 13.080 -17.813 96 HB3 SER 23 HB1 SER 23 104.746 14.367 -16.613 97 HG SER 23 HG SER 23 106.375 15.258 -17.572 98 H GLY 24 HN GLY 24 108.495 12.517 -15.978 99 HA2 GLY 24 HA2 GLY 24 108.841 14.558 -13.838 100 HA3 GLY 24 HA1 GLY 24 109.844 13.114 -13.975 101 HA PRO 25 HA PRO 25 111.866 16.843 -16.086 102 HB2 PRO 25 HB2 PRO 25 114.197 15.436 -14.825 103 HB3 PRO 25 HB1 PRO 25 113.855 17.174 -14.927 104 HG2 PRO 25 HG2 PRO 25 113.506 15.846 -12.651 105 HG3 PRO 25 HG1 PRO 25 112.376 17.120 -13.147 106 HD2 PRO 25 HD2 PRO 25 112.005 14.145 -13.218 107 HD3 PRO 25 HD1 PRO 25 110.809 15.422 -12.897 108 H HIS 26 HN HIS 26 112.895 13.470 -15.762 109 HA HIS 26 HA HIS 26 112.942 13.065 -18.609 110 HB2 HIS 26 HB2 HIS 26 115.533 13.168 -17.054 111 HB3 HIS 26 HB1 HIS 26 115.371 12.302 -18.583 112 HD2 HIS 26 HD2 HIS 26 114.464 14.101 -20.781 113 HE1 HIS 26 HE1 HIS 26 116.086 17.519 -18.912 114 HE2 HIS 26 HE2 HIS 26 115.170 16.593 -21.089 115 H GLY 27 HN GLY 27 114.693 11.640 -15.845 116 HA2 GLY 27 HA2 GLY 27 114.448 9.595 -14.797 117 HA3 GLY 27 HA1 GLY 27 112.880 9.441 -15.584 118 H LEU 28 HN LEU 28 115.218 10.145 -17.864 119 HA LEU 28 HA LEU 28 116.367 8.931 -19.435 120 HB2 LEU 28 HB2 LEU 28 117.154 7.707 -17.267 121 HB3 LEU 28 HB1 LEU 28 116.051 6.434 -17.774 122 HG LEU 28 HG LEU 28 118.219 7.572 -19.562 123 HD11 LEU 28 HD11 LEU 28 118.260 5.069 -17.855 124 HD12 LEU 28 HD12 LEU 28 119.206 6.529 -17.564 125 HD13 LEU 28 HD13 LEU 28 119.508 5.555 -19.003 126 HD21 LEU 28 HD21 LEU 28 116.301 5.238 -19.736 127 HD22 LEU 28 HD22 LEU 28 117.815 5.236 -20.640 128 HD23 LEU 28 HD23 LEU 28 116.620 6.496 -20.932 129 H SER 29 HN SER 29 113.986 6.716 -17.992 130 HA SER 29 HA SER 29 112.639 6.494 -20.619 131 HB2 SER 29 HB2 SER 29 112.395 4.107 -20.308 132 HB3 SER 29 HB1 SER 29 114.103 4.520 -20.206 133 HG SER 29 HG SER 29 112.658 4.600 -17.838 134 H SER 30 HN SER 30 110.643 4.755 -19.858 135 HA SER 30 HA SER 30 108.755 6.453 -18.688 136 HB2 SER 30 HB2 SER 30 108.077 4.572 -20.067 137 HB3 SER 30 HB1 SER 30 108.762 3.436 -18.910 138 HG SER 30 HG SER 30 106.670 3.540 -18.349 139 H CYS 31 HN CYS 31 107.813 6.550 -16.656 140 HA CYS 31 HA CYS 31 109.219 5.152 -14.456 141 HB2 CYS 31 HB2 CYS 31 110.038 7.432 -14.477 142 HB3 CYS 31 HB1 CYS 31 108.395 8.065 -14.582 143 H HIS 32 HN HIS 32 107.817 3.875 -13.452 144 HA HIS 32 HA HIS 32 104.984 4.731 -13.204 145 HB2 HIS 32 HB2 HIS 32 106.132 1.936 -13.421 146 HB3 HIS 32 HB1 HIS 32 104.436 2.317 -13.129 147 HD2 HIS 32 HD2 HIS 32 106.981 2.267 -16.084 148 HE1 HIS 32 HE1 HIS 32 103.269 3.554 -17.626 149 HE2 HIS 32 HE2 HIS 32 105.621 2.824 -18.241 150 H LEU 33 HN LEU 33 104.023 4.536 -11.212 151 HA LEU 33 HA LEU 33 105.756 4.486 -8.924 152 HB2 LEU 33 HB2 LEU 33 103.403 5.673 -9.352 153 HB3 LEU 33 HB1 LEU 33 102.772 4.181 -8.667 154 HG LEU 33 HG LEU 33 104.788 6.039 -7.375 155 HD11 LEU 33 HD11 LEU 33 101.860 5.463 -6.894 156 HD12 LEU 33 HD12 LEU 33 102.618 7.017 -7.240 157 HD13 LEU 33 HD13 LEU 33 102.881 6.235 -5.681 158 HD21 LEU 33 HD21 LEU 33 105.399 3.942 -6.562 159 HD22 LEU 33 HD22 LEU 33 103.747 3.316 -6.622 160 HD23 LEU 33 HD23 LEU 33 104.216 4.464 -5.367 161 H GLU 34 HN GLU 34 106.281 2.758 -7.659 162 HA GLU 34 HA GLU 34 104.718 0.258 -7.958 163 HB2 GLU 34 HB2 GLU 34 106.919 -0.974 -7.823 164 HB3 GLU 34 HB1 GLU 34 106.637 -0.108 -9.334 165 HG2 GLU 34 HG2 GLU 34 108.113 1.653 -8.721 166 HG3 GLU 34 HG1 GLU 34 108.136 1.152 -7.032 167 H ILE 35 HN ILE 35 104.589 -1.035 -6.185 168 HA ILE 35 HA ILE 35 105.732 0.049 -3.654 169 HB ILE 35 HB ILE 35 103.138 -1.487 -4.003 170 HG12 ILE 35 HG12 ILE 35 103.567 1.426 -3.269 171 HG13 ILE 35 HG11 ILE 35 103.129 0.882 -4.890 172 HG21 ILE 35 HG21 ILE 35 102.808 -0.887 -1.627 173 HG22 ILE 35 HG22 ILE 35 104.382 -0.096 -1.606 174 HG23 ILE 35 HG23 ILE 35 104.278 -1.842 -1.825 175 HD11 ILE 35 HD11 ILE 35 101.525 0.559 -2.343 176 HD12 ILE 35 HD12 ILE 35 101.139 -0.292 -3.840 177 HD13 ILE 35 HD13 ILE 35 101.079 1.469 -3.788 178 H ARG 36 HN ARG 36 107.109 -1.279 -2.667 179 HA ARG 36 HA ARG 36 107.514 -3.963 -3.699 180 HB2 ARG 36 HB2 ARG 36 108.914 -2.257 -1.659 181 HB3 ARG 36 HB1 ARG 36 109.304 -3.963 -1.829 182 HG2 ARG 36 HG2 ARG 36 110.866 -2.959 -3.248 183 HG3 ARG 36 HG1 ARG 36 109.588 -3.396 -4.373 184 HD2 ARG 36 HD2 ARG 36 108.705 -1.123 -4.315 185 HD3 ARG 36 HD1 ARG 36 109.877 -0.669 -3.080 186 HE ARG 36 HE ARG 36 110.991 -1.702 -5.571 187 HH11 ARG 36 HH11 ARG 36 112.341 -0.263 -6.676 188 HH12 ARG 36 HH12 ARG 36 112.383 1.407 -6.216 189 HH21 ARG 36 HH21 ARG 36 110.059 1.044 -3.670 190 HH22 ARG 36 HH22 ARG 36 111.104 2.142 -4.510 191 H GLU 37 HN GLU 37 107.664 -5.794 -2.311 192 HA GLU 37 HA GLU 37 105.352 -6.132 -0.677 193 HB2 GLU 37 HB2 GLU 37 106.289 -7.955 -2.049 194 HB3 GLU 37 HB1 GLU 37 107.762 -7.925 -1.080 195 HG2 GLU 37 HG2 GLU 37 106.517 -8.530 0.914 196 HG3 GLU 37 HG1 GLU 37 104.995 -8.447 0.027 197 H ASP 38 HN ASP 38 108.639 -5.227 -0.202 198 HA ASP 38 HA ASP 38 108.820 -5.844 2.586 199 HB2 ASP 38 HB2 ASP 38 110.765 -5.382 0.976 200 HB3 ASP 38 HB1 ASP 38 110.363 -3.676 1.157 201 H GLY 39 HN GLY 39 107.060 -3.645 0.802 202 HA2 GLY 39 HA2 GLY 39 105.424 -2.205 1.710 203 HA3 GLY 39 HA1 GLY 39 106.336 -2.127 3.210 204 H THR 40 HN THR 40 108.448 -1.759 0.596 205 HA THR 40 HA THR 40 108.621 1.119 1.145 206 HB THR 40 HB THR 40 110.655 0.911 -0.415 207 HG1 THR 40 HG1 THR 40 110.273 -1.017 -1.376 208 HG21 THR 40 HG21 THR 40 110.422 -0.493 2.247 209 HG22 THR 40 HG22 THR 40 111.024 1.133 1.927 210 HG23 THR 40 HG23 THR 40 111.969 -0.271 1.430 211 H VAL 41 HN VAL 41 108.950 2.627 -0.711 212 HA VAL 41 HA VAL 41 107.269 1.896 -3.050 213 HB VAL 41 HB VAL 41 107.176 4.499 -1.511 214 HG11 VAL 41 HG11 VAL 41 105.146 4.841 -2.969 215 HG12 VAL 41 HG12 VAL 41 105.636 3.411 -3.879 216 HG13 VAL 41 HG13 VAL 41 106.674 4.836 -3.852 217 HG21 VAL 41 HG21 VAL 41 106.179 2.653 -0.233 218 HG22 VAL 41 HG22 VAL 41 105.238 2.165 -1.642 219 HG23 VAL 41 HG23 VAL 41 104.909 3.708 -0.853 220 H GLY 42 HN GLY 42 107.742 2.921 -4.997 221 HA2 GLY 42 HA2 GLY 42 109.632 5.007 -5.317 222 HA3 GLY 42 HA1 GLY 42 110.422 3.458 -5.577 223 H CYS 43 HN CYS 43 110.621 4.748 -7.712 224 HA CYS 43 HA CYS 43 108.298 4.495 -9.488 225 HB2 CYS 43 HB2 CYS 43 109.556 6.536 -9.728 226 HB3 CYS 43 HB1 CYS 43 111.073 5.649 -9.861 227 H ALA 44 HN ALA 44 108.546 3.418 -11.593 228 HA ALA 44 HA ALA 44 110.627 1.328 -11.722 229 HB1 ALA 44 HB1 ALA 44 107.745 0.660 -12.304 230 HB2 ALA 44 HB2 ALA 44 108.435 0.458 -10.699 231 HB3 ALA 44 HB3 ALA 44 109.102 -0.438 -12.057 232 H ALA 45 HN ALA 45 111.214 0.731 -13.786 233 HA ALA 45 HA ALA 45 110.054 2.346 -15.993 234 HB1 ALA 45 HB1 ALA 45 112.287 1.916 -17.094 235 HB2 ALA 45 HB2 ALA 45 112.837 1.252 -15.556 236 HB3 ALA 45 HB3 ALA 45 112.347 2.943 -15.662 237 H ASP 46 HN ASP 46 110.169 -0.765 -14.747 238 HA ASP 46 HA ASP 46 110.086 -2.068 -17.390 239 HB2 ASP 46 HB2 ASP 46 110.252 -3.202 -14.593 240 HB3 ASP 46 HB1 ASP 46 110.156 -4.177 -16.061 241 H GLN 47 HN GLN 47 107.958 -0.594 -15.401 242 HA GLN 47 HA GLN 47 105.721 -0.879 -14.861 243 HB2 GLN 47 HB2 GLN 47 105.816 -0.035 -17.212 244 HB3 GLN 47 HB1 GLN 47 105.675 -1.704 -17.769 245 HG2 GLN 47 HG2 GLN 47 103.545 -1.943 -16.599 246 HG3 GLN 47 HG1 GLN 47 103.697 -0.307 -15.959 247 HE21 GLN 47 HE21 GLN 47 102.636 1.253 -17.160 248 HE22 GLN 47 HE22 GLN 47 102.255 1.129 -18.809 249 H SER 48 HN SER 48 105.687 -2.618 -13.417 250 HA SER 48 HA SER 48 104.901 -5.222 -14.600 251 HB2 SER 48 HB2 SER 48 106.118 -5.368 -11.916 252 HB3 SER 48 HB1 SER 48 106.469 -6.315 -13.361 253 HG SER 48 HG SER 48 107.982 -4.940 -13.899 254 HA PRO 49 HA PRO 49 101.276 -5.549 -12.148 255 HB2 PRO 49 HB2 PRO 49 102.511 -7.565 -10.301 256 HB3 PRO 49 HB1 PRO 49 101.001 -7.667 -11.231 257 HG2 PRO 49 HG2 PRO 49 103.145 -8.992 -12.025 258 HG3 PRO 49 HG1 PRO 49 102.107 -8.172 -13.209 259 HD2 PRO 49 HD2 PRO 49 104.778 -7.315 -12.132 260 HD3 PRO 49 HD1 PRO 49 104.135 -7.186 -13.785 261 H GLU 50 HN GLU 50 104.195 -5.402 -10.163 262 HA GLU 50 HA GLU 50 103.092 -4.626 -7.728 263 HB2 GLU 50 HB2 GLU 50 105.274 -3.699 -7.206 264 HB3 GLU 50 HB1 GLU 50 105.485 -5.205 -8.101 265 HG2 GLU 50 HG2 GLU 50 105.670 -3.817 -10.209 266 HG3 GLU 50 HG1 GLU 50 105.699 -2.385 -9.187 267 H SER 51 HN SER 51 103.425 -2.847 -10.685 268 HA SER 51 HA SER 51 102.971 -0.262 -9.410 269 HB2 SER 51 HB2 SER 51 103.371 -1.124 -12.278 270 HB3 SER 51 HB1 SER 51 103.009 0.534 -11.814 271 HG SER 51 HG SER 51 104.906 -0.089 -10.232 272 H LEU 52 HN LEU 52 101.058 -2.818 -10.213 273 HA LEU 52 HA LEU 52 98.833 -1.303 -11.353 274 HB2 LEU 52 HB2 LEU 52 99.579 -3.783 -11.858 275 HB3 LEU 52 HB1 LEU 52 98.650 -4.157 -10.410 276 HG LEU 52 HG LEU 52 97.630 -2.756 -12.892 277 HD11 LEU 52 HD11 LEU 52 96.789 -5.379 -11.642 278 HD12 LEU 52 HD12 LEU 52 97.929 -5.251 -12.982 279 HD13 LEU 52 HD13 LEU 52 96.261 -4.721 -13.189 280 HD21 LEU 52 HD21 LEU 52 95.399 -2.987 -11.664 281 HD22 LEU 52 HD22 LEU 52 96.484 -1.727 -11.089 282 HD23 LEU 52 HD23 LEU 52 96.351 -3.249 -10.204 283 H LEU 53 HN LEU 53 97.682 -0.090 -9.976 284 HA LEU 53 HA LEU 53 97.209 -1.100 -7.221 285 HB2 LEU 53 HB2 LEU 53 97.004 1.743 -8.218 286 HB3 LEU 53 HB1 LEU 53 96.904 1.186 -6.549 287 HG LEU 53 HG LEU 53 99.346 0.900 -8.326 288 HD11 LEU 53 HD11 LEU 53 98.810 3.248 -7.707 289 HD12 LEU 53 HD12 LEU 53 100.299 2.687 -6.946 290 HD13 LEU 53 HD13 LEU 53 98.808 2.781 -6.007 291 HD21 LEU 53 HD21 LEU 53 100.366 0.484 -5.955 292 HD22 LEU 53 HD22 LEU 53 99.482 -0.830 -6.728 293 HD23 LEU 53 HD23 LEU 53 98.705 0.135 -5.473 294 H GLN 54 HN GLN 54 95.209 -1.645 -6.671 295 HA GLN 54 HA GLN 54 93.024 -1.226 -8.519 296 HB2 GLN 54 HB2 GLN 54 93.239 -2.528 -5.807 297 HB3 GLN 54 HB1 GLN 54 91.681 -2.280 -6.597 298 HG2 GLN 54 HG2 GLN 54 92.438 -3.546 -8.549 299 HG3 GLN 54 HG1 GLN 54 94.028 -3.746 -7.826 300 HE21 GLN 54 HE21 GLN 54 92.321 -3.998 -5.132 301 HE22 GLN 54 HE22 GLN 54 91.902 -5.642 -5.146 302 H LEU 55 HN LEU 55 91.899 0.560 -8.629 303 HA LEU 55 HA LEU 55 92.021 2.553 -6.500 304 HB2 LEU 55 HB2 LEU 55 92.324 3.359 -8.736 305 HB3 LEU 55 HB1 LEU 55 90.893 2.508 -9.303 306 HG LEU 55 HG LEU 55 89.439 3.970 -8.061 307 HD11 LEU 55 HD11 LEU 55 90.532 4.360 -6.014 308 HD12 LEU 55 HD12 LEU 55 90.591 5.932 -6.811 309 HD13 LEU 55 HD13 LEU 55 92.019 4.898 -6.800 310 HD21 LEU 55 HD21 LEU 55 90.064 6.159 -9.082 311 HD22 LEU 55 HD22 LEU 55 90.235 4.817 -10.214 312 HD23 LEU 55 HD23 LEU 55 91.662 5.503 -9.440 313 H LYS 56 HN LYS 56 90.563 2.540 -4.916 314 HA LYS 56 HA LYS 56 87.841 1.497 -5.476 315 HB2 LYS 56 HB2 LYS 56 89.704 1.094 -3.164 316 HB3 LYS 56 HB1 LYS 56 87.974 1.152 -2.826 317 HG2 LYS 56 HG2 LYS 56 87.553 -0.657 -4.369 318 HG3 LYS 56 HG1 LYS 56 89.229 -0.660 -4.909 319 HD2 LYS 56 HD2 LYS 56 89.963 -1.329 -2.665 320 HD3 LYS 56 HD1 LYS 56 88.296 -1.258 -2.087 321 HE2 LYS 56 HE2 LYS 56 89.193 -3.042 -4.365 322 HE3 LYS 56 HE1 LYS 56 89.083 -3.584 -2.690 323 HZ1 LYS 56 HZ1 LYS 56 87.052 -3.543 -4.524 324 HZ2 LYS 56 HZ2 LYS 56 86.728 -2.212 -3.520 325 HZ3 LYS 56 HZ3 LYS 56 86.891 -3.763 -2.849 326 H ALA 57 HN ALA 57 86.136 2.626 -4.914 327 HA ALA 57 HA ALA 57 86.565 5.379 -3.944 328 HB1 ALA 57 HB1 ALA 57 85.280 4.927 -6.063 329 HB2 ALA 57 HB2 ALA 57 84.393 5.855 -4.852 330 HB3 ALA 57 HB3 ALA 57 84.051 4.139 -5.075 331 H LEU 58 HN LEU 58 86.643 5.314 -1.720 332 HA LEU 58 HA LEU 58 84.984 3.579 -0.146 333 HB2 LEU 58 HB2 LEU 58 86.433 6.119 0.651 334 HB3 LEU 58 HB1 LEU 58 85.767 4.926 1.760 335 HG LEU 58 HG LEU 58 88.036 4.508 -0.211 336 HD11 LEU 58 HD11 LEU 58 87.838 4.708 2.801 337 HD12 LEU 58 HD12 LEU 58 88.833 5.669 1.709 338 HD13 LEU 58 HD13 LEU 58 89.225 3.976 2.002 339 HD21 LEU 58 HD21 LEU 58 86.983 2.405 -0.196 340 HD22 LEU 58 HD22 LEU 58 86.450 2.574 1.479 341 HD23 LEU 58 HD23 LEU 58 88.147 2.250 1.119 342 H LYS 59 HN LYS 59 84.983 7.042 -0.821 343 HA LYS 59 HA LYS 59 82.074 7.154 -0.564 344 HB2 LYS 59 HB2 LYS 59 83.774 9.251 0.792 345 HB3 LYS 59 HB1 LYS 59 82.062 8.919 1.005 346 HG2 LYS 59 HG2 LYS 59 82.551 6.836 2.153 347 HG3 LYS 59 HG1 LYS 59 84.274 7.027 1.841 348 HD2 LYS 59 HD2 LYS 59 82.628 9.033 3.405 349 HD3 LYS 59 HD1 LYS 59 83.556 7.738 4.156 350 HE2 LYS 59 HE2 LYS 59 85.521 8.779 2.639 351 HE3 LYS 59 HE1 LYS 59 84.525 10.224 2.802 352 HZ1 LYS 59 HZ1 LYS 59 84.583 9.155 5.310 353 HZ2 LYS 59 HZ2 LYS 59 85.502 10.477 4.762 354 HZ3 LYS 59 HZ3 LYS 59 86.162 8.911 4.741 355 HA PRO 60 HA PRO 60 82.513 9.800 -4.114 356 HB2 PRO 60 HB2 PRO 60 80.835 11.887 -2.776 357 HB3 PRO 60 HB1 PRO 60 80.605 11.098 -4.349 358 HG2 PRO 60 HG2 PRO 60 79.090 10.485 -2.223 359 HG3 PRO 60 HG1 PRO 60 79.550 9.271 -3.430 360 HD2 PRO 60 HD2 PRO 60 80.598 9.658 -0.654 361 HD3 PRO 60 HD1 PRO 60 80.414 8.166 -1.603 362 H GLY 61 HN GLY 61 84.363 10.892 -4.502 363 HA2 GLY 61 HA2 GLY 61 85.800 12.754 -4.427 364 HA3 GLY 61 HA1 GLY 61 85.034 13.270 -2.930 365 H VAL 62 HN VAL 62 85.475 10.164 -2.262 366 HA VAL 62 HA VAL 62 88.296 10.460 -1.369 367 HB VAL 62 HB VAL 62 86.016 9.158 0.141 368 HG11 VAL 62 HG11 VAL 62 88.949 9.568 0.770 369 HG12 VAL 62 HG12 VAL 62 88.105 8.030 0.590 370 HG13 VAL 62 HG13 VAL 62 87.751 9.077 1.965 371 HG21 VAL 62 HG21 VAL 62 87.502 11.771 0.539 372 HG22 VAL 62 HG22 VAL 62 86.479 11.029 1.773 373 HG23 VAL 62 HG23 VAL 62 85.772 11.562 0.248 374 H ILE 63 HN ILE 63 89.603 8.806 -1.913 375 HA ILE 63 HA ILE 63 88.397 6.212 -2.691 376 HB ILE 63 HB ILE 63 89.830 6.111 -4.634 377 HG12 ILE 63 HG12 ILE 63 90.893 8.647 -5.053 378 HG13 ILE 63 HG11 ILE 63 91.096 8.468 -3.314 379 HG21 ILE 63 HG21 ILE 63 87.580 7.335 -4.660 380 HG22 ILE 63 HG22 ILE 63 88.676 7.693 -5.993 381 HG23 ILE 63 HG23 ILE 63 88.511 8.831 -4.655 382 HD11 ILE 63 HD11 ILE 63 92.320 6.881 -5.542 383 HD12 ILE 63 HD12 ILE 63 92.062 6.090 -3.987 384 HD13 ILE 63 HD13 ILE 63 93.071 7.531 -4.088 385 H GLN 64 HN GLN 64 89.987 4.488 -2.870 386 HA GLN 64 HA GLN 64 92.364 4.780 -1.129 387 HB2 GLN 64 HB2 GLN 64 90.433 3.689 0.072 388 HB3 GLN 64 HB1 GLN 64 90.502 2.391 -1.115 389 HG2 GLN 64 HG2 GLN 64 92.852 1.956 -0.498 390 HG3 GLN 64 HG1 GLN 64 92.774 3.250 0.697 391 HE21 GLN 64 HE21 GLN 64 93.377 0.676 1.600 392 HE22 GLN 64 HE22 GLN 64 92.059 0.043 2.459 393 H ILE 65 HN ILE 65 94.131 3.548 -1.778 394 HA ILE 65 HA ILE 65 93.851 2.095 -4.351 395 HB ILE 65 HB ILE 65 96.408 2.866 -4.491 396 HG12 ILE 65 HG12 ILE 65 95.093 4.987 -2.746 397 HG13 ILE 65 HG11 ILE 65 96.436 3.951 -2.280 398 HG21 ILE 65 HG21 ILE 65 94.563 3.436 -6.089 399 HG22 ILE 65 HG22 ILE 65 95.693 4.767 -5.848 400 HG23 ILE 65 HG23 ILE 65 94.123 4.788 -5.044 401 HD11 ILE 65 HD11 ILE 65 97.596 5.842 -2.917 402 HD12 ILE 65 HD12 ILE 65 96.381 6.313 -4.102 403 HD13 ILE 65 HD13 ILE 65 97.524 5.025 -4.481 404 H LEU 66 HN LEU 66 94.369 0.050 -4.311 405 HA LEU 66 HA LEU 66 96.127 -0.989 -2.158 406 HB2 LEU 66 HB2 LEU 66 93.779 -1.474 -1.699 407 HB3 LEU 66 HB1 LEU 66 93.566 -2.139 -3.303 408 HG LEU 66 HG LEU 66 93.862 -3.759 -1.291 409 HD11 LEU 66 HD11 LEU 66 95.772 -4.371 -3.528 410 HD12 LEU 66 HD12 LEU 66 94.041 -4.291 -3.829 411 HD13 LEU 66 HD13 LEU 66 94.683 -5.447 -2.670 412 HD21 LEU 66 HD21 LEU 66 96.791 -3.248 -1.806 413 HD22 LEU 66 HD22 LEU 66 96.064 -4.269 -0.572 414 HD23 LEU 66 HD23 LEU 66 95.916 -2.519 -0.460 415 H GLY 67 HN GLY 67 97.905 -1.919 -2.951 416 HA2 GLY 67 HA2 GLY 67 98.208 -2.544 -5.750 417 HA3 GLY 67 HA1 GLY 67 99.409 -2.790 -4.493 418 H VAL 68 HN VAL 68 97.753 -4.425 -6.724 419 HA VAL 68 HA VAL 68 96.604 -6.586 -5.301 420 HB VAL 68 HB VAL 68 96.439 -7.677 -7.428 421 HG11 VAL 68 HG11 VAL 68 95.334 -5.902 -8.704 422 HG12 VAL 68 HG12 VAL 68 96.186 -4.671 -7.766 423 HG13 VAL 68 HG13 VAL 68 94.991 -5.709 -6.986 424 HG21 VAL 68 HG21 VAL 68 98.630 -7.434 -8.344 425 HG22 VAL 68 HG22 VAL 68 98.557 -5.676 -8.237 426 HG23 VAL 68 HG23 VAL 68 97.569 -6.528 -9.424 427 H LYS 69 HN LYS 69 99.819 -6.239 -6.806 428 HA LYS 69 HA LYS 69 100.627 -8.898 -6.356 429 HB2 LYS 69 HB2 LYS 69 101.744 -7.281 -7.897 430 HB3 LYS 69 HB1 LYS 69 102.411 -6.463 -6.488 431 HG2 LYS 69 HG2 LYS 69 102.869 -9.418 -6.602 432 HG3 LYS 69 HG1 LYS 69 103.716 -8.467 -7.814 433 HD2 LYS 69 HD2 LYS 69 104.655 -7.036 -6.010 434 HD3 LYS 69 HD1 LYS 69 103.848 -8.047 -4.814 435 HE2 LYS 69 HE2 LYS 69 105.107 -9.996 -5.526 436 HE3 LYS 69 HE1 LYS 69 105.843 -9.081 -6.844 437 HZ1 LYS 69 HZ1 LYS 69 107.457 -8.673 -5.377 438 HZ2 LYS 69 HZ2 LYS 69 106.507 -9.132 -4.044 439 HZ3 LYS 69 HZ3 LYS 69 106.383 -7.561 -4.679 440 H THR 70 HN THR 70 101.062 -5.991 -4.363 441 HA THR 70 HA THR 70 102.324 -7.607 -2.254 442 HB THR 70 HB THR 70 102.882 -5.504 -1.218 443 HG1 THR 70 HG1 THR 70 101.104 -4.477 -3.158 444 HG21 THR 70 HG21 THR 70 103.258 -5.122 -4.194 445 HG22 THR 70 HG22 THR 70 104.154 -6.327 -3.269 446 HG23 THR 70 HG23 THR 70 104.333 -4.616 -2.890 447 H SER 71 HN SER 71 99.229 -6.325 -3.048 448 HA SER 71 HA SER 71 97.250 -6.206 -1.864 449 HB2 SER 71 HB2 SER 71 97.364 -8.534 -1.495 450 HB3 SER 71 HB1 SER 71 98.722 -8.382 -0.388 451 HG SER 71 HG SER 71 96.546 -6.934 0.388 452 H ARG 72 HN ARG 72 99.514 -4.429 -1.219 453 HA ARG 72 HA ARG 72 99.078 -3.875 1.644 454 HB2 ARG 72 HB2 ARG 72 101.178 -2.974 -0.332 455 HB3 ARG 72 HB1 ARG 72 100.997 -2.252 1.264 456 HG2 ARG 72 HG2 ARG 72 101.290 -4.469 2.296 457 HG3 ARG 72 HG1 ARG 72 101.478 -5.186 0.704 458 HD2 ARG 72 HD2 ARG 72 103.467 -3.791 0.305 459 HD3 ARG 72 HD1 ARG 72 103.277 -3.068 1.898 460 HE ARG 72 HE ARG 72 104.213 -5.781 1.315 461 HH11 ARG 72 HH11 ARG 72 105.110 -6.870 3.091 462 HH12 ARG 72 HH12 ARG 72 104.954 -6.202 4.682 463 HH21 ARG 72 HH21 ARG 72 103.166 -3.424 3.635 464 HH22 ARG 72 HH22 ARG 72 103.841 -4.263 4.990 465 H PHE 73 HN PHE 73 98.229 -1.949 2.341 466 HA PHE 73 HA PHE 73 96.783 -0.384 0.311 467 HB2 PHE 73 HB2 PHE 73 96.691 -0.281 3.342 468 HB3 PHE 73 HB1 PHE 73 95.647 0.627 2.249 469 HD1 PHE 73 HD1 PHE 73 96.214 -2.563 3.881 470 HD2 PHE 73 HD2 PHE 73 94.150 -0.638 0.638 471 HE1 PHE 73 HE1 PHE 73 94.669 -4.494 3.714 472 HE2 PHE 73 HE2 PHE 73 92.610 -2.571 0.471 473 HZ PHE 73 HZ PHE 73 92.864 -4.499 2.011 474 H LEU 74 HN LEU 74 97.948 1.159 -0.611 475 HA LEU 74 HA LEU 74 100.237 2.365 0.542 476 HB2 LEU 74 HB2 LEU 74 100.129 2.339 -1.820 477 HB3 LEU 74 HB1 LEU 74 98.507 3.008 -1.838 478 HG LEU 74 HG LEU 74 99.310 5.181 -1.154 479 HD11 LEU 74 HD11 LEU 74 101.010 4.781 0.436 480 HD12 LEU 74 HD12 LEU 74 101.898 5.422 -0.939 481 HD13 LEU 74 HD13 LEU 74 101.882 3.686 -0.637 482 HD21 LEU 74 HD21 LEU 74 100.716 5.747 -3.048 483 HD22 LEU 74 HD22 LEU 74 99.580 4.500 -3.559 484 HD23 LEU 74 HD23 LEU 74 101.252 4.074 -3.204 485 H CYS 75 HN CYS 75 100.113 3.555 2.339 486 HA CYS 75 HA CYS 75 98.061 5.692 2.466 487 HB2 CYS 75 HB2 CYS 75 99.366 4.433 4.876 488 HB3 CYS 75 HB1 CYS 75 97.975 5.510 4.833 489 H GLN 76 HN GLN 76 98.763 7.646 3.580 490 HA GLN 76 HA GLN 76 101.617 8.179 3.040 491 HB2 GLN 76 HB2 GLN 76 100.073 9.543 1.770 492 HB3 GLN 76 HB1 GLN 76 99.247 10.048 3.244 493 HG2 GLN 76 HG2 GLN 76 101.162 11.251 4.015 494 HG3 GLN 76 HG1 GLN 76 102.199 10.524 2.795 495 HE21 GLN 76 HE21 GLN 76 102.476 11.705 0.906 496 HE22 GLN 76 HE22 GLN 76 101.488 12.996 0.418 497 H ARG 77 HN ARG 77 102.950 8.861 4.465 498 HA ARG 77 HA ARG 77 102.436 8.629 7.264 499 HB2 ARG 77 HB2 ARG 77 104.545 7.996 6.025 500 HB3 ARG 77 HB1 ARG 77 104.860 9.714 5.812 501 HG2 ARG 77 HG2 ARG 77 105.015 10.043 8.200 502 HG3 ARG 77 HG1 ARG 77 104.491 8.382 8.502 503 HD2 ARG 77 HD2 ARG 77 106.492 7.471 7.603 504 HD3 ARG 77 HD1 ARG 77 106.954 9.005 6.870 505 HE ARG 77 HE ARG 77 106.764 9.409 9.640 506 HH11 ARG 77 HH11 ARG 77 108.648 9.401 10.902 507 HH12 ARG 77 HH12 ARG 77 110.071 8.601 10.323 508 HH21 ARG 77 HH21 ARG 77 108.625 7.634 7.323 509 HH22 ARG 77 HH22 ARG 77 110.058 7.601 8.295 510 HA PRO 78 HA PRO 78 101.204 12.882 8.047 511 HB2 PRO 78 HB2 PRO 78 103.133 12.753 10.345 512 HB3 PRO 78 HB1 PRO 78 101.452 13.326 10.317 513 HG2 PRO 78 HG2 PRO 78 102.049 10.952 11.325 514 HG3 PRO 78 HG1 PRO 78 100.583 11.182 10.354 515 HD2 PRO 78 HD2 PRO 78 103.147 9.841 9.597 516 HD3 PRO 78 HD1 PRO 78 101.485 9.472 9.088 517 H ASP 79 HN ASP 79 104.591 11.938 8.058 518 HA ASP 79 HA ASP 79 105.645 14.588 7.706 519 HB2 ASP 79 HB2 ASP 79 107.022 12.791 8.670 520 HB3 ASP 79 HB1 ASP 79 106.913 11.894 7.156 521 H GLY 80 HN GLY 80 103.826 12.689 5.739 522 HA2 GLY 80 HA2 GLY 80 103.154 13.207 3.555 523 HA3 GLY 80 HA1 GLY 80 104.605 14.180 3.354 524 H ALA 81 HN ALA 81 105.265 11.110 4.694 525 HA ALA 81 HA ALA 81 106.544 10.269 2.208 526 HB1 ALA 81 HB1 ALA 81 106.570 8.508 4.623 527 HB2 ALA 81 HB2 ALA 81 107.378 10.069 4.753 528 HB3 ALA 81 HB3 ALA 81 107.880 8.921 3.512 529 H LEU 82 HN LEU 82 106.257 8.056 1.393 530 HA LEU 82 HA LEU 82 103.446 7.125 1.681 531 HB2 LEU 82 HB2 LEU 82 105.261 7.430 -0.682 532 HB3 LEU 82 HB1 LEU 82 104.110 6.098 -0.705 533 HG LEU 82 HG LEU 82 102.256 7.649 -0.348 534 HD11 LEU 82 HD11 LEU 82 102.903 10.174 -0.576 535 HD12 LEU 82 HD12 LEU 82 104.489 9.639 -0.014 536 HD13 LEU 82 HD13 LEU 82 103.059 9.376 0.986 537 HD21 LEU 82 HD21 LEU 82 103.354 7.230 -2.675 538 HD22 LEU 82 HD22 LEU 82 103.938 8.888 -2.526 539 HD23 LEU 82 HD23 LEU 82 102.207 8.561 -2.519 540 H TYR 83 HN TYR 83 103.049 5.044 2.180 541 HA TYR 83 HA TYR 83 105.104 3.006 1.845 542 HB2 TYR 83 HB2 TYR 83 105.135 2.349 4.196 543 HB3 TYR 83 HB1 TYR 83 105.674 4.021 4.027 544 HD1 TYR 83 HD1 TYR 83 103.107 1.805 5.370 545 HD2 TYR 83 HD2 TYR 83 104.111 5.898 4.539 546 HE1 TYR 83 HE1 TYR 83 101.294 2.560 6.889 547 HE2 TYR 83 HE2 TYR 83 102.297 6.648 6.048 548 HH TYR 83 HH TYR 83 99.834 4.881 7.004 549 H GLY 84 HN GLY 84 104.327 0.889 2.039 550 HA2 GLY 84 HA2 GLY 84 101.435 0.613 1.654 551 HA3 GLY 84 HA1 GLY 84 102.663 -0.611 1.341 552 H SER 85 HN SER 85 100.102 -0.545 3.073 553 HA SER 85 HA SER 85 101.362 -1.779 5.455 554 HB2 SER 85 HB2 SER 85 100.686 0.441 6.146 555 HB3 SER 85 HB1 SER 85 99.080 0.207 5.474 556 HG SER 85 HG SER 85 98.583 -1.113 7.083 557 H LEU 86 HN LEU 86 100.305 -3.533 6.291 558 HA LEU 86 HA LEU 86 98.553 -4.971 4.582 559 HB2 LEU 86 HB2 LEU 86 99.556 -5.365 7.390 560 HB3 LEU 86 HB1 LEU 86 98.289 -6.415 6.761 561 HG LEU 86 HG LEU 86 100.602 -7.329 6.454 562 HD11 LEU 86 HD11 LEU 86 99.613 -6.785 3.672 563 HD12 LEU 86 HD12 LEU 86 98.529 -7.619 4.786 564 HD13 LEU 86 HD13 LEU 86 100.109 -8.302 4.419 565 HD21 LEU 86 HD21 LEU 86 101.630 -5.063 6.080 566 HD22 LEU 86 HD22 LEU 86 100.920 -5.069 4.469 567 HD23 LEU 86 HD23 LEU 86 102.124 -6.279 4.902 568 H HIS 87 HN HIS 87 98.053 -3.048 7.496 569 HA HIS 87 HA HIS 87 95.164 -3.560 7.437 570 HB2 HIS 87 HB2 HIS 87 96.534 -3.572 9.578 571 HB3 HIS 87 HB1 HIS 87 96.690 -1.826 9.381 572 HD2 HIS 87 HD2 HIS 87 93.736 -4.444 9.850 573 HE1 HIS 87 HE1 HIS 87 92.368 -0.619 10.999 574 HE2 HIS 87 HE2 HIS 87 91.762 -3.082 10.882 575 H PHE 88 HN PHE 88 93.707 -2.193 6.725 576 HA PHE 88 HA PHE 88 94.463 0.146 5.270 577 HB2 PHE 88 HB2 PHE 88 92.630 -1.056 4.401 578 HB3 PHE 88 HB1 PHE 88 91.865 -1.197 5.977 579 HD1 PHE 88 HD1 PHE 88 93.275 1.851 4.271 580 HD2 PHE 88 HD2 PHE 88 89.777 -0.166 5.744 581 HE1 PHE 88 HE1 PHE 88 91.910 3.867 3.806 582 HE2 PHE 88 HE2 PHE 88 88.418 1.846 5.275 583 HZ PHE 88 HZ PHE 88 89.481 3.862 4.309 584 H ASP 89 HN ASP 89 94.517 2.214 5.915 585 HA ASP 89 HA ASP 89 93.399 2.940 8.571 586 HB2 ASP 89 HB2 ASP 89 95.830 2.784 8.680 587 HB3 ASP 89 HB1 ASP 89 95.980 3.864 7.296 588 HA PRO 90 HA PRO 90 91.219 5.548 5.438 589 HB2 PRO 90 HB2 PRO 90 89.844 6.406 7.958 590 HB3 PRO 90 HB1 PRO 90 89.142 5.929 6.399 591 HG2 PRO 90 HG2 PRO 90 89.102 4.306 8.523 592 HG3 PRO 90 HG1 PRO 90 89.284 3.684 6.879 593 HD2 PRO 90 HD2 PRO 90 91.334 3.934 9.034 594 HD3 PRO 90 HD1 PRO 90 91.225 2.744 7.718 595 H GLU 91 HN GLU 91 92.256 6.601 8.650 596 HA GLU 91 HA GLU 91 92.313 9.361 8.183 597 HB2 GLU 91 HB2 GLU 91 93.840 7.599 10.090 598 HB3 GLU 91 HB1 GLU 91 94.023 9.354 10.086 599 HG2 GLU 91 HG2 GLU 91 91.625 9.637 10.470 600 HG3 GLU 91 HG1 GLU 91 91.386 7.890 10.394 601 H ALA 92 HN ALA 92 94.461 6.954 6.941 602 HA ALA 92 HA ALA 92 96.341 9.099 6.090 603 HB1 ALA 92 HB1 ALA 92 97.013 6.254 6.864 604 HB2 ALA 92 HB2 ALA 92 97.379 7.701 7.803 605 HB3 ALA 92 HB3 ALA 92 98.155 7.444 6.240 606 H CYS 93 HN CYS 93 94.620 6.164 5.205 607 HA CYS 93 HA CYS 93 95.840 6.180 2.544 608 HB2 CYS 93 HB2 CYS 93 94.548 4.174 4.206 609 HB3 CYS 93 HB1 CYS 93 93.883 4.170 2.575 610 H SER 94 HN SER 94 93.109 7.574 4.000 611 HA SER 94 HA SER 94 91.461 7.502 1.611 612 HB2 SER 94 HB2 SER 94 91.170 9.365 3.977 613 HB3 SER 94 HB1 SER 94 89.931 8.891 2.818 614 HG SER 94 HG SER 94 91.295 6.967 4.355 615 H PHE 95 HN PHE 95 91.566 8.906 -0.048 616 HA PHE 95 HA PHE 95 93.148 11.395 0.293 617 HB2 PHE 95 HB2 PHE 95 93.222 9.560 -2.109 618 HB3 PHE 95 HB1 PHE 95 94.117 11.057 -1.893 619 HD1 PHE 95 HD1 PHE 95 93.921 7.510 -1.051 620 HD2 PHE 95 HD2 PHE 95 95.977 11.192 -0.238 621 HE1 PHE 95 HE1 PHE 95 95.780 6.240 -0.026 622 HE2 PHE 95 HE2 PHE 95 97.840 9.920 0.799 623 HZ PHE 95 HZ PHE 95 97.747 7.439 0.900 624 H ARG 96 HN ARG 96 92.523 13.134 -0.950 625 HA ARG 96 HA ARG 96 89.780 13.102 -1.921 626 HB2 ARG 96 HB2 ARG 96 90.629 14.975 -0.527 627 HB3 ARG 96 HB1 ARG 96 91.786 15.370 -1.796 628 HG2 ARG 96 HG2 ARG 96 89.940 15.770 -3.374 629 HG3 ARG 96 HG1 ARG 96 88.771 15.339 -2.126 630 HD2 ARG 96 HD2 ARG 96 89.735 17.187 -0.704 631 HD3 ARG 96 HD1 ARG 96 90.688 17.682 -2.100 632 HE ARG 96 HE ARG 96 88.023 17.540 -2.934 633 HH11 ARG 96 HH11 ARG 96 86.750 19.425 -2.999 634 HH12 ARG 96 HH12 ARG 96 87.196 20.796 -2.038 635 HH21 ARG 96 HH21 ARG 96 89.989 19.265 -0.669 636 HH22 ARG 96 HH22 ARG 96 89.034 20.709 -0.728 637 H GLU 97 HN GLU 97 89.192 13.315 -4.066 638 HA GLU 97 HA GLU 97 91.281 12.720 -6.030 639 HB2 GLU 97 HB2 GLU 97 89.191 11.415 -6.008 640 HB3 GLU 97 HB1 GLU 97 88.268 12.884 -6.317 641 HG2 GLU 97 HG2 GLU 97 89.436 13.192 -8.452 642 HG3 GLU 97 HG1 GLU 97 90.414 11.762 -8.137 643 H LEU 98 HN LEU 98 92.206 14.213 -7.262 644 HA LEU 98 HA LEU 98 90.839 16.828 -7.655 645 HB2 LEU 98 HB2 LEU 98 93.813 16.287 -7.745 646 HB3 LEU 98 HB1 LEU 98 93.004 17.854 -7.712 647 HG LEU 98 HG LEU 98 92.956 15.787 -5.495 648 HD11 LEU 98 HD11 LEU 98 94.344 18.469 -5.744 649 HD12 LEU 98 HD12 LEU 98 95.118 16.886 -5.662 650 HD13 LEU 98 HD13 LEU 98 94.256 17.518 -4.260 651 HD21 LEU 98 HD21 LEU 98 91.943 17.833 -4.252 652 HD22 LEU 98 HD22 LEU 98 90.895 16.931 -5.342 653 HD23 LEU 98 HD23 LEU 98 91.600 18.461 -5.865 654 H LEU 99 HN LEU 99 90.055 16.958 -9.677 655 HA LEU 99 HA LEU 99 91.544 15.637 -11.876 656 HB2 LEU 99 HB2 LEU 99 88.723 15.866 -11.221 657 HB3 LEU 99 HB1 LEU 99 89.009 16.531 -12.821 658 HG LEU 99 HG LEU 99 88.454 14.090 -12.827 659 HD11 LEU 99 HD11 LEU 99 90.008 15.320 -14.531 660 HD12 LEU 99 HD12 LEU 99 89.933 13.560 -14.553 661 HD13 LEU 99 HD13 LEU 99 91.293 14.370 -13.783 662 HD21 LEU 99 HD21 LEU 99 89.666 12.492 -11.720 663 HD22 LEU 99 HD22 LEU 99 90.004 13.831 -10.629 664 HD23 LEU 99 HD23 LEU 99 91.187 13.370 -11.854 665 H LEU 100 HN LEU 100 92.602 16.775 -13.270 666 HA LEU 100 HA LEU 100 92.450 19.698 -13.231 667 HB2 LEU 100 HB2 LEU 100 94.331 17.697 -14.488 668 HB3 LEU 100 HB1 LEU 100 94.425 19.413 -14.848 669 HG LEU 100 HG LEU 100 95.954 18.429 -12.974 670 HD11 LEU 100 HD11 LEU 100 94.318 20.940 -12.730 671 HD12 LEU 100 HD12 LEU 100 95.968 20.744 -13.312 672 HD13 LEU 100 HD13 LEU 100 95.611 20.548 -11.598 673 HD21 LEU 100 HD21 LEU 100 95.001 18.338 -10.753 674 HD22 LEU 100 HD22 LEU 100 94.088 17.249 -11.790 675 HD23 LEU 100 HD23 LEU 100 93.419 18.820 -11.354 676 H GLU 101 HN GLU 101 91.955 20.939 -15.023 677 HA GLU 101 HA GLU 101 89.965 20.051 -16.767 678 HB2 GLU 101 HB2 GLU 101 90.699 22.103 -18.156 679 HB3 GLU 101 HB1 GLU 101 90.143 22.392 -16.510 680 HG2 GLU 101 HG2 GLU 101 93.078 21.882 -16.917 681 HG3 GLU 101 HG1 GLU 101 92.441 23.444 -17.420 682 H ASP 102 HN ASP 102 93.414 19.763 -16.907 683 HA ASP 102 HA ASP 102 93.556 19.194 -19.733 684 HB2 ASP 102 HB2 ASP 102 95.537 18.848 -17.481 685 HB3 ASP 102 HB1 ASP 102 95.902 18.536 -19.175 686 H GLY 103 HN GLY 103 92.524 17.462 -17.050 687 HA2 GLY 103 HA2 GLY 103 91.559 15.308 -17.195 688 HA3 GLY 103 HA1 GLY 103 92.594 14.946 -18.568 689 H TYR 104 HN TYR 104 94.385 16.418 -16.095 690 HA TYR 104 HA TYR 104 95.657 13.872 -15.441 691 HB2 TYR 104 HB2 TYR 104 96.336 16.575 -14.268 692 HB3 TYR 104 HB1 TYR 104 97.360 15.150 -14.358 693 HD1 TYR 104 HD1 TYR 104 97.365 18.232 -15.558 694 HD2 TYR 104 HD2 TYR 104 97.042 14.257 -17.162 695 HE1 TYR 104 HE1 TYR 104 98.261 19.028 -17.727 696 HE2 TYR 104 HE2 TYR 104 97.930 15.056 -19.325 697 HH TYR 104 HH TYR 104 98.664 18.500 -19.852 698 H ASN 105 HN ASN 105 95.925 13.123 -13.264 699 HA ASN 105 HA ASN 105 93.871 14.120 -11.378 700 HB2 ASN 105 HB2 ASN 105 93.058 12.078 -12.478 701 HB3 ASN 105 HB1 ASN 105 94.502 11.221 -11.938 702 HD21 ASN 105 HD21 ASN 105 91.349 11.452 -11.179 703 HD22 ASN 105 HD22 ASN 105 91.422 11.281 -9.494 704 H VAL 106 HN VAL 106 94.475 14.333 -9.328 705 HA VAL 106 HA VAL 106 97.061 13.178 -8.464 706 HB VAL 106 HB VAL 106 96.192 15.924 -7.572 707 HG11 VAL 106 HG11 VAL 106 98.907 14.612 -7.922 708 HG12 VAL 106 HG12 VAL 106 98.027 14.721 -6.397 709 HG13 VAL 106 HG13 VAL 106 98.595 16.189 -7.193 710 HG21 VAL 106 HG21 VAL 106 96.196 16.127 -9.978 711 HG22 VAL 106 HG22 VAL 106 97.692 15.201 -10.106 712 HG23 VAL 106 HG23 VAL 106 97.710 16.812 -9.387 713 H TYR 107 HN TYR 107 97.247 13.032 -6.112 714 HA TYR 107 HA TYR 107 94.605 12.745 -4.774 715 HB2 TYR 107 HB2 TYR 107 97.062 11.007 -4.494 716 HB3 TYR 107 HB1 TYR 107 95.550 10.790 -3.630 717 HD1 TYR 107 HD1 TYR 107 97.380 9.934 -6.558 718 HD2 TYR 107 HD2 TYR 107 93.391 10.568 -5.098 719 HE1 TYR 107 HE1 TYR 107 96.480 8.609 -8.449 720 HE2 TYR 107 HE2 TYR 107 92.487 9.249 -6.996 721 HH TYR 107 HH TYR 107 94.214 7.198 -8.791 722 H GLN 108 HN GLN 108 94.441 13.332 -2.656 723 HA GLN 108 HA GLN 108 96.810 14.331 -1.224 724 HB2 GLN 108 HB2 GLN 108 95.926 16.307 -2.337 725 HB3 GLN 108 HB1 GLN 108 94.303 15.951 -1.749 726 HG2 GLN 108 HG2 GLN 108 94.998 16.302 0.552 727 HG3 GLN 108 HG1 GLN 108 96.678 16.469 0.056 728 HE21 GLN 108 HE21 GLN 108 94.168 18.334 1.058 729 HE22 GLN 108 HE22 GLN 108 94.514 19.762 0.211 730 H SER 109 HN SER 109 96.778 13.678 0.855 731 HA SER 109 HA SER 109 94.747 12.021 1.895 732 HB2 SER 109 HB2 SER 109 96.672 13.601 3.597 733 HB3 SER 109 HB1 SER 109 95.999 12.002 3.903 734 HG SER 109 HG SER 109 98.090 11.784 3.123 735 H GLU 110 HN GLU 110 92.794 12.537 2.611 736 HA GLU 110 HA GLU 110 91.915 15.228 2.888 737 HB2 GLU 110 HB2 GLU 110 89.767 14.275 3.346 738 HB3 GLU 110 HB1 GLU 110 90.533 13.283 2.109 739 HG2 GLU 110 HG2 GLU 110 91.273 11.700 3.894 740 HG3 GLU 110 HG1 GLU 110 90.375 12.654 5.074 741 H ALA 111 HN ALA 111 92.797 12.729 5.229 742 HA ALA 111 HA ALA 111 91.706 13.851 7.527 743 HB1 ALA 111 HB1 ALA 111 94.361 12.439 7.530 744 HB2 ALA 111 HB2 ALA 111 92.856 11.581 7.201 745 HB3 ALA 111 HB3 ALA 111 93.087 12.393 8.750 746 H HIS 112 HN HIS 112 95.069 14.291 6.357 747 HA HIS 112 HA HIS 112 95.277 16.655 8.136 748 HB2 HIS 112 HB2 HIS 112 97.329 14.764 7.011 749 HB3 HIS 112 HB1 HIS 112 97.771 16.309 7.726 750 HD2 HIS 112 HD2 HIS 112 97.581 16.407 10.545 751 HE1 HIS 112 HE1 HIS 112 96.219 12.445 11.068 752 HE2 HIS 112 HE2 HIS 112 97.046 14.523 12.272 753 H GLY 113 HN GLY 113 94.725 15.932 4.925 754 HA2 GLY 113 HA2 GLY 113 94.668 17.350 3.082 755 HA3 GLY 113 HA1 GLY 113 95.219 18.643 4.136 756 H LEU 114 HN LEU 114 97.130 15.782 4.161 757 HA LEU 114 HA LEU 114 99.409 17.190 3.193 758 HB2 LEU 114 HB2 LEU 114 99.008 14.249 3.740 759 HB3 LEU 114 HB1 LEU 114 100.567 15.001 3.420 760 HG LEU 114 HG LEU 114 98.833 16.102 5.633 761 HD11 LEU 114 HD11 LEU 114 99.791 14.550 7.224 762 HD12 LEU 114 HD12 LEU 114 100.762 13.791 5.963 763 HD13 LEU 114 HD13 LEU 114 99.011 13.605 5.956 764 HD21 LEU 114 HD21 LEU 114 101.022 16.687 6.584 765 HD22 LEU 114 HD22 LEU 114 100.927 17.271 4.925 766 HD23 LEU 114 HD23 LEU 114 101.839 15.807 5.292 767 HA PRO 115 HA PRO 115 98.677 16.159 -1.117 768 HB2 PRO 115 HB2 PRO 115 100.982 17.061 -2.210 769 HB3 PRO 115 HB1 PRO 115 99.765 18.177 -1.555 770 HG2 PRO 115 HG2 PRO 115 102.274 17.168 -0.271 771 HG3 PRO 115 HG1 PRO 115 101.648 18.827 -0.354 772 HD2 PRO 115 HD2 PRO 115 101.299 17.250 1.847 773 HD3 PRO 115 HD1 PRO 115 100.106 18.477 1.358 774 H LEU 116 HN LEU 116 99.190 14.460 -2.533 775 HA LEU 116 HA LEU 116 101.050 12.444 -1.457 776 HB2 LEU 116 HB2 LEU 116 98.673 11.852 -2.082 777 HB3 LEU 116 HB1 LEU 116 99.106 12.149 -3.762 778 HG LEU 116 HG LEU 116 100.660 10.235 -1.995 779 HD11 LEU 116 HD11 LEU 116 98.171 9.630 -2.291 780 HD12 LEU 116 HD12 LEU 116 99.363 8.408 -2.723 781 HD13 LEU 116 HD13 LEU 116 98.576 9.350 -3.985 782 HD21 LEU 116 HD21 LEU 116 100.974 9.297 -4.519 783 HD22 LEU 116 HD22 LEU 116 102.034 10.509 -3.818 784 HD23 LEU 116 HD23 LEU 116 100.726 11.002 -4.889 785 H HIS 117 HN HIS 117 103.014 12.285 -2.249 786 HA HIS 117 HA HIS 117 103.518 12.722 -5.101 787 HB2 HIS 117 HB2 HIS 117 105.462 14.194 -4.571 788 HB3 HIS 117 HB1 HIS 117 103.908 14.935 -4.187 789 HD2 HIS 117 HD2 HIS 117 103.378 15.186 -1.373 790 HE1 HIS 117 HE1 HIS 117 107.249 14.026 -0.149 791 HE2 HIS 117 HE2 HIS 117 105.044 15.013 0.633 792 H LEU 118 HN LEU 118 105.354 11.682 -5.846 793 HA LEU 118 HA LEU 118 106.163 9.385 -4.395 794 HB2 LEU 118 HB2 LEU 118 105.997 9.677 -6.917 795 HB3 LEU 118 HB1 LEU 118 107.527 10.540 -6.817 796 HG LEU 118 HG LEU 118 108.572 8.546 -5.777 797 HD11 LEU 118 HD11 LEU 118 105.750 7.551 -5.901 798 HD12 LEU 118 HD12 LEU 118 107.005 7.234 -4.704 799 HD13 LEU 118 HD13 LEU 118 107.030 6.380 -6.243 800 HD21 LEU 118 HD21 LEU 118 108.839 8.728 -8.137 801 HD22 LEU 118 HD22 LEU 118 107.162 8.263 -8.441 802 HD23 LEU 118 HD23 LEU 118 108.318 7.066 -7.861 803 HA PRO 119 HA PRO 119 109.300 11.774 -2.078 804 HB2 PRO 119 HB2 PRO 119 110.250 9.098 -1.175 805 HB3 PRO 119 HB1 PRO 119 109.761 10.503 -0.210 806 HG2 PRO 119 HG2 PRO 119 108.230 8.305 -0.427 807 HG3 PRO 119 HG1 PRO 119 107.540 9.929 -0.255 808 HD2 PRO 119 HD2 PRO 119 107.721 8.206 -2.700 809 HD3 PRO 119 HD1 PRO 119 106.466 9.369 -2.215 810 H GLY 120 HN GLY 120 111.486 12.204 -2.354 811 HA2 GLY 120 HA2 GLY 120 113.068 10.450 -4.128 812 HA3 GLY 120 HA1 GLY 120 112.862 12.148 -4.552 813 H ASN 121 HN ASN 121 114.189 9.940 -2.136 814 HA ASN 121 HA ASN 121 115.586 12.097 -0.752 815 HB2 ASN 121 HB2 ASN 121 115.761 9.099 -0.360 816 HB3 ASN 121 HB1 ASN 121 116.411 10.331 0.717 817 HD21 ASN 121 HD21 ASN 121 113.471 11.441 -0.573 818 HD22 ASN 121 HD22 ASN 121 112.454 10.980 0.708 819 H LYS 122 HN LYS 122 117.037 12.924 -2.239 820 HA LYS 122 HA LYS 122 119.271 11.125 -3.015 821 HB2 LYS 122 HB2 LYS 122 118.252 13.480 -4.623 822 HB3 LYS 122 HB1 LYS 122 119.487 12.327 -5.102 823 HG2 LYS 122 HG2 LYS 122 116.630 11.509 -4.511 824 HG3 LYS 122 HG1 LYS 122 117.171 11.967 -6.120 825 HD2 LYS 122 HD2 LYS 122 118.324 9.688 -4.473 826 HD3 LYS 122 HD1 LYS 122 117.199 9.514 -5.808 827 HE2 LYS 122 HE2 LYS 122 119.165 9.193 -6.973 828 HE3 LYS 122 HE1 LYS 122 119.093 10.952 -7.079 829 HZ1 LYS 122 HZ1 LYS 122 120.333 10.775 -4.799 830 HZ2 LYS 122 HZ2 LYS 122 121.187 10.643 -6.262 831 HZ3 LYS 122 HZ3 LYS 122 120.777 9.248 -5.386 832 H SER 123 HN SER 123 121.302 11.894 -2.610 833 HA SER 123 HA SER 123 121.482 14.248 -0.920 834 HB2 SER 123 HB2 SER 123 123.308 13.199 -0.076 835 HB3 SER 123 HB1 SER 123 122.900 11.845 -1.120 836 HG SER 123 HG SER 123 124.971 12.448 -1.598 837 HA PRO 124 HA PRO 124 124.244 15.629 -4.690 838 HB2 PRO 124 HB2 PRO 124 122.905 14.202 -6.933 839 HB3 PRO 124 HB1 PRO 124 124.637 14.399 -6.602 840 HG2 PRO 124 HG2 PRO 124 123.384 12.048 -6.264 841 HG3 PRO 124 HG1 PRO 124 124.713 12.564 -5.209 842 HD2 PRO 124 HD2 PRO 124 121.760 12.583 -4.663 843 HD3 PRO 124 HD1 PRO 124 123.102 12.188 -3.574 844 H HIS 125 HN HIS 125 123.737 17.516 -5.820 845 HA HIS 125 HA HIS 125 121.146 18.607 -5.479 846 HB2 HIS 125 HB2 HIS 125 123.346 19.549 -7.335 847 HB3 HIS 125 HB1 HIS 125 121.980 20.505 -6.761 848 HD2 HIS 125 HD2 HIS 125 125.468 20.590 -5.884 849 HE1 HIS 125 HE1 HIS 125 123.643 20.549 -2.077 850 HE2 HIS 125 HE2 HIS 125 125.792 21.054 -3.334 851 H ARG 126 HN ARG 126 119.495 19.004 -6.956 852 HA ARG 126 HA ARG 126 119.670 17.551 -9.548 853 HB2 ARG 126 HB2 ARG 126 117.288 17.805 -7.694 854 HB3 ARG 126 HB1 ARG 126 117.275 17.027 -9.276 855 HG2 ARG 126 HG2 ARG 126 118.923 15.382 -8.509 856 HG3 ARG 126 HG1 ARG 126 119.020 16.186 -6.941 857 HD2 ARG 126 HD2 ARG 126 117.523 14.326 -6.676 858 HD3 ARG 126 HD1 ARG 126 116.536 15.784 -6.691 859 HE ARG 126 HE ARG 126 116.767 14.743 -9.324 860 HH11 ARG 126 HH11 ARG 126 115.033 13.544 -10.177 861 HH12 ARG 126 HH12 ARG 126 113.804 12.939 -9.118 862 HH21 ARG 126 HH21 ARG 126 115.260 14.230 -6.250 863 HH22 ARG 126 HH22 ARG 126 113.937 13.318 -6.897 864 H ASP 127 HN ASP 127 118.613 18.471 -11.301 865 HA ASP 127 HA ASP 127 118.641 21.229 -11.550 866 HB2 ASP 127 HB2 ASP 127 117.859 20.878 -13.716 867 HB3 ASP 127 HB1 ASP 127 118.478 19.286 -13.321 868 HA PRO 128 HA PRO 128 114.919 22.886 -9.863 869 HB2 PRO 128 HB2 PRO 128 113.797 23.725 -12.499 870 HB3 PRO 128 HB1 PRO 128 114.202 24.713 -11.081 871 HG2 PRO 128 HG2 PRO 128 115.714 24.758 -13.275 872 HG3 PRO 128 HG1 PRO 128 116.434 24.861 -11.658 873 HD2 PRO 128 HD2 PRO 128 116.295 22.507 -13.516 874 HD3 PRO 128 HD1 PRO 128 117.635 23.035 -12.470 875 H ALA 129 HN ALA 129 112.833 22.327 -9.318 876 HA ALA 129 HA ALA 129 111.486 20.254 -10.956 877 HB1 ALA 129 HB1 ALA 129 110.747 19.243 -8.794 878 HB2 ALA 129 HB2 ALA 129 111.850 20.335 -7.956 879 HB3 ALA 129 HB3 ALA 129 112.483 19.129 -9.079 880 HA PRO 130 HA PRO 130 108.484 23.620 -10.041 881 HB2 PRO 130 HB2 PRO 130 107.196 23.656 -12.434 882 HB3 PRO 130 HB1 PRO 130 108.753 24.472 -12.180 883 HG2 PRO 130 HG2 PRO 130 108.177 21.866 -13.509 884 HG3 PRO 130 HG1 PRO 130 109.360 23.114 -13.939 885 HD2 PRO 130 HD2 PRO 130 109.973 20.776 -12.559 886 HD3 PRO 130 HD1 PRO 130 110.968 22.249 -12.518 887 H ARG 131 HN ARG 131 106.164 23.561 -9.730 888 HA ARG 131 HA ARG 131 104.157 22.560 -9.231 889 HB2 ARG 131 HB2 ARG 131 104.585 21.624 -11.645 890 HB3 ARG 131 HB1 ARG 131 104.944 20.118 -10.809 891 HG2 ARG 131 HG2 ARG 131 102.658 19.860 -11.150 892 HG3 ARG 131 HG1 ARG 131 102.648 20.628 -9.565 893 HD2 ARG 131 HD2 ARG 131 102.330 22.837 -10.659 894 HD3 ARG 131 HD1 ARG 131 102.298 22.038 -12.230 895 HE ARG 131 HE ARG 131 100.374 20.818 -10.576 896 HH11 ARG 131 HH11 ARG 131 98.194 21.358 -10.857 897 HH12 ARG 131 HH12 ARG 131 97.767 22.860 -11.607 898 HH21 ARG 131 HH21 ARG 131 101.054 23.852 -12.097 899 HH22 ARG 131 HH22 ARG 131 99.387 24.273 -12.309 900 H GLY 132 HN GLY 132 104.820 22.385 -7.060 901 HA2 GLY 132 HA2 GLY 132 106.403 20.712 -5.708 902 HA3 GLY 132 HA1 GLY 132 104.794 21.096 -5.114 903 HA PRO 133 HA PRO 133 103.640 16.879 -5.472 904 HB2 PRO 133 HB2 PRO 133 101.044 17.002 -6.374 905 HB3 PRO 133 HB1 PRO 133 101.521 17.454 -4.725 906 HG2 PRO 133 HG2 PRO 133 100.995 19.208 -7.087 907 HG3 PRO 133 HG1 PRO 133 100.526 19.432 -5.391 908 HD2 PRO 133 HD2 PRO 133 102.663 20.723 -6.499 909 HD3 PRO 133 HD1 PRO 133 102.615 20.262 -4.783 910 H ALA 134 HN ALA 134 103.526 15.142 -6.934 911 HA ALA 134 HA ALA 134 104.158 15.813 -9.708 912 HB1 ALA 134 HB1 ALA 134 105.551 14.146 -8.661 913 HB2 ALA 134 HB2 ALA 134 104.572 13.354 -9.896 914 HB3 ALA 134 HB3 ALA 134 104.140 13.195 -8.194 915 H ARG 135 HN ARG 135 102.818 15.533 -11.407 916 HA ARG 135 HA ARG 135 100.035 14.911 -10.903 917 HB2 ARG 135 HB2 ARG 135 101.464 15.342 -13.543 918 HB3 ARG 135 HB1 ARG 135 99.723 15.385 -13.270 919 HG2 ARG 135 HG2 ARG 135 100.054 17.298 -11.701 920 HG3 ARG 135 HG1 ARG 135 101.771 17.294 -12.106 921 HD2 ARG 135 HD2 ARG 135 99.502 17.683 -14.079 922 HD3 ARG 135 HD1 ARG 135 100.532 18.963 -13.446 923 HE ARG 135 HE ARG 135 101.200 17.123 -15.541 924 HH11 ARG 135 HH11 ARG 135 103.286 17.297 -16.415 925 HH12 ARG 135 HH12 ARG 135 104.520 18.136 -15.537 926 HH21 ARG 135 HH21 ARG 135 102.458 18.926 -12.866 927 HH22 ARG 135 HH22 ARG 135 104.048 19.072 -13.537 928 H PHE 136 HN PHE 136 99.081 12.969 -11.155 929 HA PHE 136 HA PHE 136 100.651 10.795 -12.427 930 HB2 PHE 136 HB2 PHE 136 99.045 10.935 -9.926 931 HB3 PHE 136 HB1 PHE 136 98.847 9.458 -10.872 932 HD1 PHE 136 HD1 PHE 136 100.970 11.224 -8.555 933 HD2 PHE 136 HD2 PHE 136 100.972 8.253 -11.655 934 HE1 PHE 136 HE1 PHE 136 103.166 10.369 -7.745 935 HE2 PHE 136 HE2 PHE 136 103.154 7.407 -10.852 936 HZ PHE 136 HZ PHE 136 104.250 8.460 -8.893 937 H LEU 137 HN LEU 137 99.829 9.671 -13.996 938 HA LEU 137 HA LEU 137 97.083 10.260 -14.936 939 HB2 LEU 137 HB2 LEU 137 99.717 10.012 -16.281 940 HB3 LEU 137 HB1 LEU 137 98.393 9.204 -17.115 941 HG LEU 137 HG LEU 137 98.041 12.044 -16.145 942 HD11 LEU 137 HD11 LEU 137 99.418 11.125 -18.686 943 HD12 LEU 137 HD12 LEU 137 100.089 12.166 -17.430 944 HD13 LEU 137 HD13 LEU 137 98.781 12.754 -18.458 945 HD21 LEU 137 HD21 LEU 137 96.966 10.575 -18.575 946 HD22 LEU 137 HD22 LEU 137 96.410 12.123 -17.940 947 HD23 LEU 137 HD23 LEU 137 96.126 10.642 -17.027 948 HA PRO 138 HA PRO 138 96.949 5.823 -13.599 949 HB2 PRO 138 HB2 PRO 138 94.036 6.377 -14.023 950 HB3 PRO 138 HB1 PRO 138 94.841 5.596 -12.646 951 HG2 PRO 138 HG2 PRO 138 93.905 8.078 -12.457 952 HG3 PRO 138 HG1 PRO 138 95.435 7.619 -11.685 953 HD2 PRO 138 HD2 PRO 138 94.994 9.177 -14.216 954 HD3 PRO 138 HD1 PRO 138 96.223 9.406 -12.950 955 H LEU 139 HN LEU 139 97.208 4.200 -15.114 956 HA LEU 139 HA LEU 139 96.090 4.628 -17.816 957 HB2 LEU 139 HB2 LEU 139 98.009 2.412 -17.157 958 HB3 LEU 139 HB1 LEU 139 97.780 3.272 -18.675 959 HG LEU 139 HG LEU 139 98.988 4.458 -16.157 960 HD11 LEU 139 HD11 LEU 139 100.211 3.561 -18.784 961 HD12 LEU 139 HD12 LEU 139 100.512 2.863 -17.192 962 HD13 LEU 139 HD13 LEU 139 101.064 4.498 -17.557 963 HD21 LEU 139 HD21 LEU 139 99.577 6.310 -17.755 964 HD22 LEU 139 HD22 LEU 139 97.847 6.157 -17.450 965 HD23 LEU 139 HD23 LEU 139 98.536 5.537 -18.949 966 HA PRO 140 HA PRO 140 92.879 1.601 -16.908 967 HB2 PRO 140 HB2 PRO 140 93.380 0.625 -19.698 968 HB3 PRO 140 HB1 PRO 140 91.848 1.067 -18.920 969 HG2 PRO 140 HG2 PRO 140 93.075 2.670 -20.703 970 HG3 PRO 140 HG1 PRO 140 92.122 3.304 -19.351 971 HD2 PRO 140 HD2 PRO 140 95.077 3.315 -19.718 972 HD3 PRO 140 HD1 PRO 140 94.051 4.383 -18.735 973 H GLY 141 HN GLY 141 93.258 -0.231 -15.744 974 HA2 GLY 141 HA2 GLY 141 95.694 -1.721 -16.103 975 HA3 GLY 141 HA1 GLY 141 94.442 -2.052 -14.911 Start of MODEL 6 1 H1 GLY 13 HT1 GLY 13 81.848 0.989 -1.742 2 H2 GLY 13 HT2 GLY 13 81.978 -0.223 -2.928 3 H3 GLY 13 HT3 GLY 13 80.448 0.283 -2.391 4 HA2 GLY 13 HA2 GLY 13 80.370 1.969 -3.810 5 HA3 GLY 13 HA1 GLY 13 82.008 2.465 -3.379 6 H GLN 14 HN GLN 14 82.470 2.857 -5.607 7 HA GLN 14 HA GLN 14 82.533 0.526 -7.402 8 HB2 GLN 14 HB2 GLN 14 83.056 3.461 -7.923 9 HB3 GLN 14 HB1 GLN 14 83.052 2.192 -9.149 10 HG2 GLN 14 HG2 GLN 14 80.695 2.831 -7.356 11 HG3 GLN 14 HG1 GLN 14 80.878 3.434 -9.001 12 HE21 GLN 14 HE21 GLN 14 79.372 1.022 -7.286 13 HE22 GLN 14 HE22 GLN 14 79.266 -0.158 -8.502 14 H VAL 15 HN VAL 15 84.369 -0.438 -8.049 15 HA VAL 15 HA VAL 15 86.957 0.774 -7.286 16 HB VAL 15 HB VAL 15 86.588 -0.874 -5.628 17 HG11 VAL 15 HG11 VAL 15 86.062 -3.265 -6.317 18 HG12 VAL 15 HG12 VAL 15 85.686 -2.626 -7.917 19 HG13 VAL 15 HG13 VAL 15 84.746 -2.109 -6.518 20 HG21 VAL 15 HG21 VAL 15 88.208 -2.329 -7.731 21 HG22 VAL 15 HG22 VAL 15 88.411 -2.384 -5.980 22 HG23 VAL 15 HG23 VAL 15 88.822 -0.920 -6.867 23 H ARG 16 HN ARG 16 88.532 0.652 -8.730 24 HA ARG 16 HA ARG 16 88.202 -1.053 -11.129 25 HB2 ARG 16 HB2 ARG 16 88.779 1.922 -11.078 26 HB3 ARG 16 HB1 ARG 16 88.994 0.902 -12.503 27 HG2 ARG 16 HG2 ARG 16 86.632 0.277 -12.452 28 HG3 ARG 16 HG1 ARG 16 86.391 1.204 -10.974 29 HD2 ARG 16 HD2 ARG 16 87.043 3.270 -12.194 30 HD3 ARG 16 HD1 ARG 16 87.203 2.325 -13.674 31 HE ARG 16 HE ARG 16 84.636 1.882 -12.589 32 HH11 ARG 16 HH11 ARG 16 82.854 3.011 -13.417 33 HH12 ARG 16 HH12 ARG 16 83.103 4.443 -14.360 34 HH21 ARG 16 HH21 ARG 16 86.557 4.333 -14.102 35 HH22 ARG 16 HH22 ARG 16 85.196 5.199 -14.732 36 H GLN 17 HN GLN 17 90.108 -1.876 -11.932 37 HA GLN 17 HA GLN 17 92.521 -1.384 -10.305 38 HB2 GLN 17 HB2 GLN 17 93.308 -3.484 -11.607 39 HB3 GLN 17 HB1 GLN 17 92.096 -3.687 -10.346 40 HG2 GLN 17 HG2 GLN 17 90.314 -3.737 -11.965 41 HG3 GLN 17 HG1 GLN 17 91.422 -3.308 -13.267 42 HE21 GLN 17 HE21 GLN 17 93.534 -4.966 -13.050 43 HE22 GLN 17 HE22 GLN 17 93.067 -6.597 -13.067 44 H ARG 18 HN ARG 18 94.014 -0.047 -11.084 45 HA ARG 18 HA ARG 18 94.677 -0.104 -13.935 46 HB2 ARG 18 HB2 ARG 18 94.300 2.251 -14.277 47 HB3 ARG 18 HB1 ARG 18 92.806 1.529 -13.678 48 HG2 ARG 18 HG2 ARG 18 93.608 2.208 -11.332 49 HG3 ARG 18 HG1 ARG 18 94.798 3.215 -12.157 50 HD2 ARG 18 HD2 ARG 18 92.792 4.159 -13.483 51 HD3 ARG 18 HD1 ARG 18 91.791 3.409 -12.248 52 HE ARG 18 HE ARG 18 93.687 4.890 -10.874 53 HH11 ARG 18 HH11 ARG 18 93.274 7.026 -10.218 54 HH12 ARG 18 HH12 ARG 18 92.064 7.957 -11.034 55 HH21 ARG 18 HH21 ARG 18 91.216 5.410 -13.234 56 HH22 ARG 18 HH22 ARG 18 90.891 7.039 -12.740 57 H TYR 19 HN TYR 19 96.618 1.147 -14.441 58 HA TYR 19 HA TYR 19 98.568 0.991 -12.253 59 HB2 TYR 19 HB2 TYR 19 98.908 1.582 -15.202 60 HB3 TYR 19 HB1 TYR 19 100.219 1.403 -14.044 61 HD1 TYR 19 HD1 TYR 19 97.403 -0.379 -15.691 62 HD2 TYR 19 HD2 TYR 19 100.968 -0.746 -13.322 63 HE1 TYR 19 HE1 TYR 19 97.383 -2.835 -16.039 64 HE2 TYR 19 HE2 TYR 19 100.945 -3.200 -13.667 65 HH TYR 19 HH TYR 19 99.888 -4.763 -15.650 66 H LEU 20 HN LEU 20 99.885 2.739 -11.604 67 HA LEU 20 HA LEU 20 98.880 5.430 -12.369 68 HB2 LEU 20 HB2 LEU 20 98.941 4.355 -9.840 69 HB3 LEU 20 HB1 LEU 20 100.510 5.157 -9.885 70 HG LEU 20 HG LEU 20 99.204 7.210 -10.785 71 HD11 LEU 20 HD11 LEU 20 96.905 7.276 -10.680 72 HD12 LEU 20 HD12 LEU 20 96.813 6.140 -9.336 73 HD13 LEU 20 HD13 LEU 20 97.079 5.548 -10.973 74 HD21 LEU 20 HD21 LEU 20 98.467 7.812 -8.420 75 HD22 LEU 20 HD22 LEU 20 100.142 7.281 -8.576 76 HD23 LEU 20 HD23 LEU 20 98.919 6.173 -7.951 77 H TYR 21 HN TYR 21 100.205 6.526 -13.637 78 HA TYR 21 HA TYR 21 103.130 6.037 -13.474 79 HB2 TYR 21 HB2 TYR 21 102.513 4.869 -15.410 80 HB3 TYR 21 HB1 TYR 21 101.282 6.047 -15.849 81 HD1 TYR 21 HD1 TYR 21 104.955 5.514 -15.594 82 HD2 TYR 21 HD2 TYR 21 101.799 7.916 -17.227 83 HE1 TYR 21 HE1 TYR 21 106.600 6.707 -17.013 84 HE2 TYR 21 HE2 TYR 21 103.440 9.104 -18.656 85 HH TYR 21 HH TYR 21 106.535 9.251 -18.159 86 H THR 22 HN THR 22 104.458 7.756 -13.677 87 HA THR 22 HA THR 22 103.415 10.380 -14.469 88 HB THR 22 HB THR 22 103.155 10.390 -12.040 89 HG1 THR 22 HG1 THR 22 104.353 12.134 -13.383 90 HG21 THR 22 HG21 THR 22 104.773 8.600 -11.569 91 HG22 THR 22 HG22 THR 22 105.103 10.031 -10.594 92 HG23 THR 22 HG23 THR 22 106.094 9.677 -12.006 93 H SER 23 HN SER 23 105.289 11.964 -14.695 94 HA SER 23 HA SER 23 107.856 10.599 -15.246 95 HB2 SER 23 HB2 SER 23 107.991 11.318 -17.447 96 HB3 SER 23 HB1 SER 23 106.267 10.981 -17.318 97 HG SER 23 HG SER 23 107.068 13.131 -18.174 98 H GLY 24 HN GLY 24 109.599 11.730 -14.651 99 HA2 GLY 24 HA2 GLY 24 109.255 14.589 -13.903 100 HA3 GLY 24 HA1 GLY 24 110.196 13.460 -12.934 101 HA PRO 25 HA PRO 25 113.793 13.940 -15.455 102 HB2 PRO 25 HB2 PRO 25 113.733 11.244 -16.706 103 HB3 PRO 25 HB1 PRO 25 114.913 11.925 -15.567 104 HG2 PRO 25 HG2 PRO 25 113.182 10.020 -14.826 105 HG3 PRO 25 HG1 PRO 25 113.675 11.315 -13.717 106 HD2 PRO 25 HD2 PRO 25 111.132 11.074 -15.309 107 HD3 PRO 25 HD1 PRO 25 111.357 11.586 -13.619 108 H HIS 26 HN HIS 26 114.599 14.439 -17.563 109 HA HIS 26 HA HIS 26 112.715 15.269 -19.456 110 HB2 HIS 26 HB2 HIS 26 115.061 16.103 -19.316 111 HB3 HIS 26 HB1 HIS 26 115.616 14.560 -19.967 112 HD2 HIS 26 HD2 HIS 26 114.048 17.878 -21.247 113 HE1 HIS 26 HE1 HIS 26 114.288 15.250 -24.540 114 HE2 HIS 26 HE2 HIS 26 113.817 17.642 -23.837 115 H GLY 27 HN GLY 27 114.715 12.342 -19.338 116 HA2 GLY 27 HA2 GLY 27 112.745 10.848 -20.831 117 HA3 GLY 27 HA1 GLY 27 114.248 11.109 -21.712 118 H LEU 28 HN LEU 28 115.899 9.723 -21.351 119 HA LEU 28 HA LEU 28 117.153 8.042 -20.420 120 HB2 LEU 28 HB2 LEU 28 116.868 9.664 -18.392 121 HB3 LEU 28 HB1 LEU 28 115.739 8.460 -17.789 122 HG LEU 28 HG LEU 28 118.540 7.685 -18.653 123 HD11 LEU 28 HD11 LEU 28 119.130 7.838 -16.219 124 HD12 LEU 28 HD12 LEU 28 117.603 8.679 -15.949 125 HD13 LEU 28 HD13 LEU 28 118.841 9.405 -16.975 126 HD21 LEU 28 HD21 LEU 28 118.093 5.874 -16.940 127 HD22 LEU 28 HD22 LEU 28 117.037 5.807 -18.344 128 HD23 LEU 28 HD23 LEU 28 116.439 6.470 -16.822 129 H SER 29 HN SER 29 114.148 7.783 -18.525 130 HA SER 29 HA SER 29 113.205 5.520 -20.025 131 HB2 SER 29 HB2 SER 29 115.025 4.452 -18.761 132 HB3 SER 29 HB1 SER 29 114.322 5.033 -17.255 133 HG SER 29 HG SER 29 113.739 2.831 -18.590 134 H SER 30 HN SER 30 111.197 4.667 -19.210 135 HA SER 30 HA SER 30 109.536 6.701 -18.028 136 HB2 SER 30 HB2 SER 30 108.494 5.429 -19.720 137 HB3 SER 30 HB1 SER 30 109.066 3.906 -19.046 138 HG SER 30 HG SER 30 106.777 5.100 -18.595 139 H CYS 31 HN CYS 31 108.319 6.515 -16.070 140 HA CYS 31 HA CYS 31 109.346 4.514 -14.130 141 HB2 CYS 31 HB2 CYS 31 109.537 7.432 -14.044 142 HB3 CYS 31 HB1 CYS 31 108.748 6.798 -12.606 143 H HIS 32 HN HIS 32 107.758 3.250 -13.510 144 HA HIS 32 HA HIS 32 104.982 4.284 -13.320 145 HB2 HIS 32 HB2 HIS 32 105.778 1.371 -13.444 146 HB3 HIS 32 HB1 HIS 32 104.209 2.093 -13.789 147 HD2 HIS 32 HD2 HIS 32 103.825 2.505 -16.485 148 HE1 HIS 32 HE1 HIS 32 107.862 2.420 -17.699 149 HE2 HIS 32 HE2 HIS 32 105.463 2.620 -18.510 150 H LEU 33 HN LEU 33 104.201 4.507 -11.291 151 HA LEU 33 HA LEU 33 105.655 4.096 -8.981 152 HB2 LEU 33 HB2 LEU 33 103.335 5.296 -9.481 153 HB3 LEU 33 HB1 LEU 33 102.668 3.789 -8.868 154 HG LEU 33 HG LEU 33 104.570 5.658 -7.421 155 HD11 LEU 33 HD11 LEU 33 102.314 6.476 -7.357 156 HD12 LEU 33 HD12 LEU 33 102.624 5.714 -5.797 157 HD13 LEU 33 HD13 LEU 33 101.678 4.866 -7.021 158 HD21 LEU 33 HD21 LEU 33 105.262 3.538 -6.684 159 HD22 LEU 33 HD22 LEU 33 103.632 2.869 -6.772 160 HD23 LEU 33 HD23 LEU 33 104.055 3.998 -5.486 161 H GLU 34 HN GLU 34 106.242 2.390 -7.836 162 HA GLU 34 HA GLU 34 104.682 -0.114 -7.966 163 HB2 GLU 34 HB2 GLU 34 106.887 -1.344 -7.916 164 HB3 GLU 34 HB1 GLU 34 106.514 -0.552 -9.447 165 HG2 GLU 34 HG2 GLU 34 107.978 1.286 -8.919 166 HG3 GLU 34 HG1 GLU 34 108.204 0.706 -7.271 167 H ILE 35 HN ILE 35 104.641 -1.298 -6.090 168 HA ILE 35 HA ILE 35 105.910 -0.011 -3.715 169 HB ILE 35 HB ILE 35 103.384 -1.678 -3.833 170 HG12 ILE 35 HG12 ILE 35 103.769 1.284 -3.284 171 HG13 ILE 35 HG11 ILE 35 103.210 0.625 -4.823 172 HG21 ILE 35 HG21 ILE 35 104.549 -1.969 -1.716 173 HG22 ILE 35 HG22 ILE 35 103.189 -0.885 -1.446 174 HG23 ILE 35 HG23 ILE 35 104.821 -0.233 -1.583 175 HD11 ILE 35 HD11 ILE 35 101.324 -0.484 -3.595 176 HD12 ILE 35 HD12 ILE 35 101.267 1.278 -3.520 177 HD13 ILE 35 HD13 ILE 35 101.844 0.354 -2.132 178 H ARG 36 HN ARG 36 107.428 -1.145 -2.743 179 HA ARG 36 HA ARG 36 108.067 -3.834 -3.560 180 HB2 ARG 36 HB2 ARG 36 109.198 -1.874 -1.586 181 HB3 ARG 36 HB1 ARG 36 109.727 -3.552 -1.545 182 HG2 ARG 36 HG2 ARG 36 111.233 -2.203 -2.942 183 HG3 ARG 36 HG1 ARG 36 110.394 -3.409 -3.915 184 HD2 ARG 36 HD2 ARG 36 108.831 -1.750 -4.730 185 HD3 ARG 36 HD1 ARG 36 109.476 -0.537 -3.626 186 HE ARG 36 HE ARG 36 111.269 -0.233 -5.082 187 HH11 ARG 36 HH11 ARG 36 112.353 -0.562 -7.032 188 HH12 ARG 36 HH12 ARG 36 111.927 -1.902 -8.044 189 HH21 ARG 36 HH21 ARG 36 109.456 -3.071 -5.909 190 HH22 ARG 36 HH22 ARG 36 110.280 -3.319 -7.411 191 H GLU 37 HN GLU 37 108.224 -5.652 -2.142 192 HA GLU 37 HA GLU 37 105.902 -6.109 -0.549 193 HB2 GLU 37 HB2 GLU 37 108.508 -7.650 -0.727 194 HB3 GLU 37 HB1 GLU 37 107.023 -8.245 0.012 195 HG2 GLU 37 HG2 GLU 37 107.037 -7.264 -2.835 196 HG3 GLU 37 HG1 GLU 37 107.534 -8.909 -2.451 197 H ASP 38 HN ASP 38 109.127 -5.019 -0.033 198 HA ASP 38 HA ASP 38 109.178 -5.325 2.821 199 HB2 ASP 38 HB2 ASP 38 110.873 -3.549 1.049 200 HB3 ASP 38 HB1 ASP 38 111.249 -4.064 2.690 201 H GLY 39 HN GLY 39 107.519 -3.310 0.759 202 HA2 GLY 39 HA2 GLY 39 106.001 -1.644 1.412 203 HA3 GLY 39 HA1 GLY 39 106.860 -1.471 2.937 204 H THR 40 HN THR 40 108.978 -1.515 0.268 205 HA THR 40 HA THR 40 109.605 1.284 0.664 206 HB THR 40 HB THR 40 110.796 -0.211 -1.633 207 HG1 THR 40 HG1 THR 40 112.099 -0.884 0.578 208 HG21 THR 40 HG21 THR 40 111.533 2.073 -0.894 209 HG22 THR 40 HG22 THR 40 112.823 0.873 -0.872 210 HG23 THR 40 HG23 THR 40 112.049 1.361 0.635 211 H VAL 41 HN VAL 41 109.769 2.776 -1.255 212 HA VAL 41 HA VAL 41 107.646 2.251 -3.257 213 HB VAL 41 HB VAL 41 108.004 4.756 -1.604 214 HG11 VAL 41 HG11 VAL 41 105.943 5.468 -2.945 215 HG12 VAL 41 HG12 VAL 41 106.346 4.159 -4.058 216 HG13 VAL 41 HG13 VAL 41 107.479 5.489 -3.812 217 HG21 VAL 41 HG21 VAL 41 106.768 3.090 -0.394 218 HG22 VAL 41 HG22 VAL 41 105.848 2.636 -1.829 219 HG23 VAL 41 HG23 VAL 41 105.575 4.202 -1.064 220 H GLY 42 HN GLY 42 108.038 2.897 -5.262 221 HA2 GLY 42 HA2 GLY 42 109.862 4.918 -6.059 222 HA3 GLY 42 HA1 GLY 42 110.622 3.330 -6.208 223 H CYS 43 HN CYS 43 110.509 4.213 -8.581 224 HA CYS 43 HA CYS 43 107.913 3.427 -9.765 225 HB2 CYS 43 HB2 CYS 43 108.704 4.673 -11.783 226 HB3 CYS 43 HB1 CYS 43 108.359 5.677 -10.379 227 H ALA 44 HN ALA 44 107.961 2.264 -11.766 228 HA ALA 44 HA ALA 44 110.330 0.506 -12.090 229 HB1 ALA 44 HB1 ALA 44 108.587 -1.055 -13.158 230 HB2 ALA 44 HB2 ALA 44 107.368 -0.006 -12.438 231 HB3 ALA 44 HB3 ALA 44 108.507 -0.866 -11.405 232 H ALA 45 HN ALA 45 110.813 -0.114 -14.321 233 HA ALA 45 HA ALA 45 109.922 1.947 -16.277 234 HB1 ALA 45 HB1 ALA 45 112.242 2.229 -15.879 235 HB2 ALA 45 HB2 ALA 45 112.121 1.373 -17.418 236 HB3 ALA 45 HB3 ALA 45 112.547 0.492 -15.950 237 H ASP 46 HN ASP 46 109.701 -1.352 -15.533 238 HA ASP 46 HA ASP 46 109.232 -2.063 -18.385 239 HB2 ASP 46 HB2 ASP 46 111.075 -3.242 -17.030 240 HB3 ASP 46 HB1 ASP 46 109.753 -4.032 -16.174 241 H GLN 47 HN GLN 47 107.362 -0.969 -16.135 242 HA GLN 47 HA GLN 47 105.216 -1.367 -15.367 243 HB2 GLN 47 HB2 GLN 47 105.174 -2.632 -18.107 244 HB3 GLN 47 HB1 GLN 47 103.730 -2.320 -17.145 245 HG2 GLN 47 HG2 GLN 47 104.221 0.063 -17.114 246 HG3 GLN 47 HG1 GLN 47 105.743 -0.207 -17.963 247 HE21 GLN 47 HE21 GLN 47 102.521 0.658 -18.464 248 HE22 GLN 47 HE22 GLN 47 102.415 0.284 -20.117 249 H SER 48 HN SER 48 105.343 -2.750 -13.618 250 HA SER 48 HA SER 48 105.089 -5.652 -14.187 251 HB2 SER 48 HB2 SER 48 107.166 -5.540 -13.149 252 HB3 SER 48 HB1 SER 48 106.711 -4.158 -12.160 253 HG SER 48 HG SER 48 105.134 -5.786 -11.232 254 HA PRO 49 HA PRO 49 101.172 -5.709 -12.095 255 HB2 PRO 49 HB2 PRO 49 102.291 -7.797 -10.250 256 HB3 PRO 49 HB1 PRO 49 100.793 -7.819 -11.202 257 HG2 PRO 49 HG2 PRO 49 102.965 -9.205 -11.942 258 HG3 PRO 49 HG1 PRO 49 101.869 -8.471 -13.125 259 HD2 PRO 49 HD2 PRO 49 104.620 -7.632 -12.346 260 HD3 PRO 49 HD1 PRO 49 103.743 -7.375 -13.868 261 H GLU 50 HN GLU 50 104.079 -5.645 -10.101 262 HA GLU 50 HA GLU 50 103.006 -4.947 -7.629 263 HB2 GLU 50 HB2 GLU 50 105.201 -3.976 -7.141 264 HB3 GLU 50 HB1 GLU 50 105.382 -5.500 -8.012 265 HG2 GLU 50 HG2 GLU 50 105.544 -4.184 -10.142 266 HG3 GLU 50 HG1 GLU 50 105.563 -2.716 -9.184 267 H SER 51 HN SER 51 103.156 -3.111 -10.543 268 HA SER 51 HA SER 51 102.802 -0.557 -9.193 269 HB2 SER 51 HB2 SER 51 103.137 -1.413 -12.053 270 HB3 SER 51 HB1 SER 51 102.562 0.206 -11.664 271 HG SER 51 HG SER 51 104.560 -0.214 -10.067 272 H LEU 52 HN LEU 52 100.874 -3.109 -10.306 273 HA LEU 52 HA LEU 52 98.575 -1.600 -11.083 274 HB2 LEU 52 HB2 LEU 52 99.352 -4.242 -11.283 275 HB3 LEU 52 HB1 LEU 52 98.126 -4.339 -10.026 276 HG LEU 52 HG LEU 52 97.731 -3.044 -12.742 277 HD11 LEU 52 HD11 LEU 52 96.998 -5.750 -11.615 278 HD12 LEU 52 HD12 LEU 52 97.899 -5.393 -13.091 279 HD13 LEU 52 HD13 LEU 52 96.169 -5.059 -13.011 280 HD21 LEU 52 HD21 LEU 52 96.348 -2.201 -10.736 281 HD22 LEU 52 HD22 LEU 52 95.613 -3.802 -10.722 282 HD23 LEU 52 HD23 LEU 52 95.452 -2.768 -12.143 283 H LEU 53 HN LEU 53 97.276 -0.497 -9.773 284 HA LEU 53 HA LEU 53 97.115 -1.278 -6.903 285 HB2 LEU 53 HB2 LEU 53 96.950 1.478 -8.137 286 HB3 LEU 53 HB1 LEU 53 96.763 1.106 -6.426 287 HG LEU 53 HG LEU 53 99.257 0.237 -7.903 288 HD11 LEU 53 HD11 LEU 53 98.615 2.985 -6.826 289 HD12 LEU 53 HD12 LEU 53 99.237 2.549 -8.418 290 HD13 LEU 53 HD13 LEU 53 100.274 2.411 -7.001 291 HD21 LEU 53 HD21 LEU 53 100.209 0.688 -5.566 292 HD22 LEU 53 HD22 LEU 53 99.094 -0.663 -5.696 293 HD23 LEU 53 HD23 LEU 53 98.543 0.866 -5.021 294 H GLN 54 HN GLN 54 95.132 -1.842 -6.241 295 HA GLN 54 HA GLN 54 92.865 -1.516 -8.014 296 HB2 GLN 54 HB2 GLN 54 93.073 -2.575 -5.187 297 HB3 GLN 54 HB1 GLN 54 91.563 -2.504 -6.098 298 HG2 GLN 54 HG2 GLN 54 92.605 -3.871 -7.886 299 HG3 GLN 54 HG1 GLN 54 94.061 -3.986 -6.907 300 HE21 GLN 54 HE21 GLN 54 94.023 -5.400 -5.034 301 HE22 GLN 54 HE22 GLN 54 92.725 -6.453 -4.738 302 H LEU 55 HN LEU 55 91.959 0.415 -8.243 303 HA LEU 55 HA LEU 55 92.073 2.380 -6.101 304 HB2 LEU 55 HB2 LEU 55 92.467 3.045 -8.425 305 HB3 LEU 55 HB1 LEU 55 90.855 2.500 -8.866 306 HG LEU 55 HG LEU 55 90.822 4.366 -6.565 307 HD11 LEU 55 HD11 LEU 55 91.384 6.381 -7.792 308 HD12 LEU 55 HD12 LEU 55 91.716 5.448 -9.253 309 HD13 LEU 55 HD13 LEU 55 92.765 5.287 -7.842 310 HD21 LEU 55 HD21 LEU 55 88.853 3.605 -7.971 311 HD22 LEU 55 HD22 LEU 55 89.501 4.585 -9.286 312 HD23 LEU 55 HD23 LEU 55 88.992 5.354 -7.784 313 H LYS 56 HN LYS 56 90.623 2.369 -4.544 314 HA LYS 56 HA LYS 56 87.848 1.470 -5.128 315 HB2 LYS 56 HB2 LYS 56 89.356 1.544 -2.502 316 HB3 LYS 56 HB1 LYS 56 87.677 1.052 -2.695 317 HG2 LYS 56 HG2 LYS 56 88.393 -0.770 -4.204 318 HG3 LYS 56 HG1 LYS 56 90.071 -0.288 -3.980 319 HD2 LYS 56 HD2 LYS 56 89.881 -0.723 -1.562 320 HD3 LYS 56 HD1 LYS 56 88.192 -1.184 -1.774 321 HE2 LYS 56 HE2 LYS 56 89.347 -3.246 -1.763 322 HE3 LYS 56 HE1 LYS 56 89.079 -2.922 -3.475 323 HZ1 LYS 56 HZ1 LYS 56 91.564 -2.487 -1.915 324 HZ2 LYS 56 HZ2 LYS 56 91.328 -1.862 -3.477 325 HZ3 LYS 56 HZ3 LYS 56 91.334 -3.542 -3.223 326 H ALA 57 HN ALA 57 86.229 2.858 -4.832 327 HA ALA 57 HA ALA 57 86.895 5.619 -4.083 328 HB1 ALA 57 HB1 ALA 57 84.501 4.323 -5.385 329 HB2 ALA 57 HB2 ALA 57 85.682 5.403 -6.125 330 HB3 ALA 57 HB3 ALA 57 84.545 6.027 -4.929 331 H LEU 58 HN LEU 58 86.905 5.846 -1.887 332 HA LEU 58 HA LEU 58 85.063 4.481 -0.154 333 HB2 LEU 58 HB2 LEU 58 86.637 6.992 0.458 334 HB3 LEU 58 HB1 LEU 58 86.002 5.824 1.612 335 HG LEU 58 HG LEU 58 88.172 5.312 -0.441 336 HD11 LEU 58 HD11 LEU 58 89.107 6.573 1.337 337 HD12 LEU 58 HD12 LEU 58 89.477 4.898 1.743 338 HD13 LEU 58 HD13 LEU 58 88.151 5.726 2.553 339 HD21 LEU 58 HD21 LEU 58 88.346 3.131 0.975 340 HD22 LEU 58 HD22 LEU 58 87.056 3.241 -0.222 341 HD23 LEU 58 HD23 LEU 58 86.699 3.507 1.484 342 H LYS 59 HN LYS 59 85.484 7.907 -0.969 343 HA LYS 59 HA LYS 59 82.564 8.308 -0.866 344 HB2 LYS 59 HB2 LYS 59 84.626 10.148 0.366 345 HB3 LYS 59 HB1 LYS 59 82.887 10.411 0.336 346 HG2 LYS 59 HG2 LYS 59 82.489 8.513 1.760 347 HG3 LYS 59 HG1 LYS 59 84.167 7.996 1.636 348 HD2 LYS 59 HD2 LYS 59 83.475 10.724 2.735 349 HD3 LYS 59 HD1 LYS 59 83.429 9.300 3.770 350 HE2 LYS 59 HE2 LYS 59 85.830 8.828 2.969 351 HE3 LYS 59 HE1 LYS 59 85.813 10.465 2.316 352 HZ1 LYS 59 HZ1 LYS 59 85.965 11.357 4.335 353 HZ2 LYS 59 HZ2 LYS 59 86.480 9.818 4.838 354 HZ3 LYS 59 HZ3 LYS 59 84.854 10.275 5.021 355 HA PRO 60 HA PRO 60 83.071 10.359 -4.780 356 HB2 PRO 60 HB2 PRO 60 81.727 12.730 -3.515 357 HB3 PRO 60 HB1 PRO 60 81.368 11.925 -5.056 358 HG2 PRO 60 HG2 PRO 60 79.856 11.544 -2.873 359 HG3 PRO 60 HG1 PRO 60 80.141 10.259 -4.058 360 HD2 PRO 60 HD2 PRO 60 81.217 10.524 -1.299 361 HD3 PRO 60 HD1 PRO 60 81.003 9.069 -2.297 362 H GLY 61 HN GLY 61 85.189 10.896 -5.130 363 HA2 GLY 61 HA2 GLY 61 86.756 12.663 -5.507 364 HA3 GLY 61 HA1 GLY 61 86.153 13.483 -4.074 365 H VAL 62 HN VAL 62 86.239 10.666 -2.745 366 HA VAL 62 HA VAL 62 89.136 10.740 -2.075 367 HB VAL 62 HB VAL 62 86.820 9.780 -0.375 368 HG11 VAL 62 HG11 VAL 62 89.776 10.176 0.174 369 HG12 VAL 62 HG12 VAL 62 88.903 8.644 0.168 370 HG13 VAL 62 HG13 VAL 62 88.574 9.841 1.420 371 HG21 VAL 62 HG21 VAL 62 88.468 12.324 -0.208 372 HG22 VAL 62 HG22 VAL 62 87.201 11.836 0.922 373 HG23 VAL 62 HG23 VAL 62 86.790 12.231 -0.747 374 H ILE 63 HN ILE 63 90.296 8.957 -2.509 375 HA ILE 63 HA ILE 63 88.875 6.390 -2.916 376 HB ILE 63 HB ILE 63 90.166 5.947 -4.894 377 HG12 ILE 63 HG12 ILE 63 91.611 8.022 -5.725 378 HG13 ILE 63 HG11 ILE 63 91.659 8.424 -4.014 379 HG21 ILE 63 HG21 ILE 63 89.314 7.711 -6.364 380 HG22 ILE 63 HG22 ILE 63 89.102 8.782 -4.978 381 HG23 ILE 63 HG23 ILE 63 88.118 7.326 -5.123 382 HD11 ILE 63 HD11 ILE 63 93.280 6.551 -5.425 383 HD12 ILE 63 HD12 ILE 63 92.304 5.620 -4.293 384 HD13 ILE 63 HD13 ILE 63 93.318 6.936 -3.710 385 H GLN 64 HN GLN 64 90.348 4.537 -2.932 386 HA GLN 64 HA GLN 64 92.762 4.881 -1.237 387 HB2 GLN 64 HB2 GLN 64 90.887 4.020 0.134 388 HB3 GLN 64 HB1 GLN 64 90.679 2.685 -0.989 389 HG2 GLN 64 HG2 GLN 64 93.023 1.970 -0.516 390 HG3 GLN 64 HG1 GLN 64 93.142 3.263 0.678 391 HE21 GLN 64 HE21 GLN 64 93.440 0.582 1.509 392 HE22 GLN 64 HE22 GLN 64 92.091 0.129 2.430 393 H ILE 65 HN ILE 65 94.481 3.550 -1.799 394 HA ILE 65 HA ILE 65 94.119 1.888 -4.238 395 HB ILE 65 HB ILE 65 96.668 2.520 -4.507 396 HG12 ILE 65 HG12 ILE 65 95.600 4.822 -2.839 397 HG13 ILE 65 HG11 ILE 65 96.791 3.645 -2.293 398 HG21 ILE 65 HG21 ILE 65 94.794 3.188 -6.030 399 HG22 ILE 65 HG22 ILE 65 96.039 4.427 -5.878 400 HG23 ILE 65 HG23 ILE 65 94.515 4.598 -5.006 401 HD11 ILE 65 HD11 ILE 65 98.213 4.345 -4.276 402 HD12 ILE 65 HD12 ILE 65 98.004 5.577 -3.029 403 HD13 ILE 65 HD13 ILE 65 97.072 5.666 -4.522 404 H LEU 66 HN LEU 66 94.703 -0.150 -4.143 405 HA LEU 66 HA LEU 66 96.494 -1.084 -1.980 406 HB2 LEU 66 HB2 LEU 66 94.169 -1.516 -1.357 407 HB3 LEU 66 HB1 LEU 66 93.869 -2.286 -2.899 408 HG LEU 66 HG LEU 66 94.294 -3.763 -0.796 409 HD11 LEU 66 HD11 LEU 66 96.033 -4.542 -3.116 410 HD12 LEU 66 HD12 LEU 66 94.285 -4.473 -3.293 411 HD13 LEU 66 HD13 LEU 66 95.009 -5.549 -2.106 412 HD21 LEU 66 HD21 LEU 66 96.408 -2.509 -0.182 413 HD22 LEU 66 HD22 LEU 66 97.179 -3.295 -1.558 414 HD23 LEU 66 HD23 LEU 66 96.549 -4.261 -0.230 415 H GLY 67 HN GLY 67 98.216 -2.056 -2.852 416 HA2 GLY 67 HA2 GLY 67 98.319 -2.805 -5.624 417 HA3 GLY 67 HA1 GLY 67 99.593 -3.037 -4.439 418 H VAL 68 HN VAL 68 97.829 -4.651 -6.535 419 HA VAL 68 HA VAL 68 96.673 -6.786 -5.087 420 HB VAL 68 HB VAL 68 96.485 -7.883 -7.218 421 HG11 VAL 68 HG11 VAL 68 95.607 -5.920 -8.612 422 HG12 VAL 68 HG12 VAL 68 96.145 -4.877 -7.297 423 HG13 VAL 68 HG13 VAL 68 94.916 -6.113 -7.001 424 HG21 VAL 68 HG21 VAL 68 97.619 -6.749 -9.219 425 HG22 VAL 68 HG22 VAL 68 98.667 -7.670 -8.142 426 HG23 VAL 68 HG23 VAL 68 98.622 -5.910 -8.035 427 H LYS 69 HN LYS 69 99.879 -6.457 -6.609 428 HA LYS 69 HA LYS 69 100.649 -9.131 -6.185 429 HB2 LYS 69 HB2 LYS 69 101.696 -7.364 -7.727 430 HB3 LYS 69 HB1 LYS 69 102.585 -6.828 -6.309 431 HG2 LYS 69 HG2 LYS 69 102.644 -9.768 -6.987 432 HG3 LYS 69 HG1 LYS 69 103.605 -8.667 -7.964 433 HD2 LYS 69 HD2 LYS 69 104.648 -7.793 -5.850 434 HD3 LYS 69 HD1 LYS 69 103.785 -9.049 -4.964 435 HE2 LYS 69 HE2 LYS 69 105.676 -9.590 -7.264 436 HE3 LYS 69 HE1 LYS 69 106.124 -9.706 -5.562 437 HZ1 LYS 69 HZ1 LYS 69 105.296 -11.743 -5.541 438 HZ2 LYS 69 HZ2 LYS 69 104.804 -11.603 -7.161 439 HZ3 LYS 69 HZ3 LYS 69 103.757 -11.132 -5.908 440 H THR 70 HN THR 70 101.393 -6.221 -4.247 441 HA THR 70 HA THR 70 102.640 -7.925 -2.206 442 HB THR 70 HB THR 70 103.398 -5.867 -1.190 443 HG1 THR 70 HG1 THR 70 102.078 -4.464 -3.248 444 HG21 THR 70 HG21 THR 70 104.282 -6.810 -3.601 445 HG22 THR 70 HG22 THR 70 105.026 -5.451 -2.757 446 HG23 THR 70 HG23 THR 70 103.849 -5.158 -4.037 447 H SER 71 HN SER 71 99.624 -6.314 -2.765 448 HA SER 71 HA SER 71 97.705 -6.248 -1.473 449 HB2 SER 71 HB2 SER 71 97.351 -8.099 -0.174 450 HB3 SER 71 HB1 SER 71 98.913 -8.619 -0.799 451 HG SER 71 HG SER 71 99.534 -8.548 1.201 452 H ARG 72 HN ARG 72 99.947 -4.346 -1.136 453 HA ARG 72 HA ARG 72 99.733 -3.594 1.709 454 HB2 ARG 72 HB2 ARG 72 101.540 -2.513 -0.468 455 HB3 ARG 72 HB1 ARG 72 101.635 -2.147 1.247 456 HG2 ARG 72 HG2 ARG 72 101.833 -4.991 0.276 457 HG3 ARG 72 HG1 ARG 72 103.247 -3.943 0.280 458 HD2 ARG 72 HD2 ARG 72 102.863 -3.514 2.709 459 HD3 ARG 72 HD1 ARG 72 101.542 -4.680 2.674 460 HE ARG 72 HE ARG 72 104.401 -5.274 2.466 461 HH11 ARG 72 HH11 ARG 72 104.921 -7.475 2.653 462 HH12 ARG 72 HH12 ARG 72 103.663 -8.664 2.615 463 HH21 ARG 72 HH21 ARG 72 101.114 -6.349 2.232 464 HH22 ARG 72 HH22 ARG 72 101.512 -8.026 2.389 465 H PHE 73 HN PHE 73 98.861 -1.674 2.344 466 HA PHE 73 HA PHE 73 97.321 -0.169 0.329 467 HB2 PHE 73 HB2 PHE 73 97.325 0.021 3.364 468 HB3 PHE 73 HB1 PHE 73 96.218 0.856 2.277 469 HD1 PHE 73 HD1 PHE 73 96.930 -2.241 4.028 470 HD2 PHE 73 HD2 PHE 73 94.675 -0.508 0.803 471 HE1 PHE 73 HE1 PHE 73 95.429 -4.215 4.013 472 HE2 PHE 73 HE2 PHE 73 93.172 -2.480 0.795 473 HZ PHE 73 HZ PHE 73 93.550 -4.333 2.398 474 H LEU 74 HN LEU 74 98.331 1.577 -0.557 475 HA LEU 74 HA LEU 74 100.708 2.667 0.620 476 HB2 LEU 74 HB2 LEU 74 100.558 2.704 -1.771 477 HB3 LEU 74 HB1 LEU 74 99.022 3.561 -1.721 478 HG LEU 74 HG LEU 74 100.088 5.562 -0.844 479 HD11 LEU 74 HD11 LEU 74 102.489 3.740 -0.615 480 HD12 LEU 74 HD12 LEU 74 101.760 4.754 0.629 481 HD13 LEU 74 HD13 LEU 74 102.675 5.494 -0.680 482 HD21 LEU 74 HD21 LEU 74 101.383 6.183 -2.741 483 HD22 LEU 74 HD22 LEU 74 100.236 4.985 -3.332 484 HD23 LEU 74 HD23 LEU 74 101.907 4.524 -3.022 485 H CYS 75 HN CYS 75 100.758 3.953 2.298 486 HA CYS 75 HA CYS 75 98.714 6.068 2.588 487 HB2 CYS 75 HB2 CYS 75 99.892 4.500 4.886 488 HB3 CYS 75 HB1 CYS 75 98.561 5.656 4.941 489 H GLN 76 HN GLN 76 99.456 8.031 3.328 490 HA GLN 76 HA GLN 76 102.391 8.344 3.360 491 HB2 GLN 76 HB2 GLN 76 101.241 9.614 1.631 492 HB3 GLN 76 HB1 GLN 76 100.184 10.346 2.838 493 HG2 GLN 76 HG2 GLN 76 102.046 11.488 3.874 494 HG3 GLN 76 HG1 GLN 76 103.202 10.617 2.872 495 HE21 GLN 76 HE21 GLN 76 103.948 11.870 1.165 496 HE22 GLN 76 HE22 GLN 76 103.045 13.062 0.361 497 H ARG 77 HN ARG 77 103.409 8.911 5.132 498 HA ARG 77 HA ARG 77 101.980 9.289 7.601 499 HB2 ARG 77 HB2 ARG 77 104.715 9.974 8.019 500 HB3 ARG 77 HB1 ARG 77 103.933 8.446 8.407 501 HG2 ARG 77 HG2 ARG 77 104.445 7.586 6.184 502 HG3 ARG 77 HG1 ARG 77 105.126 9.142 5.720 503 HD2 ARG 77 HD2 ARG 77 106.887 7.518 6.361 504 HD3 ARG 77 HD1 ARG 77 106.869 8.928 7.417 505 HE ARG 77 HE ARG 77 105.230 7.044 8.631 506 HH11 ARG 77 HH11 ARG 77 106.043 5.663 10.243 507 HH12 ARG 77 HH12 ARG 77 107.741 5.327 10.311 508 HH21 ARG 77 HH21 ARG 77 108.514 7.320 7.581 509 HH22 ARG 77 HH22 ARG 77 109.140 6.264 8.803 510 HA PRO 78 HA PRO 78 101.656 13.651 7.873 511 HB2 PRO 78 HB2 PRO 78 102.870 14.210 10.333 512 HB3 PRO 78 HB1 PRO 78 101.203 13.639 10.135 513 HG2 PRO 78 HG2 PRO 78 103.668 12.084 10.798 514 HG3 PRO 78 HG1 PRO 78 102.024 11.927 11.451 515 HD2 PRO 78 HD2 PRO 78 102.944 10.197 9.616 516 HD3 PRO 78 HD1 PRO 78 101.254 10.744 9.581 517 H ASP 79 HN ASP 79 104.746 12.134 8.210 518 HA ASP 79 HA ASP 79 106.394 14.463 8.024 519 HB2 ASP 79 HB2 ASP 79 107.137 12.185 8.843 520 HB3 ASP 79 HB1 ASP 79 107.098 11.650 7.163 521 H GLY 80 HN GLY 80 104.373 12.856 5.850 522 HA2 GLY 80 HA2 GLY 80 103.863 13.523 3.665 523 HA3 GLY 80 HA1 GLY 80 105.358 14.451 3.616 524 H ALA 81 HN ALA 81 105.827 11.301 4.821 525 HA ALA 81 HA ALA 81 107.165 10.528 2.319 526 HB1 ALA 81 HB1 ALA 81 107.947 8.580 3.853 527 HB2 ALA 81 HB2 ALA 81 107.315 9.574 5.167 528 HB3 ALA 81 HB3 ALA 81 108.598 10.195 4.133 529 H LEU 82 HN LEU 82 106.722 8.685 1.167 530 HA LEU 82 HA LEU 82 104.027 7.550 1.520 531 HB2 LEU 82 HB2 LEU 82 105.992 7.784 -0.737 532 HB3 LEU 82 HB1 LEU 82 104.807 6.481 -0.798 533 HG LEU 82 HG LEU 82 102.976 8.072 -0.636 534 HD11 LEU 82 HD11 LEU 82 103.555 10.557 -0.740 535 HD12 LEU 82 HD12 LEU 82 105.189 10.095 -0.255 536 HD13 LEU 82 HD13 LEU 82 103.821 9.758 0.809 537 HD21 LEU 82 HD21 LEU 82 105.076 8.458 -2.750 538 HD22 LEU 82 HD22 LEU 82 103.725 9.589 -2.724 539 HD23 LEU 82 HD23 LEU 82 103.423 7.863 -2.896 540 H TYR 83 HN TYR 83 103.653 5.431 2.039 541 HA TYR 83 HA TYR 83 105.731 3.436 1.806 542 HB2 TYR 83 HB2 TYR 83 106.100 2.982 4.101 543 HB3 TYR 83 HB1 TYR 83 106.241 4.733 3.953 544 HD1 TYR 83 HD1 TYR 83 104.551 2.038 5.606 545 HD2 TYR 83 HD2 TYR 83 104.101 6.137 4.406 546 HE1 TYR 83 HE1 TYR 83 102.709 2.310 7.239 547 HE2 TYR 83 HE2 TYR 83 102.262 6.413 6.051 548 HH TYR 83 HH TYR 83 101.353 3.770 8.251 549 H GLY 84 HN GLY 84 104.948 1.347 1.899 550 HA2 GLY 84 HA2 GLY 84 102.097 1.011 1.632 551 HA3 GLY 84 HA1 GLY 84 103.313 -0.266 1.575 552 H SER 85 HN SER 85 100.701 -0.040 3.088 553 HA SER 85 HA SER 85 101.788 -0.634 5.789 554 HB2 SER 85 HB2 SER 85 99.863 0.428 6.788 555 HB3 SER 85 HB1 SER 85 100.641 1.583 5.708 556 HG SER 85 HG SER 85 98.457 -0.095 5.007 557 H LEU 86 HN LEU 86 100.623 -2.161 7.013 558 HA LEU 86 HA LEU 86 99.215 -4.157 5.386 559 HB2 LEU 86 HB2 LEU 86 100.540 -4.166 8.086 560 HB3 LEU 86 HB1 LEU 86 99.414 -5.448 7.655 561 HG LEU 86 HG LEU 86 101.849 -5.949 7.177 562 HD11 LEU 86 HD11 LEU 86 99.734 -6.882 5.893 563 HD12 LEU 86 HD12 LEU 86 101.353 -7.208 5.288 564 HD13 LEU 86 HD13 LEU 86 100.382 -5.940 4.550 565 HD21 LEU 86 HD21 LEU 86 102.344 -3.589 6.403 566 HD22 LEU 86 HD22 LEU 86 101.493 -3.975 4.907 567 HD23 LEU 86 HD23 LEU 86 102.954 -4.858 5.341 568 H HIS 87 HN HIS 87 98.366 -1.507 7.176 569 HA HIS 87 HA HIS 87 95.687 -2.634 7.739 570 HB2 HIS 87 HB2 HIS 87 97.027 -2.519 9.843 571 HB3 HIS 87 HB1 HIS 87 97.204 -0.782 9.596 572 HD2 HIS 87 HD2 HIS 87 95.115 0.679 10.675 573 HE1 HIS 87 HE1 HIS 87 92.318 -2.463 11.037 574 HE2 HIS 87 HE2 HIS 87 92.740 -0.004 11.513 575 H PHE 88 HN PHE 88 94.008 -1.350 7.252 576 HA PHE 88 HA PHE 88 94.495 0.928 5.589 577 HB2 PHE 88 HB2 PHE 88 92.632 -0.512 5.066 578 HB3 PHE 88 HB1 PHE 88 91.936 -0.271 6.669 579 HD1 PHE 88 HD1 PHE 88 93.245 1.851 3.855 580 HD2 PHE 88 HD2 PHE 88 90.166 1.259 6.794 581 HE1 PHE 88 HE1 PHE 88 92.077 3.877 3.042 582 HE2 PHE 88 HE2 PHE 88 88.997 3.284 5.975 583 HZ PHE 88 HZ PHE 88 89.953 4.596 4.099 584 H ASP 89 HN ASP 89 94.485 3.011 6.058 585 HA ASP 89 HA ASP 89 93.370 3.967 8.610 586 HB2 ASP 89 HB2 ASP 89 95.819 3.650 8.876 587 HB3 ASP 89 HB1 ASP 89 96.084 4.745 7.526 588 HA PRO 90 HA PRO 90 91.912 6.554 5.136 589 HB2 PRO 90 HB2 PRO 90 89.909 7.902 6.495 590 HB3 PRO 90 HB1 PRO 90 89.711 6.304 5.751 591 HG2 PRO 90 HG2 PRO 90 90.154 7.020 8.604 592 HG3 PRO 90 HG1 PRO 90 89.172 5.722 7.904 593 HD2 PRO 90 HD2 PRO 90 91.653 5.320 9.021 594 HD3 PRO 90 HD1 PRO 90 90.968 4.262 7.768 595 H GLU 91 HN GLU 91 93.014 7.576 8.257 596 HA GLU 91 HA GLU 91 93.067 10.384 7.787 597 HB2 GLU 91 HB2 GLU 91 93.201 9.205 10.020 598 HB3 GLU 91 HB1 GLU 91 94.871 8.813 9.631 599 HG2 GLU 91 HG2 GLU 91 94.927 10.812 10.946 600 HG3 GLU 91 HG1 GLU 91 95.249 11.308 9.290 601 H ALA 92 HN ALA 92 94.985 7.803 6.580 602 HA ALA 92 HA ALA 92 96.890 9.758 5.433 603 HB1 ALA 92 HB1 ALA 92 97.594 7.176 6.834 604 HB2 ALA 92 HB2 ALA 92 98.075 8.807 7.296 605 HB3 ALA 92 HB3 ALA 92 98.713 8.082 5.822 606 H CYS 93 HN CYS 93 95.220 6.693 5.209 607 HA CYS 93 HA CYS 93 96.435 5.994 2.679 608 HB2 CYS 93 HB2 CYS 93 94.047 4.710 3.995 609 HB3 CYS 93 HB1 CYS 93 95.120 4.008 2.783 610 H SER 94 HN SER 94 93.843 7.984 3.641 611 HA SER 94 HA SER 94 92.308 7.635 1.194 612 HB2 SER 94 HB2 SER 94 92.062 9.718 3.378 613 HB3 SER 94 HB1 SER 94 90.918 9.452 2.071 614 HG SER 94 HG SER 94 91.589 7.203 3.506 615 H PHE 95 HN PHE 95 92.273 9.070 -0.523 616 HA PHE 95 HA PHE 95 94.113 11.380 -0.456 617 HB2 PHE 95 HB2 PHE 95 94.047 9.322 -2.673 618 HB3 PHE 95 HB1 PHE 95 95.052 10.763 -2.610 619 HD1 PHE 95 HD1 PHE 95 94.612 7.339 -1.432 620 HD2 PHE 95 HD2 PHE 95 96.902 10.940 -0.945 621 HE1 PHE 95 HE1 PHE 95 96.363 6.057 -0.254 622 HE2 PHE 95 HE2 PHE 95 98.662 9.656 0.240 623 HZ PHE 95 HZ PHE 95 98.400 7.213 0.580 624 H ARG 96 HN ARG 96 93.536 13.044 -1.859 625 HA ARG 96 HA ARG 96 90.782 12.934 -2.867 626 HB2 ARG 96 HB2 ARG 96 91.627 14.865 -1.432 627 HB3 ARG 96 HB1 ARG 96 92.651 15.318 -2.790 628 HG2 ARG 96 HG2 ARG 96 90.744 16.641 -3.140 629 HG3 ARG 96 HG1 ARG 96 90.432 15.254 -4.180 630 HD2 ARG 96 HD2 ARG 96 88.995 14.251 -2.473 631 HD3 ARG 96 HD1 ARG 96 89.391 15.537 -1.343 632 HE ARG 96 HE ARG 96 88.326 16.775 -3.589 633 HH11 ARG 96 HH11 ARG 96 86.105 17.291 -3.683 634 HH12 ARG 96 HH12 ARG 96 84.979 16.427 -2.688 635 HH21 ARG 96 HH21 ARG 96 87.394 14.413 -1.237 636 HH22 ARG 96 HH22 ARG 96 85.708 14.803 -1.305 637 H GLU 97 HN GLU 97 90.318 12.849 -5.009 638 HA GLU 97 HA GLU 97 92.565 12.521 -6.859 639 HB2 GLU 97 HB2 GLU 97 90.616 10.931 -6.788 640 HB3 GLU 97 HB1 GLU 97 89.607 12.234 -7.414 641 HG2 GLU 97 HG2 GLU 97 91.075 12.420 -9.388 642 HG3 GLU 97 HG1 GLU 97 92.069 11.101 -8.769 643 H LEU 98 HN LEU 98 93.379 14.425 -7.526 644 HA LEU 98 HA LEU 98 91.629 16.678 -8.194 645 HB2 LEU 98 HB2 LEU 98 94.637 16.467 -8.471 646 HB3 LEU 98 HB1 LEU 98 93.666 17.939 -8.423 647 HG LEU 98 HG LEU 98 94.027 15.956 -6.157 648 HD11 LEU 98 HD11 LEU 98 95.020 18.068 -5.076 649 HD12 LEU 98 HD12 LEU 98 95.085 18.732 -6.709 650 HD13 LEU 98 HD13 LEU 98 95.994 17.274 -6.313 651 HD21 LEU 98 HD21 LEU 98 91.837 16.781 -5.874 652 HD22 LEU 98 HD22 LEU 98 92.255 18.376 -6.501 653 HD23 LEU 98 HD23 LEU 98 92.806 17.884 -4.900 654 H LEU 99 HN LEU 99 91.127 17.284 -10.268 655 HA LEU 99 HA LEU 99 92.421 15.796 -12.489 656 HB2 LEU 99 HB2 LEU 99 89.598 16.030 -11.745 657 HB3 LEU 99 HB1 LEU 99 89.867 16.541 -13.406 658 HG LEU 99 HG LEU 99 89.363 14.095 -13.173 659 HD11 LEU 99 HD11 LEU 99 91.013 15.253 -14.945 660 HD12 LEU 99 HD12 LEU 99 90.752 13.512 -14.915 661 HD13 LEU 99 HD13 LEU 99 92.187 14.197 -14.159 662 HD21 LEU 99 HD21 LEU 99 90.610 12.657 -11.891 663 HD22 LEU 99 HD22 LEU 99 90.912 14.119 -10.960 664 HD23 LEU 99 HD23 LEU 99 92.108 13.553 -12.126 665 H LEU 100 HN LEU 100 92.948 16.861 -14.302 666 HA LEU 100 HA LEU 100 92.783 19.820 -14.207 667 HB2 LEU 100 HB2 LEU 100 94.801 17.943 -15.466 668 HB3 LEU 100 HB1 LEU 100 94.742 19.669 -15.817 669 HG LEU 100 HG LEU 100 94.830 19.941 -13.206 670 HD11 LEU 100 HD11 LEU 100 94.565 17.623 -12.569 671 HD12 LEU 100 HD12 LEU 100 96.201 18.123 -12.154 672 HD13 LEU 100 HD13 LEU 100 95.919 17.143 -13.591 673 HD21 LEU 100 HD21 LEU 100 97.356 19.769 -13.300 674 HD22 LEU 100 HD22 LEU 100 96.627 20.742 -14.577 675 HD23 LEU 100 HD23 LEU 100 97.173 19.102 -14.921 676 H GLU 101 HN GLU 101 92.212 20.953 -16.066 677 HA GLU 101 HA GLU 101 90.271 19.782 -17.743 678 HB2 GLU 101 HB2 GLU 101 90.551 21.854 -19.113 679 HB3 GLU 101 HB1 GLU 101 90.325 22.187 -17.395 680 HG2 GLU 101 HG2 GLU 101 92.796 22.367 -17.137 681 HG3 GLU 101 HG1 GLU 101 92.970 22.130 -18.876 682 H ASP 102 HN ASP 102 93.680 19.819 -17.795 683 HA ASP 102 HA ASP 102 94.032 19.295 -20.599 684 HB2 ASP 102 HB2 ASP 102 95.878 19.064 -18.218 685 HB3 ASP 102 HB1 ASP 102 96.375 18.759 -19.878 686 H GLY 103 HN GLY 103 92.869 17.441 -18.054 687 HA2 GLY 103 HA2 GLY 103 92.157 15.221 -18.185 688 HA3 GLY 103 HA1 GLY 103 93.147 15.002 -19.621 689 H TYR 104 HN TYR 104 94.610 16.425 -16.789 690 HA TYR 104 HA TYR 104 96.147 13.913 -16.377 691 HB2 TYR 104 HB2 TYR 104 96.812 16.813 -15.844 692 HB3 TYR 104 HB1 TYR 104 97.759 15.481 -15.182 693 HD1 TYR 104 HD1 TYR 104 96.336 16.697 -18.430 694 HD2 TYR 104 HD2 TYR 104 99.505 14.567 -16.464 695 HE1 TYR 104 HE1 TYR 104 97.528 16.479 -20.593 696 HE2 TYR 104 HE2 TYR 104 100.702 14.353 -18.627 697 HH TYR 104 HH TYR 104 99.249 14.893 -21.587 698 H ASN 105 HN ASN 105 96.534 13.213 -14.200 699 HA ASN 105 HA ASN 105 94.634 14.327 -12.209 700 HB2 ASN 105 HB2 ASN 105 95.234 11.386 -12.438 701 HB3 ASN 105 HB1 ASN 105 93.925 12.181 -11.562 702 HD21 ASN 105 HD21 ASN 105 92.099 11.367 -12.643 703 HD22 ASN 105 HD22 ASN 105 91.835 11.550 -14.310 704 H VAL 106 HN VAL 106 95.338 14.569 -10.201 705 HA VAL 106 HA VAL 106 97.959 13.437 -9.422 706 HB VAL 106 HB VAL 106 97.093 16.211 -8.597 707 HG11 VAL 106 HG11 VAL 106 98.959 14.871 -7.448 708 HG12 VAL 106 HG12 VAL 106 99.392 16.478 -8.025 709 HG13 VAL 106 HG13 VAL 106 99.867 15.052 -8.949 710 HG21 VAL 106 HG21 VAL 106 97.135 16.205 -11.058 711 HG22 VAL 106 HG22 VAL 106 98.722 15.435 -11.043 712 HG23 VAL 106 HG23 VAL 106 98.534 17.079 -10.433 713 H TYR 107 HN TYR 107 98.187 13.207 -7.089 714 HA TYR 107 HA TYR 107 95.568 13.024 -5.690 715 HB2 TYR 107 HB2 TYR 107 97.990 11.231 -5.463 716 HB3 TYR 107 HB1 TYR 107 96.544 11.112 -4.459 717 HD1 TYR 107 HD1 TYR 107 97.878 10.771 -7.891 718 HD2 TYR 107 HD2 TYR 107 94.465 10.242 -5.340 719 HE1 TYR 107 HE1 TYR 107 96.760 9.448 -9.665 720 HE2 TYR 107 HE2 TYR 107 93.345 8.916 -7.113 721 HH TYR 107 HH TYR 107 93.461 8.181 -9.211 722 H GLN 108 HN GLN 108 95.442 13.565 -3.565 723 HA GLN 108 HA GLN 108 97.798 14.599 -2.157 724 HB2 GLN 108 HB2 GLN 108 96.943 16.553 -3.351 725 HB3 GLN 108 HB1 GLN 108 95.317 16.242 -2.747 726 HG2 GLN 108 HG2 GLN 108 96.070 16.624 -0.445 727 HG3 GLN 108 HG1 GLN 108 97.726 16.848 -1.006 728 HE21 GLN 108 HE21 GLN 108 95.775 18.795 0.335 729 HE22 GLN 108 HE22 GLN 108 95.750 20.136 -0.704 730 H SER 109 HN SER 109 97.663 14.177 0.017 731 HA SER 109 HA SER 109 95.641 12.461 0.994 732 HB2 SER 109 HB2 SER 109 97.993 12.742 1.924 733 HB3 SER 109 HB1 SER 109 97.412 14.213 2.700 734 HG SER 109 HG SER 109 96.636 11.535 3.116 735 H GLU 110 HN GLU 110 93.615 12.933 1.527 736 HA GLU 110 HA GLU 110 92.641 15.605 1.671 737 HB2 GLU 110 HB2 GLU 110 90.501 14.544 2.222 738 HB3 GLU 110 HB1 GLU 110 91.277 13.724 0.872 739 HG2 GLU 110 HG2 GLU 110 90.714 11.876 2.156 740 HG3 GLU 110 HG1 GLU 110 92.307 12.212 2.825 741 H ALA 111 HN ALA 111 93.658 13.247 4.044 742 HA ALA 111 HA ALA 111 92.448 14.307 6.335 743 HB1 ALA 111 HB1 ALA 111 93.600 12.080 6.095 744 HB2 ALA 111 HB2 ALA 111 93.977 12.960 7.578 745 HB3 ALA 111 HB3 ALA 111 95.130 12.946 6.241 746 H HIS 112 HN HIS 112 95.790 14.887 5.176 747 HA HIS 112 HA HIS 112 95.904 17.258 6.963 748 HB2 HIS 112 HB2 HIS 112 97.934 15.212 6.130 749 HB3 HIS 112 HB1 HIS 112 98.475 16.826 6.573 750 HD2 HIS 112 HD2 HIS 112 99.570 15.508 8.966 751 HE1 HIS 112 HE1 HIS 112 95.784 15.163 10.802 752 HE2 HIS 112 HE2 HIS 112 98.290 15.022 11.189 753 H GLY 113 HN GLY 113 95.779 16.335 3.697 754 HA2 GLY 113 HA2 GLY 113 95.749 17.764 1.840 755 HA3 GLY 113 HA1 GLY 113 96.295 19.072 2.875 756 H LEU 114 HN LEU 114 98.085 16.126 3.055 757 HA LEU 114 HA LEU 114 100.459 17.427 2.116 758 HB2 LEU 114 HB2 LEU 114 99.910 14.546 2.843 759 HB3 LEU 114 HB1 LEU 114 101.508 15.177 2.457 760 HG LEU 114 HG LEU 114 99.912 16.607 4.571 761 HD11 LEU 114 HD11 LEU 114 100.644 15.087 6.311 762 HD12 LEU 114 HD12 LEU 114 101.504 14.090 5.140 763 HD13 LEU 114 HD13 LEU 114 99.744 14.157 5.116 764 HD21 LEU 114 HD21 LEU 114 102.850 15.877 4.571 765 HD22 LEU 114 HD22 LEU 114 102.050 17.224 5.383 766 HD23 LEU 114 HD23 LEU 114 102.250 17.246 3.632 767 HA PRO 115 HA PRO 115 99.867 16.196 -2.159 768 HB2 PRO 115 HB2 PRO 115 102.305 16.792 -3.180 769 HB3 PRO 115 HB1 PRO 115 101.181 18.064 -2.649 770 HG2 PRO 115 HG2 PRO 115 103.516 16.884 -1.193 771 HG3 PRO 115 HG1 PRO 115 103.061 18.588 -1.385 772 HD2 PRO 115 HD2 PRO 115 102.461 17.164 0.872 773 HD3 PRO 115 HD1 PRO 115 101.430 18.483 0.273 774 H LEU 116 HN LEU 116 100.459 14.487 -3.616 775 HA LEU 116 HA LEU 116 102.070 12.337 -2.354 776 HB2 LEU 116 HB2 LEU 116 99.586 11.965 -2.890 777 HB3 LEU 116 HB1 LEU 116 100.054 12.000 -4.584 778 HG LEU 116 HG LEU 116 101.474 10.163 -2.644 779 HD11 LEU 116 HD11 LEU 116 99.064 9.725 -2.401 780 HD12 LEU 116 HD12 LEU 116 99.885 8.387 -3.205 781 HD13 LEU 116 HD13 LEU 116 98.925 9.527 -4.150 782 HD21 LEU 116 HD21 LEU 116 102.580 10.204 -4.741 783 HD22 LEU 116 HD22 LEU 116 101.068 10.262 -5.644 784 HD23 LEU 116 HD23 LEU 116 101.555 8.777 -4.837 785 H HIS 117 HN HIS 117 103.999 12.008 -3.214 786 HA HIS 117 HA HIS 117 104.396 12.090 -6.099 787 HB2 HIS 117 HB2 HIS 117 106.377 13.626 -5.851 788 HB3 HIS 117 HB1 HIS 117 104.818 14.408 -5.588 789 HD2 HIS 117 HD2 HIS 117 104.287 15.121 -2.862 790 HE1 HIS 117 HE1 HIS 117 108.160 14.218 -1.448 791 HE2 HIS 117 HE2 HIS 117 105.949 15.318 -0.858 792 H LEU 118 HN LEU 118 106.623 11.319 -6.676 793 HA LEU 118 HA LEU 118 107.260 9.009 -5.133 794 HB2 LEU 118 HB2 LEU 118 108.713 10.331 -7.440 795 HB3 LEU 118 HB1 LEU 118 109.178 8.782 -6.749 796 HG LEU 118 HG LEU 118 106.470 9.401 -7.966 797 HD11 LEU 118 HD11 LEU 118 107.190 8.001 -9.823 798 HD12 LEU 118 HD12 LEU 118 108.728 7.670 -9.021 799 HD13 LEU 118 HD13 LEU 118 108.366 9.298 -9.599 800 HD21 LEU 118 HD21 LEU 118 106.571 6.711 -7.876 801 HD22 LEU 118 HD22 LEU 118 105.956 7.659 -6.528 802 HD23 LEU 118 HD23 LEU 118 107.610 7.047 -6.491 803 HA PRO 119 HA PRO 119 110.182 10.826 -2.338 804 HB2 PRO 119 HB2 PRO 119 111.729 8.691 -1.684 805 HB3 PRO 119 HB1 PRO 119 110.030 8.816 -1.178 806 HG2 PRO 119 HG2 PRO 119 111.198 7.323 -3.498 807 HG3 PRO 119 HG1 PRO 119 110.017 6.772 -2.292 808 HD2 PRO 119 HD2 PRO 119 109.251 7.636 -4.751 809 HD3 PRO 119 HD1 PRO 119 108.247 7.908 -3.311 810 H GLY 120 HN GLY 120 112.206 11.785 -2.329 811 HA2 GLY 120 HA2 GLY 120 113.823 11.461 -4.780 812 HA3 GLY 120 HA1 GLY 120 113.825 12.861 -3.714 813 H ASN 121 HN ASN 121 113.919 9.655 -2.345 814 HA ASN 121 HA ASN 121 116.247 10.188 -0.849 815 HB2 ASN 121 HB2 ASN 121 115.151 7.465 -1.591 816 HB3 ASN 121 HB1 ASN 121 116.173 7.857 -0.211 817 HD21 ASN 121 HD21 ASN 121 114.100 10.454 -0.593 818 HD22 ASN 121 HD22 ASN 121 112.876 9.975 0.482 819 H LYS 122 HN LYS 122 115.779 8.151 -3.749 820 HA LYS 122 HA LYS 122 118.629 7.713 -4.014 821 HB2 LYS 122 HB2 LYS 122 116.279 6.940 -5.750 822 HB3 LYS 122 HB1 LYS 122 117.955 6.559 -6.151 823 HG2 LYS 122 HG2 LYS 122 118.202 5.378 -3.992 824 HG3 LYS 122 HG1 LYS 122 116.521 5.741 -3.607 825 HD2 LYS 122 HD2 LYS 122 115.780 4.463 -5.576 826 HD3 LYS 122 HD1 LYS 122 117.460 4.118 -5.990 827 HE2 LYS 122 HE2 LYS 122 116.164 3.336 -3.365 828 HE3 LYS 122 HE1 LYS 122 116.346 2.248 -4.741 829 HZ1 LYS 122 HZ1 LYS 122 118.407 1.834 -4.094 830 HZ2 LYS 122 HZ2 LYS 122 118.236 2.895 -2.777 831 HZ3 LYS 122 HZ3 LYS 122 118.812 3.471 -4.268 832 H SER 123 HN SER 123 116.163 9.694 -5.620 833 HA SER 123 HA SER 123 118.096 10.709 -7.536 834 HB2 SER 123 HB2 SER 123 116.279 11.586 -8.663 835 HB3 SER 123 HB1 SER 123 115.449 10.341 -7.736 836 HG SER 123 HG SER 123 115.270 12.084 -6.079 837 HA PRO 124 HA PRO 124 119.365 14.337 -5.378 838 HB2 PRO 124 HB2 PRO 124 118.336 16.230 -7.428 839 HB3 PRO 124 HB1 PRO 124 120.006 15.932 -6.912 840 HG2 PRO 124 HG2 PRO 124 119.079 15.115 -9.302 841 HG3 PRO 124 HG1 PRO 124 120.300 14.203 -8.397 842 HD2 PRO 124 HD2 PRO 124 117.368 13.640 -8.701 843 HD3 PRO 124 HD1 PRO 124 118.737 12.511 -8.638 844 H HIS 125 HN HIS 125 118.582 15.763 -3.827 845 HA HIS 125 HA HIS 125 115.787 15.685 -3.266 846 HB2 HIS 125 HB2 HIS 125 117.962 17.427 -2.075 847 HB3 HIS 125 HB1 HIS 125 116.344 17.210 -1.407 848 HD2 HIS 125 HD2 HIS 125 119.763 15.434 -1.345 849 HE1 HIS 125 HE1 HIS 125 116.977 12.722 0.298 850 HE2 HIS 125 HE2 HIS 125 119.447 13.174 -0.077 851 H ARG 126 HN ARG 126 114.224 16.938 -4.021 852 HA ARG 126 HA ARG 126 114.904 19.603 -5.151 853 HB2 ARG 126 HB2 ARG 126 114.390 17.892 -6.900 854 HB3 ARG 126 HB1 ARG 126 112.805 17.666 -6.164 855 HG2 ARG 126 HG2 ARG 126 112.303 20.061 -6.539 856 HG3 ARG 126 HG1 ARG 126 113.874 20.260 -7.311 857 HD2 ARG 126 HD2 ARG 126 113.256 18.579 -9.006 858 HD3 ARG 126 HD1 ARG 126 111.683 18.383 -8.240 859 HE ARG 126 HE ARG 126 112.187 21.117 -8.939 860 HH11 ARG 126 HH11 ARG 126 110.988 21.952 -10.682 861 HH12 ARG 126 HH12 ARG 126 110.199 20.871 -11.779 862 HH21 ARG 126 HH21 ARG 126 111.283 18.007 -10.157 863 HH22 ARG 126 HH22 ARG 126 110.363 18.638 -11.482 864 H ASP 127 HN ASP 127 113.947 21.176 -4.058 865 HA ASP 127 HA ASP 127 111.333 20.677 -2.736 866 HB2 ASP 127 HB2 ASP 127 113.261 20.761 -1.143 867 HB3 ASP 127 HB1 ASP 127 113.573 22.410 -1.683 868 HA PRO 128 HA PRO 128 110.960 24.433 -5.388 869 HB2 PRO 128 HB2 PRO 128 108.532 23.932 -6.466 870 HB3 PRO 128 HB1 PRO 128 110.000 23.127 -7.062 871 HG2 PRO 128 HG2 PRO 128 107.882 22.084 -5.233 872 HG3 PRO 128 HG1 PRO 128 108.728 21.265 -6.559 873 HD2 PRO 128 HD2 PRO 128 109.390 20.983 -3.874 874 HD3 PRO 128 HD1 PRO 128 110.518 20.678 -5.211 875 H ALA 129 HN ALA 129 109.804 26.348 -4.990 876 HA ALA 129 HA ALA 129 108.575 26.558 -2.414 877 HB1 ALA 129 HB1 ALA 129 109.445 28.391 -4.548 878 HB2 ALA 129 HB2 ALA 129 109.497 28.608 -2.802 879 HB3 ALA 129 HB3 ALA 129 108.013 28.954 -3.687 880 HA PRO 130 HA PRO 130 104.476 27.364 -4.774 881 HB2 PRO 130 HB2 PRO 130 104.414 26.951 -7.489 882 HB3 PRO 130 HB1 PRO 130 104.838 28.515 -6.761 883 HG2 PRO 130 HG2 PRO 130 106.649 26.352 -7.770 884 HG3 PRO 130 HG1 PRO 130 106.725 28.104 -8.057 885 HD2 PRO 130 HD2 PRO 130 108.300 26.936 -6.212 886 HD3 PRO 130 HD1 PRO 130 107.607 28.549 -5.938 887 H ARG 131 HN ARG 131 102.823 25.800 -5.059 888 HA ARG 131 HA ARG 131 103.494 23.133 -4.527 889 HB2 ARG 131 HB2 ARG 131 101.223 24.464 -4.288 890 HB3 ARG 131 HB1 ARG 131 100.908 23.825 -5.893 891 HG2 ARG 131 HG2 ARG 131 99.995 22.156 -4.528 892 HG3 ARG 131 HG1 ARG 131 101.602 21.520 -4.864 893 HD2 ARG 131 HD2 ARG 131 101.136 23.220 -2.411 894 HD3 ARG 131 HD1 ARG 131 100.721 21.514 -2.400 895 HE ARG 131 HE ARG 131 103.325 21.712 -3.387 896 HH11 ARG 131 HH11 ARG 131 105.080 21.336 -1.996 897 HH12 ARG 131 HH12 ARG 131 104.881 21.533 -0.287 898 HH21 ARG 131 HH21 ARG 131 101.543 22.436 -0.509 899 HH22 ARG 131 HH22 ARG 131 102.881 22.154 0.553 900 H GLY 132 HN GLY 132 104.651 21.875 -5.862 901 HA2 GLY 132 HA2 GLY 132 103.804 21.663 -8.698 902 HA3 GLY 132 HA1 GLY 132 105.503 21.839 -8.276 903 HA PRO 133 HA PRO 133 104.284 17.468 -6.810 904 HB2 PRO 133 HB2 PRO 133 101.787 16.533 -7.230 905 HB3 PRO 133 HB1 PRO 133 102.157 17.609 -5.867 906 HG2 PRO 133 HG2 PRO 133 100.853 18.242 -8.475 907 HG3 PRO 133 HG1 PRO 133 100.488 18.859 -6.854 908 HD2 PRO 133 HD2 PRO 133 102.011 20.211 -8.778 909 HD3 PRO 133 HD1 PRO 133 102.042 20.560 -7.035 910 H ALA 134 HN ALA 134 104.306 15.371 -7.913 911 HA ALA 134 HA ALA 134 104.937 15.574 -10.698 912 HB1 ALA 134 HB1 ALA 134 105.340 13.193 -10.588 913 HB2 ALA 134 HB2 ALA 134 104.438 13.065 -9.078 914 HB3 ALA 134 HB3 ALA 134 105.978 13.925 -9.115 915 H ARG 135 HN ARG 135 103.661 15.243 -12.431 916 HA ARG 135 HA ARG 135 100.813 14.950 -12.042 917 HB2 ARG 135 HB2 ARG 135 102.475 15.039 -14.578 918 HB3 ARG 135 HB1 ARG 135 100.715 15.167 -14.495 919 HG2 ARG 135 HG2 ARG 135 100.906 17.186 -13.112 920 HG3 ARG 135 HG1 ARG 135 102.663 17.052 -13.138 921 HD2 ARG 135 HD2 ARG 135 102.118 18.657 -14.810 922 HD3 ARG 135 HD1 ARG 135 102.502 17.175 -15.681 923 HE ARG 135 HE ARG 135 99.726 17.245 -15.162 924 HH11 ARG 135 HH11 ARG 135 98.328 17.798 -16.857 925 HH12 ARG 135 HH12 ARG 135 98.930 18.687 -18.216 926 HH21 ARG 135 HH21 ARG 135 102.180 18.838 -17.014 927 HH22 ARG 135 HH22 ARG 135 101.111 19.282 -18.302 928 H PHE 136 HN PHE 136 99.662 13.134 -12.145 929 HA PHE 136 HA PHE 136 101.029 10.646 -13.013 930 HB2 PHE 136 HB2 PHE 136 99.206 11.304 -10.741 931 HB3 PHE 136 HB1 PHE 136 98.975 9.727 -11.494 932 HD1 PHE 136 HD1 PHE 136 101.016 11.668 -9.222 933 HD2 PHE 136 HD2 PHE 136 101.012 8.227 -11.798 934 HE1 PHE 136 HE1 PHE 136 102.986 10.755 -8.019 935 HE2 PHE 136 HE2 PHE 136 102.976 7.322 -10.596 936 HZ PHE 136 HZ PHE 136 103.966 8.583 -8.711 937 H LEU 137 HN LEU 137 100.006 9.263 -14.370 938 HA LEU 137 HA LEU 137 97.438 10.148 -15.558 939 HB2 LEU 137 HB2 LEU 137 100.033 9.410 -16.789 940 HB3 LEU 137 HB1 LEU 137 98.620 8.709 -17.572 941 HG LEU 137 HG LEU 137 98.627 11.650 -16.890 942 HD11 LEU 137 HD11 LEU 137 99.597 12.138 -19.107 943 HD12 LEU 137 HD12 LEU 137 99.874 10.416 -19.365 944 HD13 LEU 137 HD13 LEU 137 100.745 11.267 -18.090 945 HD21 LEU 137 HD21 LEU 137 97.431 10.058 -19.186 946 HD22 LEU 137 HD22 LEU 137 97.117 11.754 -18.815 947 HD23 LEU 137 HD23 LEU 137 96.567 10.492 -17.711 948 HA PRO 138 HA PRO 138 96.552 5.950 -14.077 949 HB2 PRO 138 HB2 PRO 138 93.854 5.990 -14.334 950 HB3 PRO 138 HB1 PRO 138 94.689 6.877 -13.046 951 HG2 PRO 138 HG2 PRO 138 93.554 7.883 -15.616 952 HG3 PRO 138 HG1 PRO 138 93.522 8.622 -14.004 953 HD2 PRO 138 HD2 PRO 138 95.311 9.336 -16.004 954 HD3 PRO 138 HD1 PRO 138 95.604 9.583 -14.268 955 H LEU 139 HN LEU 139 97.084 4.298 -15.401 956 HA LEU 139 HA LEU 139 95.991 4.175 -18.133 957 HB2 LEU 139 HB2 LEU 139 97.916 2.097 -17.200 958 HB3 LEU 139 HB1 LEU 139 97.843 2.954 -18.732 959 HG LEU 139 HG LEU 139 98.823 4.137 -16.113 960 HD11 LEU 139 HD11 LEU 139 101.024 4.123 -17.302 961 HD12 LEU 139 HD12 LEU 139 100.274 3.208 -18.609 962 HD13 LEU 139 HD13 LEU 139 100.400 2.500 -16.998 963 HD21 LEU 139 HD21 LEU 139 98.825 5.234 -18.941 964 HD22 LEU 139 HD22 LEU 139 99.526 6.023 -17.530 965 HD23 LEU 139 HD23 LEU 139 97.784 5.796 -17.637 966 HA PRO 140 HA PRO 140 92.878 1.385 -16.253 967 HB2 PRO 140 HB2 PRO 140 92.422 0.740 -19.145 968 HB3 PRO 140 HB1 PRO 140 91.244 1.150 -17.883 969 HG2 PRO 140 HG2 PRO 140 91.970 2.910 -19.773 970 HG3 PRO 140 HG1 PRO 140 91.578 3.413 -18.119 971 HD2 PRO 140 HD2 PRO 140 94.247 3.260 -19.449 972 HD3 PRO 140 HD1 PRO 140 93.701 4.310 -18.124 973 H GLY 141 HN GLY 141 93.080 -0.709 -15.635 974 HA2 GLY 141 HA2 GLY 141 95.213 -2.335 -16.836 975 HA3 GLY 141 HA1 GLY 141 94.413 -2.627 -15.294 Start of MODEL 7 1 H1 GLY 13 HT1 GLY 13 79.291 0.415 -3.142 2 H2 GLY 13 HT2 GLY 13 79.110 0.164 -4.811 3 H3 GLY 13 HT3 GLY 13 79.962 1.518 -4.244 4 HA2 GLY 13 HA2 GLY 13 81.683 0.101 -3.328 5 HA3 GLY 13 HA1 GLY 13 80.792 -1.312 -3.896 6 H GLN 14 HN GLN 14 82.296 1.707 -5.022 7 HA GLN 14 HA GLN 14 82.548 0.606 -7.743 8 HB2 GLN 14 HB2 GLN 14 81.656 2.888 -7.486 9 HB3 GLN 14 HB1 GLN 14 83.139 3.372 -6.668 10 HG2 GLN 14 HG2 GLN 14 84.440 2.817 -8.696 11 HG3 GLN 14 HG1 GLN 14 82.954 2.331 -9.512 12 HE21 GLN 14 HE21 GLN 14 82.011 3.964 -10.743 13 HE22 GLN 14 HE22 GLN 14 82.223 5.627 -10.481 14 H VAL 15 HN VAL 15 84.280 -0.656 -7.995 15 HA VAL 15 HA VAL 15 86.904 0.395 -7.147 16 HB VAL 15 HB VAL 15 86.395 -1.164 -5.439 17 HG11 VAL 15 HG11 VAL 15 85.670 -3.495 -5.981 18 HG12 VAL 15 HG12 VAL 15 85.557 -3.026 -7.677 19 HG13 VAL 15 HG13 VAL 15 84.498 -2.275 -6.483 20 HG21 VAL 15 HG21 VAL 15 88.659 -1.383 -6.635 21 HG22 VAL 15 HG22 VAL 15 87.986 -2.807 -7.424 22 HG23 VAL 15 HG23 VAL 15 88.151 -2.766 -5.669 23 H ARG 16 HN ARG 16 88.454 0.198 -8.592 24 HA ARG 16 HA ARG 16 88.230 -1.718 -10.805 25 HB2 ARG 16 HB2 ARG 16 88.424 1.278 -11.197 26 HB3 ARG 16 HB1 ARG 16 88.781 0.099 -12.457 27 HG2 ARG 16 HG2 ARG 16 86.497 -0.817 -12.250 28 HG3 ARG 16 HG1 ARG 16 86.141 0.361 -10.987 29 HD2 ARG 16 HD2 ARG 16 85.280 1.187 -13.109 30 HD3 ARG 16 HD1 ARG 16 86.629 2.195 -12.594 31 HE ARG 16 HE ARG 16 87.568 0.102 -14.272 32 HH11 ARG 16 HH11 ARG 16 88.164 0.657 -16.393 33 HH12 ARG 16 HH12 ARG 16 87.571 2.125 -17.097 34 HH21 ARG 16 HH21 ARG 16 85.758 3.049 -14.288 35 HH22 ARG 16 HH22 ARG 16 86.203 3.477 -15.907 36 H GLN 17 HN GLN 17 90.235 -1.990 -11.974 37 HA GLN 17 HA GLN 17 92.583 -1.362 -10.292 38 HB2 GLN 17 HB2 GLN 17 92.858 -3.348 -12.488 39 HB3 GLN 17 HB1 GLN 17 93.436 -3.422 -10.828 40 HG2 GLN 17 HG2 GLN 17 91.169 -3.958 -10.050 41 HG3 GLN 17 HG1 GLN 17 90.566 -3.849 -11.704 42 HE21 GLN 17 HE21 GLN 17 91.983 -5.283 -13.307 43 HE22 GLN 17 HE22 GLN 17 92.320 -6.852 -12.743 44 H ARG 18 HN ARG 18 94.185 -0.074 -11.034 45 HA ARG 18 HA ARG 18 94.447 0.443 -13.916 46 HB2 ARG 18 HB2 ARG 18 93.997 2.667 -11.906 47 HB3 ARG 18 HB1 ARG 18 94.345 2.873 -13.618 48 HG2 ARG 18 HG2 ARG 18 92.254 1.647 -14.170 49 HG3 ARG 18 HG1 ARG 18 91.894 1.532 -12.449 50 HD2 ARG 18 HD2 ARG 18 92.068 4.069 -12.368 51 HD3 ARG 18 HD1 ARG 18 92.064 4.032 -14.129 52 HE ARG 18 HE ARG 18 89.885 2.550 -12.955 53 HH11 ARG 18 HH11 ARG 18 87.813 3.418 -13.231 54 HH12 ARG 18 HH12 ARG 18 87.627 5.047 -13.786 55 HH21 ARG 18 HH21 ARG 18 91.037 5.639 -14.013 56 HH22 ARG 18 HH22 ARG 18 89.453 6.306 -14.226 57 H TYR 19 HN TYR 19 96.421 1.647 -14.448 58 HA TYR 19 HA TYR 19 98.611 1.132 -12.517 59 HB2 TYR 19 HB2 TYR 19 98.638 1.716 -15.493 60 HB3 TYR 19 HB1 TYR 19 100.086 1.579 -14.507 61 HD1 TYR 19 HD1 TYR 19 97.149 -0.279 -15.812 62 HD2 TYR 19 HD2 TYR 19 100.942 -0.550 -13.806 63 HE1 TYR 19 HE1 TYR 19 97.158 -2.744 -16.141 64 HE2 TYR 19 HE2 TYR 19 100.933 -3.009 -14.126 65 HH TYR 19 HH TYR 19 98.691 -4.577 -16.216 66 H LEU 20 HN LEU 20 99.885 2.818 -11.735 67 HA LEU 20 HA LEU 20 98.949 5.546 -12.379 68 HB2 LEU 20 HB2 LEU 20 99.737 4.243 -9.933 69 HB3 LEU 20 HB1 LEU 20 100.869 5.557 -10.224 70 HG LEU 20 HG LEU 20 98.878 7.075 -10.587 71 HD11 LEU 20 HD11 LEU 20 96.749 6.148 -9.424 72 HD12 LEU 20 HD12 LEU 20 97.448 4.560 -9.734 73 HD13 LEU 20 HD13 LEU 20 97.077 5.637 -11.077 74 HD21 LEU 20 HD21 LEU 20 98.974 5.718 -7.875 75 HD22 LEU 20 HD22 LEU 20 98.478 7.377 -8.209 76 HD23 LEU 20 HD23 LEU 20 100.161 6.897 -8.434 77 H TYR 21 HN TYR 21 100.039 6.744 -13.692 78 HA TYR 21 HA TYR 21 102.974 6.484 -13.892 79 HB2 TYR 21 HB2 TYR 21 102.323 5.265 -15.798 80 HB3 TYR 21 HB1 TYR 21 100.946 6.313 -16.116 81 HD1 TYR 21 HD1 TYR 21 104.687 6.508 -15.814 82 HD2 TYR 21 HD2 TYR 21 101.155 7.919 -17.811 83 HE1 TYR 21 HE1 TYR 21 106.085 7.897 -17.319 84 HE2 TYR 21 HE2 TYR 21 102.552 9.297 -19.315 85 HH TYR 21 HH TYR 21 105.959 8.944 -19.503 86 H THR 22 HN THR 22 104.008 8.416 -13.910 87 HA THR 22 HA THR 22 102.423 10.870 -14.425 88 HB THR 22 HB THR 22 102.699 10.752 -12.037 89 HG1 THR 22 HG1 THR 22 104.747 12.424 -12.247 90 HG21 THR 22 HG21 THR 22 104.527 9.092 -12.066 91 HG22 THR 22 HG22 THR 22 104.903 10.463 -11.022 92 HG23 THR 22 HG23 THR 22 105.633 10.345 -12.623 93 H SER 23 HN SER 23 103.687 12.706 -15.098 94 HA SER 23 HA SER 23 106.161 11.928 -16.542 95 HB2 SER 23 HB2 SER 23 105.644 13.585 -18.160 96 HB3 SER 23 HB1 SER 23 104.129 12.737 -17.862 97 HG SER 23 HG SER 23 103.357 14.452 -16.838 98 H GLY 24 HN GLY 24 107.969 12.664 -15.650 99 HA2 GLY 24 HA2 GLY 24 107.898 15.181 -14.064 100 HA3 GLY 24 HA1 GLY 24 108.985 13.832 -13.746 101 HA PRO 25 HA PRO 25 111.252 17.008 -16.295 102 HB2 PRO 25 HB2 PRO 25 113.482 16.053 -14.556 103 HB3 PRO 25 HB1 PRO 25 112.981 17.712 -14.931 104 HG2 PRO 25 HG2 PRO 25 112.519 16.613 -12.534 105 HG3 PRO 25 HG1 PRO 25 111.371 17.741 -13.280 106 HD2 PRO 25 HD2 PRO 25 111.208 14.749 -13.071 107 HD3 PRO 25 HD1 PRO 25 109.910 15.960 -12.948 108 H HIS 26 HN HIS 26 112.452 16.519 -18.105 109 HA HIS 26 HA HIS 26 112.781 13.746 -18.794 110 HB2 HIS 26 HB2 HIS 26 113.777 16.191 -20.275 111 HB3 HIS 26 HB1 HIS 26 113.545 14.572 -20.936 112 HD2 HIS 26 HD2 HIS 26 111.699 17.480 -21.654 113 HE1 HIS 26 HE1 HIS 26 108.572 14.977 -20.323 114 HE2 HIS 26 HE2 HIS 26 109.114 17.109 -21.589 115 H GLY 27 HN GLY 27 114.606 12.526 -18.762 116 HA2 GLY 27 HA2 GLY 27 117.242 13.554 -18.781 117 HA3 GLY 27 HA1 GLY 27 116.765 13.206 -17.123 118 H LEU 28 HN LEU 28 115.047 10.936 -17.905 119 HA LEU 28 HA LEU 28 116.938 9.020 -19.048 120 HB2 LEU 28 HB2 LEU 28 116.853 9.365 -16.319 121 HB3 LEU 28 HB1 LEU 28 115.685 8.072 -16.516 122 HG LEU 28 HG LEU 28 118.530 8.055 -17.592 123 HD11 LEU 28 HD11 LEU 28 118.293 7.930 -15.089 124 HD12 LEU 28 HD12 LEU 28 119.015 6.491 -15.810 125 HD13 LEU 28 HD13 LEU 28 117.325 6.473 -15.306 126 HD21 LEU 28 HD21 LEU 28 116.521 5.786 -17.416 127 HD22 LEU 28 HD22 LEU 28 118.119 5.736 -18.155 128 HD23 LEU 28 HD23 LEU 28 116.841 6.698 -18.893 129 H SER 29 HN SER 29 115.165 6.919 -17.773 130 HA SER 29 HA SER 29 113.242 6.770 -19.931 131 HB2 SER 29 HB2 SER 29 113.015 4.521 -19.354 132 HB3 SER 29 HB1 SER 29 114.678 4.862 -18.883 133 HG SER 29 HG SER 29 113.681 5.404 -16.763 134 H SER 30 HN SER 30 111.000 5.893 -19.316 135 HA SER 30 HA SER 30 109.617 7.898 -17.874 136 HB2 SER 30 HB2 SER 30 108.720 5.163 -18.799 137 HB3 SER 30 HB1 SER 30 107.647 6.393 -18.143 138 HG SER 30 HG SER 30 107.882 7.564 -19.912 139 H CYS 31 HN CYS 31 108.131 7.466 -16.031 140 HA CYS 31 HA CYS 31 109.273 5.546 -14.081 141 HB2 CYS 31 HB2 CYS 31 109.036 8.473 -13.926 142 HB3 CYS 31 HB1 CYS 31 108.343 7.668 -12.528 143 H HIS 32 HN HIS 32 107.808 4.118 -13.518 144 HA HIS 32 HA HIS 32 104.936 4.868 -13.411 145 HB2 HIS 32 HB2 HIS 32 106.222 2.170 -13.919 146 HB3 HIS 32 HB1 HIS 32 104.494 2.439 -13.723 147 HD2 HIS 32 HD2 HIS 32 103.244 2.957 -16.108 148 HE1 HIS 32 HE1 HIS 32 106.593 4.285 -18.302 149 HE2 HIS 32 HE2 HIS 32 104.103 3.801 -18.422 150 H LEU 33 HN LEU 33 104.137 4.965 -11.399 151 HA LEU 33 HA LEU 33 105.583 4.448 -9.075 152 HB2 LEU 33 HB2 LEU 33 103.293 5.708 -9.502 153 HB3 LEU 33 HB1 LEU 33 102.587 4.156 -9.074 154 HG LEU 33 HG LEU 33 104.450 5.839 -7.374 155 HD11 LEU 33 HD11 LEU 33 101.530 5.092 -7.214 156 HD12 LEU 33 HD12 LEU 33 102.241 6.705 -7.245 157 HD13 LEU 33 HD13 LEU 33 102.422 5.687 -5.817 158 HD21 LEU 33 HD21 LEU 33 103.863 4.002 -5.640 159 HD22 LEU 33 HD22 LEU 33 105.098 3.648 -6.842 160 HD23 LEU 33 HD23 LEU 33 103.464 3.011 -7.044 161 H GLU 34 HN GLU 34 106.148 2.622 -8.069 162 HA GLU 34 HA GLU 34 104.505 0.203 -8.404 163 HB2 GLU 34 HB2 GLU 34 106.571 -1.154 -8.644 164 HB3 GLU 34 HB1 GLU 34 106.311 -0.061 -10.001 165 HG2 GLU 34 HG2 GLU 34 107.908 1.535 -9.073 166 HG3 GLU 34 HG1 GLU 34 108.125 0.525 -7.645 167 H ILE 35 HN ILE 35 104.269 -0.991 -6.605 168 HA ILE 35 HA ILE 35 105.640 -0.005 -4.163 169 HB ILE 35 HB ILE 35 103.090 -1.630 -4.373 170 HG12 ILE 35 HG12 ILE 35 103.535 1.334 -3.871 171 HG13 ILE 35 HG11 ILE 35 102.826 0.634 -5.325 172 HG21 ILE 35 HG21 ILE 35 104.388 -1.880 -2.250 173 HG22 ILE 35 HG22 ILE 35 102.853 -1.056 -1.990 174 HG23 ILE 35 HG23 ILE 35 104.352 -0.129 -2.052 175 HD11 ILE 35 HD11 ILE 35 101.689 0.652 -2.525 176 HD12 ILE 35 HD12 ILE 35 101.080 -0.432 -3.777 177 HD13 ILE 35 HD13 ILE 35 100.971 1.316 -3.994 178 H ARG 36 HN ARG 36 107.109 -1.242 -3.254 179 HA ARG 36 HA ARG 36 107.705 -3.852 -4.304 180 HB2 ARG 36 HB2 ARG 36 108.878 -2.045 -2.228 181 HB3 ARG 36 HB1 ARG 36 109.414 -3.719 -2.308 182 HG2 ARG 36 HG2 ARG 36 110.961 -2.638 -3.697 183 HG3 ARG 36 HG1 ARG 36 109.779 -3.216 -4.863 184 HD2 ARG 36 HD2 ARG 36 108.675 -1.001 -4.831 185 HD3 ARG 36 HD1 ARG 36 109.868 -0.428 -3.670 186 HE ARG 36 HE ARG 36 110.276 -0.842 -6.519 187 HH11 ARG 36 HH11 ARG 36 112.299 -0.149 -7.302 188 HH12 ARG 36 HH12 ARG 36 113.572 0.217 -6.186 189 HH21 ARG 36 HH21 ARG 36 111.686 -0.543 -3.376 190 HH22 ARG 36 HH22 ARG 36 113.225 -0.005 -3.963 191 H GLU 37 HN GLU 37 107.953 -5.735 -3.024 192 HA GLU 37 HA GLU 37 105.649 -6.347 -1.464 193 HB2 GLU 37 HB2 GLU 37 106.854 -7.995 -2.898 194 HB3 GLU 37 HB1 GLU 37 108.224 -7.913 -1.790 195 HG2 GLU 37 HG2 GLU 37 106.786 -8.665 0.055 196 HG3 GLU 37 HG1 GLU 37 105.410 -8.737 -1.043 197 H ASP 38 HN ASP 38 108.912 -5.336 -0.870 198 HA ASP 38 HA ASP 38 109.012 -5.995 1.910 199 HB2 ASP 38 HB2 ASP 38 111.014 -5.543 0.428 200 HB3 ASP 38 HB1 ASP 38 110.575 -3.837 0.476 201 H GLY 39 HN GLY 39 107.339 -3.697 0.109 202 HA2 GLY 39 HA2 GLY 39 105.674 -2.284 1.026 203 HA3 GLY 39 HA1 GLY 39 106.558 -2.247 2.546 204 H THR 40 HN THR 40 108.704 -1.850 -0.048 205 HA THR 40 HA THR 40 108.962 0.998 0.595 206 HB THR 40 HB THR 40 110.960 0.831 -0.968 207 HG1 THR 40 HG1 THR 40 111.096 -0.922 -2.069 208 HG21 THR 40 HG21 THR 40 111.083 0.661 1.515 209 HG22 THR 40 HG22 THR 40 112.324 -0.291 0.704 210 HG23 THR 40 HG23 THR 40 110.899 -1.087 1.370 211 H VAL 41 HN VAL 41 109.212 2.585 -1.198 212 HA VAL 41 HA VAL 41 107.430 1.942 -3.490 213 HB VAL 41 HB VAL 41 107.505 4.504 -1.882 214 HG11 VAL 41 HG11 VAL 41 106.086 3.671 -4.418 215 HG12 VAL 41 HG12 VAL 41 107.048 5.120 -4.128 216 HG13 VAL 41 HG13 VAL 41 105.455 4.958 -3.390 217 HG21 VAL 41 HG21 VAL 41 106.354 2.516 -0.833 218 HG22 VAL 41 HG22 VAL 41 105.287 2.464 -2.236 219 HG23 VAL 41 HG23 VAL 41 105.275 3.871 -1.172 220 H GLY 42 HN GLY 42 107.864 2.848 -5.435 221 HA2 GLY 42 HA2 GLY 42 109.789 4.880 -5.916 222 HA3 GLY 42 HA1 GLY 42 110.498 3.292 -6.220 223 H CYS 43 HN CYS 43 110.514 4.506 -8.459 224 HA CYS 43 HA CYS 43 107.937 4.053 -9.843 225 HB2 CYS 43 HB2 CYS 43 108.367 5.876 -11.134 226 HB3 CYS 43 HB1 CYS 43 109.487 6.304 -9.847 227 H ALA 44 HN ALA 44 108.039 3.204 -12.048 228 HA ALA 44 HA ALA 44 110.345 1.420 -12.580 229 HB1 ALA 44 HB1 ALA 44 108.138 0.007 -13.552 230 HB2 ALA 44 HB2 ALA 44 107.554 0.669 -12.026 231 HB3 ALA 44 HB3 ALA 44 108.995 -0.343 -12.050 232 H ALA 45 HN ALA 45 110.840 1.155 -14.767 233 HA ALA 45 HA ALA 45 109.471 3.043 -16.598 234 HB1 ALA 45 HB1 ALA 45 111.488 3.148 -17.833 235 HB2 ALA 45 HB2 ALA 45 112.147 1.720 -17.033 236 HB3 ALA 45 HB3 ALA 45 111.969 3.231 -16.139 237 H ASP 46 HN ASP 46 109.536 -0.210 -15.855 238 HA ASP 46 HA ASP 46 108.915 -1.020 -18.647 239 HB2 ASP 46 HB2 ASP 46 110.936 -2.046 -17.514 240 HB3 ASP 46 HB1 ASP 46 109.804 -2.824 -16.410 241 H GLN 47 HN GLN 47 107.159 -0.027 -16.235 242 HA GLN 47 HA GLN 47 105.129 -0.587 -15.268 243 HB2 GLN 47 HB2 GLN 47 104.909 -1.860 -18.001 244 HB3 GLN 47 HB1 GLN 47 103.552 -1.692 -16.887 245 HG2 GLN 47 HG2 GLN 47 103.857 0.744 -16.863 246 HG3 GLN 47 HG1 GLN 47 105.231 0.592 -17.957 247 HE21 GLN 47 HE21 GLN 47 103.537 2.130 -19.189 248 HE22 GLN 47 HE22 GLN 47 102.493 1.320 -20.254 249 H SER 48 HN SER 48 105.611 -1.932 -13.555 250 HA SER 48 HA SER 48 105.878 -4.821 -14.081 251 HB2 SER 48 HB2 SER 48 106.670 -3.032 -11.803 252 HB3 SER 48 HB1 SER 48 106.518 -4.767 -11.555 253 HG SER 48 HG SER 48 108.636 -3.840 -12.285 254 HA PRO 49 HA PRO 49 101.840 -5.867 -12.584 255 HB2 PRO 49 HB2 PRO 49 103.128 -7.579 -10.481 256 HB3 PRO 49 HB1 PRO 49 101.866 -7.997 -11.658 257 HG2 PRO 49 HG2 PRO 49 104.390 -8.799 -11.980 258 HG3 PRO 49 HG1 PRO 49 103.379 -8.335 -13.362 259 HD2 PRO 49 HD2 PRO 49 105.639 -6.838 -12.098 260 HD3 PRO 49 HD1 PRO 49 105.081 -6.843 -13.785 261 H GLU 50 HN GLU 50 104.283 -5.122 -10.147 262 HA GLU 50 HA GLU 50 102.457 -4.515 -8.054 263 HB2 GLU 50 HB2 GLU 50 104.609 -3.134 -7.243 264 HB3 GLU 50 HB1 GLU 50 104.529 -4.886 -7.129 265 HG2 GLU 50 HG2 GLU 50 105.761 -5.127 -9.215 266 HG3 GLU 50 HG1 GLU 50 105.751 -3.379 -9.460 267 H SER 51 HN SER 51 103.184 -2.831 -10.906 268 HA SER 51 HA SER 51 102.737 -0.188 -9.809 269 HB2 SER 51 HB2 SER 51 103.002 -1.185 -12.649 270 HB3 SER 51 HB1 SER 51 102.733 0.497 -12.221 271 HG SER 51 HG SER 51 104.647 0.081 -10.767 272 H LEU 52 HN LEU 52 100.793 -2.771 -10.414 273 HA LEU 52 HA LEU 52 98.538 -1.228 -11.468 274 HB2 LEU 52 HB2 LEU 52 99.287 -3.745 -11.973 275 HB3 LEU 52 HB1 LEU 52 98.296 -4.080 -10.558 276 HG LEU 52 HG LEU 52 97.423 -2.694 -13.112 277 HD11 LEU 52 HD11 LEU 52 96.447 -5.240 -11.795 278 HD12 LEU 52 HD12 LEU 52 97.629 -5.197 -13.103 279 HD13 LEU 52 HD13 LEU 52 95.983 -4.622 -13.381 280 HD21 LEU 52 HD21 LEU 52 96.312 -1.634 -11.174 281 HD22 LEU 52 HD22 LEU 52 95.838 -3.222 -10.577 282 HD23 LEU 52 HD23 LEU 52 95.179 -2.612 -12.094 283 H LEU 53 HN LEU 53 97.486 -0.029 -10.008 284 HA LEU 53 HA LEU 53 97.249 -0.998 -7.220 285 HB2 LEU 53 HB2 LEU 53 96.826 1.791 -8.310 286 HB3 LEU 53 HB1 LEU 53 96.841 1.314 -6.614 287 HG LEU 53 HG LEU 53 99.186 1.053 -8.523 288 HD11 LEU 53 HD11 LEU 53 100.161 2.872 -7.144 289 HD12 LEU 53 HD12 LEU 53 98.644 2.992 -6.254 290 HD13 LEU 53 HD13 LEU 53 98.693 3.392 -7.971 291 HD21 LEU 53 HD21 LEU 53 100.363 0.735 -6.206 292 HD22 LEU 53 HD22 LEU 53 99.499 -0.632 -6.900 293 HD23 LEU 53 HD23 LEU 53 98.750 0.325 -5.623 294 H GLN 54 HN GLN 54 95.368 -1.550 -6.411 295 HA GLN 54 HA GLN 54 93.020 -1.572 -8.063 296 HB2 GLN 54 HB2 GLN 54 93.767 -3.304 -6.275 297 HB3 GLN 54 HB1 GLN 54 93.064 -2.180 -5.118 298 HG2 GLN 54 HG2 GLN 54 90.928 -2.254 -6.383 299 HG3 GLN 54 HG1 GLN 54 91.643 -3.456 -7.457 300 HE21 GLN 54 HE21 GLN 54 91.040 -5.538 -6.881 301 HE22 GLN 54 HE22 GLN 54 90.780 -6.072 -5.290 302 H LEU 55 HN LEU 55 91.870 0.240 -8.358 303 HA LEU 55 HA LEU 55 91.936 2.386 -6.396 304 HB2 LEU 55 HB2 LEU 55 92.069 3.042 -8.702 305 HB3 LEU 55 HB1 LEU 55 90.637 2.106 -9.115 306 HG LEU 55 HG LEU 55 89.230 3.586 -7.782 307 HD11 LEU 55 HD11 LEU 55 90.547 4.210 -5.932 308 HD12 LEU 55 HD12 LEU 55 90.421 5.705 -6.860 309 HD13 LEU 55 HD13 LEU 55 91.891 4.732 -6.950 310 HD21 LEU 55 HD21 LEU 55 91.167 5.049 -9.598 311 HD22 LEU 55 HD22 LEU 55 89.643 5.730 -9.024 312 HD23 LEU 55 HD23 LEU 55 89.636 4.304 -10.063 313 H LYS 56 HN LYS 56 90.515 2.584 -4.803 314 HA LYS 56 HA LYS 56 87.827 1.369 -5.113 315 HB2 LYS 56 HB2 LYS 56 89.601 1.403 -2.658 316 HB3 LYS 56 HB1 LYS 56 87.904 0.920 -2.656 317 HG2 LYS 56 HG2 LYS 56 88.381 -0.881 -4.240 318 HG3 LYS 56 HG1 LYS 56 90.060 -0.369 -4.353 319 HD2 LYS 56 HD2 LYS 56 90.092 -2.170 -2.807 320 HD3 LYS 56 HD1 LYS 56 90.179 -0.719 -1.812 321 HE2 LYS 56 HE2 LYS 56 87.890 -0.887 -1.182 322 HE3 LYS 56 HE1 LYS 56 87.541 -2.059 -2.453 323 HZ1 LYS 56 HZ1 LYS 56 87.732 -3.217 -0.401 324 HZ2 LYS 56 HZ2 LYS 56 89.219 -2.476 -0.044 325 HZ3 LYS 56 HZ3 LYS 56 89.105 -3.587 -1.324 326 H ALA 57 HN ALA 57 86.173 2.684 -4.745 327 HA ALA 57 HA ALA 57 86.752 5.431 -3.859 328 HB1 ALA 57 HB1 ALA 57 84.060 4.454 -4.775 329 HB2 ALA 57 HB2 ALA 57 85.352 4.718 -5.944 330 HB3 ALA 57 HB3 ALA 57 84.784 6.055 -4.946 331 H LEU 58 HN LEU 58 86.790 5.586 -1.669 332 HA LEU 58 HA LEU 58 85.120 4.002 0.048 333 HB2 LEU 58 HB2 LEU 58 86.599 6.558 0.721 334 HB3 LEU 58 HB1 LEU 58 86.020 5.339 1.855 335 HG LEU 58 HG LEU 58 88.130 4.906 -0.277 336 HD11 LEU 58 HD11 LEU 58 89.317 6.057 1.339 337 HD12 LEU 58 HD12 LEU 58 89.425 4.442 2.033 338 HD13 LEU 58 HD13 LEU 58 88.232 5.583 2.646 339 HD21 LEU 58 HD21 LEU 58 86.735 3.072 1.670 340 HD22 LEU 58 HD22 LEU 58 88.402 2.741 1.196 341 HD23 LEU 58 HD23 LEU 58 87.135 2.802 -0.028 342 H LYS 59 HN LYS 59 85.325 7.524 -0.119 343 HA LYS 59 HA LYS 59 82.370 7.714 -0.028 344 HB2 LYS 59 HB2 LYS 59 84.418 9.521 1.276 345 HB3 LYS 59 HB1 LYS 59 82.674 9.763 1.316 346 HG2 LYS 59 HG2 LYS 59 82.311 7.987 2.778 347 HG3 LYS 59 HG1 LYS 59 83.754 7.118 2.258 348 HD2 LYS 59 HD2 LYS 59 84.061 9.766 3.673 349 HD3 LYS 59 HD1 LYS 59 83.716 8.318 4.616 350 HE2 LYS 59 HE2 LYS 59 85.686 7.200 3.576 351 HE3 LYS 59 HE1 LYS 59 86.055 8.696 2.721 352 HZ1 LYS 59 HZ1 LYS 59 85.691 9.373 5.380 353 HZ2 LYS 59 HZ2 LYS 59 87.149 9.356 4.508 354 HZ3 LYS 59 HZ3 LYS 59 86.663 7.984 5.384 355 HA PRO 60 HA PRO 60 82.580 10.121 -3.761 356 HB2 PRO 60 HB2 PRO 60 81.142 12.291 -2.258 357 HB3 PRO 60 HB1 PRO 60 80.768 11.586 -3.845 358 HG2 PRO 60 HG2 PRO 60 79.368 10.937 -1.658 359 HG3 PRO 60 HG1 PRO 60 79.716 9.753 -2.931 360 HD2 PRO 60 HD2 PRO 60 80.889 9.959 -0.196 361 HD3 PRO 60 HD1 PRO 60 80.693 8.538 -1.246 362 H GLY 61 HN GLY 61 84.458 11.047 -4.356 363 HA2 GLY 61 HA2 GLY 61 85.945 12.860 -4.564 364 HA3 GLY 61 HA1 GLY 61 85.382 13.490 -3.024 365 H VAL 62 HN VAL 62 85.755 10.503 -2.055 366 HA VAL 62 HA VAL 62 88.694 10.719 -1.597 367 HB VAL 62 HB VAL 62 86.521 9.721 0.259 368 HG11 VAL 62 HG11 VAL 62 88.541 9.542 1.856 369 HG12 VAL 62 HG12 VAL 62 89.534 9.574 0.399 370 HG13 VAL 62 HG13 VAL 62 88.360 8.280 0.638 371 HG21 VAL 62 HG21 VAL 62 88.442 12.067 0.418 372 HG22 VAL 62 HG22 VAL 62 87.354 11.562 1.713 373 HG23 VAL 62 HG23 VAL 62 86.694 12.159 0.191 374 H ILE 63 HN ILE 63 89.870 9.002 -2.215 375 HA ILE 63 HA ILE 63 88.521 6.392 -2.591 376 HB ILE 63 HB ILE 63 89.571 6.069 -4.703 377 HG12 ILE 63 HG12 ILE 63 90.961 8.190 -5.578 378 HG13 ILE 63 HG11 ILE 63 91.224 8.450 -3.860 379 HG21 ILE 63 HG21 ILE 63 88.612 7.887 -6.014 380 HG22 ILE 63 HG22 ILE 63 88.585 8.929 -4.591 381 HG23 ILE 63 HG23 ILE 63 87.545 7.506 -4.660 382 HD11 ILE 63 HD11 ILE 63 92.510 6.565 -5.632 383 HD12 ILE 63 HD12 ILE 63 91.759 5.692 -4.302 384 HD13 ILE 63 HD13 ILE 63 92.920 6.973 -3.973 385 H GLN 64 HN GLN 64 90.060 4.594 -2.739 386 HA GLN 64 HA GLN 64 92.583 5.054 -1.245 387 HB2 GLN 64 HB2 GLN 64 90.796 4.078 0.210 388 HB3 GLN 64 HB1 GLN 64 90.723 2.692 -0.877 389 HG2 GLN 64 HG2 GLN 64 93.057 2.170 -0.442 390 HG3 GLN 64 HG1 GLN 64 93.234 3.625 0.537 391 HE21 GLN 64 HE21 GLN 64 93.795 1.131 1.713 392 HE22 GLN 64 HE22 GLN 64 92.586 0.756 2.843 393 H ILE 65 HN ILE 65 94.320 3.766 -1.868 394 HA ILE 65 HA ILE 65 93.905 2.114 -4.297 395 HB ILE 65 HB ILE 65 96.445 2.832 -4.641 396 HG12 ILE 65 HG12 ILE 65 95.274 5.152 -3.060 397 HG13 ILE 65 HG11 ILE 65 96.537 4.071 -2.475 398 HG21 ILE 65 HG21 ILE 65 95.634 4.717 -6.033 399 HG22 ILE 65 HG22 ILE 65 94.082 4.658 -5.196 400 HG23 ILE 65 HG23 ILE 65 94.596 3.302 -6.199 401 HD11 ILE 65 HD11 ILE 65 97.773 4.771 -4.685 402 HD12 ILE 65 HD12 ILE 65 97.775 5.871 -3.305 403 HD13 ILE 65 HD13 ILE 65 96.664 6.143 -4.646 404 H LEU 66 HN LEU 66 94.387 0.100 -4.136 405 HA LEU 66 HA LEU 66 96.273 -0.839 -2.051 406 HB2 LEU 66 HB2 LEU 66 94.014 -1.261 -1.335 407 HB3 LEU 66 HB1 LEU 66 93.565 -1.903 -2.890 408 HG LEU 66 HG LEU 66 93.974 -3.560 -0.965 409 HD11 LEU 66 HD11 LEU 66 95.726 -4.316 -3.266 410 HD12 LEU 66 HD12 LEU 66 94.031 -3.990 -3.589 411 HD13 LEU 66 HD13 LEU 66 94.487 -5.245 -2.444 412 HD21 LEU 66 HD21 LEU 66 96.173 -4.111 -0.347 413 HD22 LEU 66 HD22 LEU 66 96.152 -2.353 -0.335 414 HD23 LEU 66 HD23 LEU 66 96.879 -3.219 -1.690 415 H GLY 67 HN GLY 67 97.968 -1.866 -2.917 416 HA2 GLY 67 HA2 GLY 67 98.171 -2.484 -5.694 417 HA3 GLY 67 HA1 GLY 67 99.340 -2.917 -4.454 418 H VAL 68 HN VAL 68 97.443 -4.216 -6.753 419 HA VAL 68 HA VAL 68 96.159 -6.366 -5.433 420 HB VAL 68 HB VAL 68 95.959 -7.338 -7.663 421 HG11 VAL 68 HG11 VAL 68 95.685 -4.318 -7.760 422 HG12 VAL 68 HG12 VAL 68 94.537 -5.393 -6.960 423 HG13 VAL 68 HG13 VAL 68 94.766 -5.494 -8.706 424 HG21 VAL 68 HG21 VAL 68 97.029 -5.952 -9.558 425 HG22 VAL 68 HG22 VAL 68 98.105 -6.998 -8.629 426 HG23 VAL 68 HG23 VAL 68 98.062 -5.264 -8.306 427 H LYS 69 HN LYS 69 99.334 -6.117 -7.006 428 HA LYS 69 HA LYS 69 100.061 -8.834 -6.699 429 HB2 LYS 69 HB2 LYS 69 101.149 -7.199 -8.244 430 HB3 LYS 69 HB1 LYS 69 101.881 -6.424 -6.847 431 HG2 LYS 69 HG2 LYS 69 102.291 -9.385 -7.094 432 HG3 LYS 69 HG1 LYS 69 103.134 -8.378 -8.264 433 HD2 LYS 69 HD2 LYS 69 104.077 -7.041 -6.355 434 HD3 LYS 69 HD1 LYS 69 103.349 -8.194 -5.241 435 HE2 LYS 69 HE2 LYS 69 104.635 -10.020 -6.223 436 HE3 LYS 69 HE1 LYS 69 105.316 -8.922 -7.423 437 HZ1 LYS 69 HZ1 LYS 69 105.661 -7.921 -4.784 438 HZ2 LYS 69 HZ2 LYS 69 106.827 -8.224 -5.982 439 HZ3 LYS 69 HZ3 LYS 69 106.338 -9.470 -4.936 440 H THR 70 HN THR 70 100.840 -5.972 -4.729 441 HA THR 70 HA THR 70 102.171 -7.639 -2.735 442 HB THR 70 HB THR 70 102.840 -5.557 -1.718 443 HG1 THR 70 HG1 THR 70 101.186 -4.315 -3.655 444 HG21 THR 70 HG21 THR 70 102.968 -5.477 -4.743 445 HG22 THR 70 HG22 THR 70 104.120 -6.266 -3.665 446 HG23 THR 70 HG23 THR 70 103.977 -4.510 -3.669 447 H SER 71 HN SER 71 99.045 -6.218 -3.179 448 HA SER 71 HA SER 71 97.188 -6.177 -1.819 449 HB2 SER 71 HB2 SER 71 96.847 -8.120 -0.664 450 HB3 SER 71 HB1 SER 71 98.400 -8.601 -1.342 451 HG SER 71 HG SER 71 99.206 -7.349 0.629 452 H ARG 72 HN ARG 72 99.467 -4.340 -1.426 453 HA ARG 72 HA ARG 72 99.250 -3.726 1.456 454 HB2 ARG 72 HB2 ARG 72 101.260 -2.918 -0.653 455 HB3 ARG 72 HB1 ARG 72 101.202 -2.211 0.958 456 HG2 ARG 72 HG2 ARG 72 101.474 -4.461 1.941 457 HG3 ARG 72 HG1 ARG 72 101.572 -5.151 0.328 458 HD2 ARG 72 HD2 ARG 72 103.565 -3.812 -0.148 459 HD3 ARG 72 HD1 ARG 72 103.455 -3.048 1.433 460 HE ARG 72 HE ARG 72 104.356 -5.776 0.868 461 HH11 ARG 72 HH11 ARG 72 105.409 -6.780 2.614 462 HH12 ARG 72 HH12 ARG 72 105.298 -6.086 4.198 463 HH21 ARG 72 HH21 ARG 72 103.344 -3.409 3.186 464 HH22 ARG 72 HH22 ARG 72 104.137 -4.181 4.519 465 H PHE 73 HN PHE 73 98.487 -1.780 2.156 466 HA PHE 73 HA PHE 73 97.018 -0.158 0.188 467 HB2 PHE 73 HB2 PHE 73 97.090 -0.045 3.220 468 HB3 PHE 73 HB1 PHE 73 96.036 0.917 2.184 469 HD1 PHE 73 HD1 PHE 73 96.546 -2.315 3.769 470 HD2 PHE 73 HD2 PHE 73 94.372 -0.241 0.699 471 HE1 PHE 73 HE1 PHE 73 94.907 -4.172 3.674 472 HE2 PHE 73 HE2 PHE 73 92.734 -2.100 0.602 473 HZ PHE 73 HZ PHE 73 93.002 -4.065 2.090 474 H LEU 74 HN LEU 74 98.176 1.389 -0.777 475 HA LEU 74 HA LEU 74 100.574 2.482 0.255 476 HB2 LEU 74 HB2 LEU 74 100.261 2.542 -2.107 477 HB3 LEU 74 HB1 LEU 74 98.709 3.361 -1.952 478 HG LEU 74 HG LEU 74 99.770 5.395 -1.200 479 HD11 LEU 74 HD11 LEU 74 102.212 3.635 -0.982 480 HD12 LEU 74 HD12 LEU 74 101.518 4.718 0.225 481 HD13 LEU 74 HD13 LEU 74 102.375 5.382 -1.162 482 HD21 LEU 74 HD21 LEU 74 100.901 6.022 -3.179 483 HD22 LEU 74 HD22 LEU 74 99.860 4.699 -3.694 484 HD23 LEU 74 HD23 LEU 74 101.573 4.410 -3.416 485 H CYS 75 HN CYS 75 100.588 3.566 2.119 486 HA CYS 75 HA CYS 75 98.631 5.758 2.496 487 HB2 CYS 75 HB2 CYS 75 99.992 4.327 4.761 488 HB3 CYS 75 HB1 CYS 75 98.560 5.353 4.807 489 H GLN 76 HN GLN 76 99.406 7.717 3.264 490 HA GLN 76 HA GLN 76 102.331 8.055 3.066 491 HB2 GLN 76 HB2 GLN 76 101.072 9.388 1.473 492 HB3 GLN 76 HB1 GLN 76 100.075 10.051 2.768 493 HG2 GLN 76 HG2 GLN 76 101.991 11.170 3.751 494 HG3 GLN 76 HG1 GLN 76 103.087 10.382 2.621 495 HE21 GLN 76 HE21 GLN 76 103.675 11.737 0.930 496 HE22 GLN 76 HE22 GLN 76 102.699 12.962 0.277 497 H ARG 77 HN ARG 77 103.484 8.656 4.779 498 HA ARG 77 HA ARG 77 102.170 8.911 7.335 499 HB2 ARG 77 HB2 ARG 77 104.906 9.534 7.706 500 HB3 ARG 77 HB1 ARG 77 104.141 7.970 7.980 501 HG2 ARG 77 HG2 ARG 77 104.600 7.298 5.687 502 HG3 ARG 77 HG1 ARG 77 105.235 8.901 5.315 503 HD2 ARG 77 HD2 ARG 77 107.064 7.303 5.763 504 HD3 ARG 77 HD1 ARG 77 107.029 8.590 6.966 505 HE ARG 77 HE ARG 77 105.541 6.698 8.170 506 HH11 ARG 77 HH11 ARG 77 106.337 4.941 9.371 507 HH12 ARG 77 HH12 ARG 77 107.917 4.315 9.035 508 HH21 ARG 77 HH21 ARG 77 108.560 6.568 6.481 509 HH22 ARG 77 HH22 ARG 77 109.173 5.231 7.396 510 HA PRO 78 HA PRO 78 101.935 13.285 7.863 511 HB2 PRO 78 HB2 PRO 78 103.945 13.188 10.084 512 HB3 PRO 78 HB1 PRO 78 102.309 13.878 10.076 513 HG2 PRO 78 HG2 PRO 78 102.826 11.568 11.295 514 HG3 PRO 78 HG1 PRO 78 101.303 11.830 10.423 515 HD2 PRO 78 HD2 PRO 78 103.689 10.210 9.600 516 HD3 PRO 78 HD1 PRO 78 101.962 9.932 9.288 517 H ASP 79 HN ASP 79 105.162 11.919 7.936 518 HA ASP 79 HA ASP 79 106.626 14.273 7.359 519 HB2 ASP 79 HB2 ASP 79 107.524 12.080 8.268 520 HB3 ASP 79 HB1 ASP 79 107.423 11.455 6.624 521 H GLY 80 HN GLY 80 104.430 12.580 5.486 522 HA2 GLY 80 HA2 GLY 80 103.762 13.069 3.308 523 HA3 GLY 80 HA1 GLY 80 105.212 14.046 3.107 524 H ALA 81 HN ALA 81 105.861 10.953 4.396 525 HA ALA 81 HA ALA 81 107.093 10.151 1.858 526 HB1 ALA 81 HB1 ALA 81 107.794 8.152 3.514 527 HB2 ALA 81 HB2 ALA 81 107.408 9.374 4.728 528 HB3 ALA 81 HB3 ALA 81 108.637 9.700 3.510 529 H LEU 82 HN LEU 82 106.634 8.251 0.777 530 HA LEU 82 HA LEU 82 103.916 7.186 1.209 531 HB2 LEU 82 HB2 LEU 82 105.781 7.452 -1.124 532 HB3 LEU 82 HB1 LEU 82 104.554 6.191 -1.180 533 HG LEU 82 HG LEU 82 102.774 7.805 -0.936 534 HD11 LEU 82 HD11 LEU 82 105.032 9.740 -0.388 535 HD12 LEU 82 HD12 LEU 82 103.624 9.388 0.613 536 HD13 LEU 82 HD13 LEU 82 103.432 10.294 -0.882 537 HD21 LEU 82 HD21 LEU 82 104.906 8.547 -2.950 538 HD22 LEU 82 HD22 LEU 82 103.351 9.372 -2.914 539 HD23 LEU 82 HD23 LEU 82 103.420 7.636 -3.214 540 H TYR 83 HN TYR 83 103.521 5.099 1.715 541 HA TYR 83 HA TYR 83 105.512 3.037 1.298 542 HB2 TYR 83 HB2 TYR 83 105.786 2.389 3.591 543 HB3 TYR 83 HB1 TYR 83 106.195 4.099 3.469 544 HD1 TYR 83 HD1 TYR 83 104.228 1.698 5.198 545 HD2 TYR 83 HD2 TYR 83 104.214 5.792 3.885 546 HE1 TYR 83 HE1 TYR 83 102.499 2.231 6.888 547 HE2 TYR 83 HE2 TYR 83 102.482 6.324 5.582 548 HH TYR 83 HH TYR 83 100.560 4.447 6.908 549 H GLY 84 HN GLY 84 104.686 0.918 1.599 550 HA2 GLY 84 HA2 GLY 84 101.766 0.759 1.350 551 HA3 GLY 84 HA1 GLY 84 102.922 -0.517 0.979 552 H SER 85 HN SER 85 100.457 -0.222 2.855 553 HA SER 85 HA SER 85 101.736 -1.529 5.189 554 HB2 SER 85 HB2 SER 85 100.407 -0.338 6.705 555 HB3 SER 85 HB1 SER 85 100.958 0.894 5.578 556 HG SER 85 HG SER 85 98.437 -0.323 5.851 557 H LEU 86 HN LEU 86 100.668 -3.232 6.072 558 HA LEU 86 HA LEU 86 98.858 -4.672 4.432 559 HB2 LEU 86 HB2 LEU 86 99.879 -5.046 7.245 560 HB3 LEU 86 HB1 LEU 86 98.656 -6.120 6.578 561 HG LEU 86 HG LEU 86 101.061 -6.912 6.337 562 HD11 LEU 86 HD11 LEU 86 100.679 -7.932 4.260 563 HD12 LEU 86 HD12 LEU 86 99.825 -6.538 3.610 564 HD13 LEU 86 HD13 LEU 86 99.051 -7.565 4.818 565 HD21 LEU 86 HD21 LEU 86 101.918 -4.597 5.786 566 HD22 LEU 86 HD22 LEU 86 101.192 -4.786 4.194 567 HD23 LEU 86 HD23 LEU 86 102.481 -5.870 4.699 568 H HIS 87 HN HIS 87 98.462 -2.657 7.286 569 HA HIS 87 HA HIS 87 95.586 -3.201 7.394 570 HB2 HIS 87 HB2 HIS 87 95.636 -1.891 9.445 571 HB3 HIS 87 HB1 HIS 87 96.929 -3.092 9.478 572 HD2 HIS 87 HD2 HIS 87 99.574 -2.003 9.170 573 HE1 HIS 87 HE1 HIS 87 98.374 2.021 9.602 574 HE2 HIS 87 HE2 HIS 87 100.374 0.457 9.515 575 H PHE 88 HN PHE 88 94.002 -1.711 7.049 576 HA PHE 88 HA PHE 88 94.708 0.560 5.348 577 HB2 PHE 88 HB2 PHE 88 92.963 -0.723 4.421 578 HB3 PHE 88 HB1 PHE 88 92.163 -0.926 5.974 579 HD1 PHE 88 HD1 PHE 88 93.466 2.199 4.317 580 HD2 PHE 88 HD2 PHE 88 90.034 0.025 5.726 581 HE1 PHE 88 HE1 PHE 88 92.031 4.161 3.854 582 HE2 PHE 88 HE2 PHE 88 88.601 1.991 5.259 583 HZ PHE 88 HZ PHE 88 89.599 4.059 4.323 584 H ASP 89 HN ASP 89 94.729 2.595 6.036 585 HA ASP 89 HA ASP 89 93.305 3.309 8.529 586 HB2 ASP 89 HB2 ASP 89 95.781 3.141 8.852 587 HB3 ASP 89 HB1 ASP 89 95.978 4.409 7.645 588 HA PRO 90 HA PRO 90 91.720 6.077 5.280 589 HB2 PRO 90 HB2 PRO 90 89.741 7.307 6.760 590 HB3 PRO 90 HB1 PRO 90 89.554 5.722 5.985 591 HG2 PRO 90 HG2 PRO 90 90.125 6.382 8.832 592 HG3 PRO 90 HG1 PRO 90 89.116 5.093 8.154 593 HD2 PRO 90 HD2 PRO 90 91.644 4.672 9.124 594 HD3 PRO 90 HD1 PRO 90 90.915 3.659 7.858 595 H GLU 91 HN GLU 91 92.800 6.985 8.458 596 HA GLU 91 HA GLU 91 92.823 9.799 8.085 597 HB2 GLU 91 HB2 GLU 91 92.886 8.740 10.300 598 HB3 GLU 91 HB1 GLU 91 94.492 8.106 9.949 599 HG2 GLU 91 HG2 GLU 91 95.391 10.357 9.752 600 HG3 GLU 91 HG1 GLU 91 93.781 11.052 9.937 601 H ALA 92 HN ALA 92 94.925 7.298 6.920 602 HA ALA 92 HA ALA 92 96.829 9.385 5.988 603 HB1 ALA 92 HB1 ALA 92 97.924 8.162 7.761 604 HB2 ALA 92 HB2 ALA 92 98.635 7.696 6.214 605 HB3 ALA 92 HB3 ALA 92 97.489 6.622 7.017 606 H CYS 93 HN CYS 93 95.147 6.371 5.292 607 HA CYS 93 HA CYS 93 96.436 6.220 2.669 608 HB2 CYS 93 HB2 CYS 93 95.426 4.288 4.473 609 HB3 CYS 93 HB1 CYS 93 94.420 4.182 3.033 610 H SER 94 HN SER 94 93.821 7.887 3.840 611 HA SER 94 HA SER 94 92.077 7.445 1.556 612 HB2 SER 94 HB2 SER 94 92.012 9.556 3.727 613 HB3 SER 94 HB1 SER 94 90.775 9.328 2.498 614 HG SER 94 HG SER 94 91.386 6.999 3.728 615 H PHE 95 HN PHE 95 91.993 8.711 -0.272 616 HA PHE 95 HA PHE 95 93.747 11.093 -0.400 617 HB2 PHE 95 HB2 PHE 95 93.623 8.925 -2.500 618 HB3 PHE 95 HB1 PHE 95 94.582 10.398 -2.575 619 HD1 PHE 95 HD1 PHE 95 94.336 7.035 -1.209 620 HD2 PHE 95 HD2 PHE 95 96.473 10.754 -0.974 621 HE1 PHE 95 HE1 PHE 95 96.176 5.897 -0.010 622 HE2 PHE 95 HE2 PHE 95 98.315 9.613 0.236 623 HZ PHE 95 HZ PHE 95 98.171 7.186 0.713 624 H ARG 96 HN ARG 96 93.036 12.709 -1.676 625 HA ARG 96 HA ARG 96 90.287 12.495 -2.698 626 HB2 ARG 96 HB2 ARG 96 90.777 14.338 -1.136 627 HB3 ARG 96 HB1 ARG 96 92.021 14.932 -2.235 628 HG2 ARG 96 HG2 ARG 96 90.380 15.360 -3.964 629 HG3 ARG 96 HG1 ARG 96 89.111 14.590 -3.011 630 HD2 ARG 96 HD2 ARG 96 89.305 16.316 -1.294 631 HD3 ARG 96 HD1 ARG 96 90.655 17.054 -2.150 632 HE ARG 96 HE ARG 96 89.130 18.050 -3.588 633 HH11 ARG 96 HH11 ARG 96 87.027 18.606 -4.209 634 HH12 ARG 96 HH12 ARG 96 85.688 17.645 -3.680 635 HH21 ARG 96 HH21 ARG 96 87.649 15.439 -1.858 636 HH22 ARG 96 HH22 ARG 96 86.039 15.859 -2.340 637 H GLU 97 HN GLU 97 89.813 12.641 -4.834 638 HA GLU 97 HA GLU 97 92.082 12.606 -6.688 639 HB2 GLU 97 HB2 GLU 97 90.298 12.067 -8.385 640 HB3 GLU 97 HB1 GLU 97 90.472 10.896 -7.081 641 HG2 GLU 97 HG2 GLU 97 88.562 11.913 -5.901 642 HG3 GLU 97 HG1 GLU 97 88.387 13.099 -7.194 643 H LEU 98 HN LEU 98 92.730 14.250 -7.840 644 HA LEU 98 HA LEU 98 91.023 16.671 -8.048 645 HB2 LEU 98 HB2 LEU 98 94.029 16.472 -8.320 646 HB3 LEU 98 HB1 LEU 98 93.065 17.940 -8.166 647 HG LEU 98 HG LEU 98 93.351 15.779 -6.056 648 HD11 LEU 98 HD11 LEU 98 94.502 18.563 -6.344 649 HD12 LEU 98 HD12 LEU 98 95.383 17.044 -6.170 650 HD13 LEU 98 HD13 LEU 98 94.468 17.695 -4.809 651 HD21 LEU 98 HD21 LEU 98 91.195 16.696 -5.741 652 HD22 LEU 98 HD22 LEU 98 91.714 18.313 -6.223 653 HD23 LEU 98 HD23 LEU 98 92.209 17.655 -4.662 654 H LEU 99 HN LEU 99 90.008 16.527 -9.994 655 HA LEU 99 HA LEU 99 91.502 15.555 -12.337 656 HB2 LEU 99 HB2 LEU 99 88.626 15.842 -11.637 657 HB3 LEU 99 HB1 LEU 99 89.024 16.127 -13.327 658 HG LEU 99 HG LEU 99 88.442 13.748 -12.828 659 HD11 LEU 99 HD11 LEU 99 89.872 13.010 -14.445 660 HD12 LEU 99 HD12 LEU 99 91.315 13.536 -13.578 661 HD13 LEU 99 HD13 LEU 99 90.386 14.695 -14.531 662 HD21 LEU 99 HD21 LEU 99 89.713 12.401 -11.392 663 HD22 LEU 99 HD22 LEU 99 89.653 13.927 -10.509 664 HD23 LEU 99 HD23 LEU 99 91.097 13.490 -11.424 665 H LEU 100 HN LEU 100 92.082 16.677 -13.994 666 HA LEU 100 HA LEU 100 91.690 19.617 -13.952 667 HB2 LEU 100 HB2 LEU 100 93.889 18.015 -15.292 668 HB3 LEU 100 HB1 LEU 100 93.789 19.772 -15.158 669 HG LEU 100 HG LEU 100 94.010 17.841 -12.832 670 HD11 LEU 100 HD11 LEU 100 96.142 17.891 -13.847 671 HD12 LEU 100 HD12 LEU 100 96.250 19.117 -12.583 672 HD13 LEU 100 HD13 LEU 100 96.004 19.600 -14.261 673 HD21 LEU 100 HD21 LEU 100 92.858 19.682 -11.954 674 HD22 LEU 100 HD22 LEU 100 93.644 20.826 -13.043 675 HD23 LEU 100 HD23 LEU 100 94.532 20.152 -11.677 676 H GLU 101 HN GLU 101 91.084 20.633 -15.898 677 HA GLU 101 HA GLU 101 89.304 19.256 -17.556 678 HB2 GLU 101 HB2 GLU 101 90.888 21.769 -18.157 679 HB3 GLU 101 HB1 GLU 101 89.468 21.217 -19.054 680 HG2 GLU 101 HG2 GLU 101 88.127 21.320 -16.994 681 HG3 GLU 101 HG1 GLU 101 89.542 21.869 -16.101 682 H ASP 102 HN ASP 102 92.727 19.572 -17.629 683 HA ASP 102 HA ASP 102 93.183 18.837 -20.339 684 HB2 ASP 102 HB2 ASP 102 94.863 19.936 -18.846 685 HB3 ASP 102 HB1 ASP 102 95.012 18.416 -17.966 686 H GLY 103 HN GLY 103 91.944 17.076 -17.732 687 HA2 GLY 103 HA2 GLY 103 91.167 14.867 -17.829 688 HA3 GLY 103 HA1 GLY 103 92.185 14.582 -19.236 689 H TYR 104 HN TYR 104 93.879 16.152 -16.773 690 HA TYR 104 HA TYR 104 95.338 13.684 -16.134 691 HB2 TYR 104 HB2 TYR 104 95.893 16.628 -15.804 692 HB3 TYR 104 HB1 TYR 104 96.812 15.447 -14.872 693 HD1 TYR 104 HD1 TYR 104 95.752 16.250 -18.380 694 HD2 TYR 104 HD2 TYR 104 98.652 14.345 -15.849 695 HE1 TYR 104 HE1 TYR 104 97.175 15.786 -20.357 696 HE2 TYR 104 HE2 TYR 104 100.074 13.880 -17.824 697 HH TYR 104 HH TYR 104 99.741 13.611 -20.300 698 H ASN 105 HN ASN 105 95.834 13.151 -13.900 699 HA ASN 105 HA ASN 105 93.870 14.190 -11.945 700 HB2 ASN 105 HB2 ASN 105 93.058 12.049 -12.937 701 HB3 ASN 105 HB1 ASN 105 94.521 11.270 -12.338 702 HD21 ASN 105 HD21 ASN 105 91.962 10.441 -11.412 703 HD22 ASN 105 HD22 ASN 105 91.811 10.869 -9.778 704 H VAL 106 HN VAL 106 94.639 14.510 -9.954 705 HA VAL 106 HA VAL 106 97.307 13.412 -9.260 706 HB VAL 106 HB VAL 106 96.365 16.106 -8.280 707 HG11 VAL 106 HG11 VAL 106 98.728 16.469 -7.942 708 HG12 VAL 106 HG12 VAL 106 99.134 15.007 -8.843 709 HG13 VAL 106 HG13 VAL 106 98.334 14.884 -7.274 710 HG21 VAL 106 HG21 VAL 106 97.618 15.426 -10.947 711 HG22 VAL 106 HG22 VAL 106 97.848 17.006 -10.199 712 HG23 VAL 106 HG23 VAL 106 96.227 16.458 -10.620 713 H TYR 107 HN TYR 107 97.628 13.091 -6.971 714 HA TYR 107 HA TYR 107 95.078 12.714 -5.488 715 HB2 TYR 107 HB2 TYR 107 97.662 11.152 -5.293 716 HB3 TYR 107 HB1 TYR 107 96.212 10.870 -4.328 717 HD1 TYR 107 HD1 TYR 107 97.814 10.407 -7.566 718 HD2 TYR 107 HD2 TYR 107 94.093 10.123 -5.434 719 HE1 TYR 107 HE1 TYR 107 96.883 8.997 -9.380 720 HE2 TYR 107 HE2 TYR 107 93.163 8.712 -7.249 721 HH TYR 107 HH TYR 107 94.182 8.562 -10.162 722 H GLN 108 HN GLN 108 94.945 13.276 -3.387 723 HA GLN 108 HA GLN 108 97.248 14.414 -1.982 724 HB2 GLN 108 HB2 GLN 108 96.320 16.361 -3.134 725 HB3 GLN 108 HB1 GLN 108 94.705 15.966 -2.547 726 HG2 GLN 108 HG2 GLN 108 95.388 16.339 -0.246 727 HG3 GLN 108 HG1 GLN 108 97.064 16.572 -0.742 728 HE21 GLN 108 HE21 GLN 108 95.156 18.495 0.613 729 HE22 GLN 108 HE22 GLN 108 95.118 19.861 -0.394 730 H SER 109 HN SER 109 97.122 14.033 0.195 731 HA SER 109 HA SER 109 95.155 12.228 1.166 732 HB2 SER 109 HB2 SER 109 97.389 12.298 2.141 733 HB3 SER 109 HB1 SER 109 97.140 13.961 2.657 734 HG SER 109 HG SER 109 95.718 11.650 3.501 735 H GLU 110 HN GLU 110 93.232 12.582 2.099 736 HA GLU 110 HA GLU 110 92.200 15.290 2.201 737 HB2 GLU 110 HB2 GLU 110 90.069 14.225 2.572 738 HB3 GLU 110 HB1 GLU 110 90.909 13.354 1.294 739 HG2 GLU 110 HG2 GLU 110 90.131 11.611 2.653 740 HG3 GLU 110 HG1 GLU 110 91.779 11.831 3.227 741 H ALA 111 HN ALA 111 93.466 12.949 4.399 742 HA ALA 111 HA ALA 111 92.144 13.816 6.754 743 HB1 ALA 111 HB1 ALA 111 94.752 12.356 6.367 744 HB2 ALA 111 HB2 ALA 111 93.166 11.637 6.655 745 HB3 ALA 111 HB3 ALA 111 93.955 12.571 7.926 746 H HIS 112 HN HIS 112 95.521 14.426 5.711 747 HA HIS 112 HA HIS 112 95.583 16.737 7.564 748 HB2 HIS 112 HB2 HIS 112 97.756 14.975 6.443 749 HB3 HIS 112 HB1 HIS 112 98.082 16.480 7.292 750 HD2 HIS 112 HD2 HIS 112 97.053 12.820 8.101 751 HE1 HIS 112 HE1 HIS 112 97.029 14.967 11.736 752 HE2 HIS 112 HE2 HIS 112 96.885 12.654 10.704 753 H GLY 113 HN GLY 113 95.448 15.967 4.249 754 HA2 GLY 113 HA2 GLY 113 95.294 17.501 2.484 755 HA3 GLY 113 HA1 GLY 113 95.872 18.762 3.559 756 H LEU 114 HN LEU 114 97.751 15.906 3.632 757 HA LEU 114 HA LEU 114 100.043 17.252 2.601 758 HB2 LEU 114 HB2 LEU 114 99.533 14.369 3.343 759 HB3 LEU 114 HB1 LEU 114 101.105 14.950 2.797 760 HG LEU 114 HG LEU 114 99.732 16.391 5.062 761 HD11 LEU 114 HD11 LEU 114 100.708 14.877 6.692 762 HD12 LEU 114 HD12 LEU 114 101.414 13.893 5.412 763 HD13 LEU 114 HD13 LEU 114 99.665 13.948 5.619 764 HD21 LEU 114 HD21 LEU 114 101.941 17.102 3.906 765 HD22 LEU 114 HD22 LEU 114 102.665 15.712 4.714 766 HD23 LEU 114 HD23 LEU 114 101.948 17.012 5.665 767 HA PRO 115 HA PRO 115 99.325 16.104 -1.685 768 HB2 PRO 115 HB2 PRO 115 101.697 16.819 -2.776 769 HB3 PRO 115 HB1 PRO 115 100.544 18.033 -2.176 770 HG2 PRO 115 HG2 PRO 115 102.980 16.922 -0.835 771 HG3 PRO 115 HG1 PRO 115 102.441 18.608 -0.964 772 HD2 PRO 115 HD2 PRO 115 101.995 17.086 1.271 773 HD3 PRO 115 HD1 PRO 115 100.896 18.389 0.761 774 H LEU 116 HN LEU 116 99.973 14.452 -3.217 775 HA LEU 116 HA LEU 116 101.586 12.304 -1.979 776 HB2 LEU 116 HB2 LEU 116 99.176 11.909 -2.745 777 HB3 LEU 116 HB1 LEU 116 99.776 12.060 -4.392 778 HG LEU 116 HG LEU 116 101.195 10.152 -2.534 779 HD11 LEU 116 HD11 LEU 116 99.632 8.358 -3.072 780 HD12 LEU 116 HD12 LEU 116 98.608 9.489 -3.953 781 HD13 LEU 116 HD13 LEU 116 98.805 9.655 -2.211 782 HD21 LEU 116 HD21 LEU 116 101.310 8.836 -4.700 783 HD22 LEU 116 HD22 LEU 116 102.157 10.377 -4.731 784 HD23 LEU 116 HD23 LEU 116 100.582 10.223 -5.506 785 H HIS 117 HN HIS 117 103.555 11.956 -2.695 786 HA HIS 117 HA HIS 117 104.246 12.275 -5.509 787 HB2 HIS 117 HB2 HIS 117 106.183 13.757 -4.965 788 HB3 HIS 117 HB1 HIS 117 104.622 14.535 -4.695 789 HD2 HIS 117 HD2 HIS 117 107.719 13.357 -2.627 790 HE1 HIS 117 HE1 HIS 117 104.902 14.946 0.087 791 HE2 HIS 117 HE2 HIS 117 107.275 14.076 -0.155 792 H LEU 118 HN LEU 118 106.265 11.260 -6.035 793 HA LEU 118 HA LEU 118 106.767 8.899 -4.648 794 HB2 LEU 118 HB2 LEU 118 108.589 10.417 -6.524 795 HB3 LEU 118 HB1 LEU 118 108.840 8.750 -6.012 796 HG LEU 118 HG LEU 118 106.395 9.772 -7.496 797 HD11 LEU 118 HD11 LEU 118 107.284 8.583 -9.419 798 HD12 LEU 118 HD12 LEU 118 108.657 8.005 -8.467 799 HD13 LEU 118 HD13 LEU 118 108.504 9.723 -8.845 800 HD21 LEU 118 HD21 LEU 118 107.146 7.138 -6.262 801 HD22 LEU 118 HD22 LEU 118 106.281 7.111 -7.798 802 HD23 LEU 118 HD23 LEU 118 105.564 7.906 -6.398 803 HA PRO 119 HA PRO 119 109.301 9.990 -1.156 804 HB2 PRO 119 HB2 PRO 119 111.293 7.956 -2.098 805 HB3 PRO 119 HB1 PRO 119 110.526 8.127 -0.506 806 HG2 PRO 119 HG2 PRO 119 109.774 6.224 -2.231 807 HG3 PRO 119 HG1 PRO 119 108.615 7.029 -1.161 808 HD2 PRO 119 HD2 PRO 119 108.998 7.371 -4.107 809 HD3 PRO 119 HD1 PRO 119 107.532 7.552 -3.116 810 H GLY 120 HN GLY 120 111.012 11.366 -0.713 811 HA2 GLY 120 HA2 GLY 120 113.172 11.768 -2.610 812 HA3 GLY 120 HA1 GLY 120 112.027 13.102 -2.501 813 H ASN 121 HN ASN 121 113.778 14.400 -1.731 814 HA ASN 121 HA ASN 121 114.851 15.554 -0.076 815 HB2 ASN 121 HB2 ASN 121 113.426 13.770 1.907 816 HB3 ASN 121 HB1 ASN 121 114.130 15.355 2.199 817 HD21 ASN 121 HD21 ASN 121 111.314 13.692 0.959 818 HD22 ASN 121 HD22 ASN 121 110.420 15.084 0.587 819 H LYS 122 HN LYS 122 114.807 12.036 0.264 820 HA LYS 122 HA LYS 122 117.118 11.774 1.860 821 HB2 LYS 122 HB2 LYS 122 115.986 9.906 -0.240 822 HB3 LYS 122 HB1 LYS 122 117.231 9.469 0.925 823 HG2 LYS 122 HG2 LYS 122 114.479 10.484 1.698 824 HG3 LYS 122 HG1 LYS 122 114.899 8.775 1.588 825 HD2 LYS 122 HD2 LYS 122 116.850 9.404 3.221 826 HD3 LYS 122 HD1 LYS 122 115.884 10.843 3.552 827 HE2 LYS 122 HE2 LYS 122 115.208 7.961 4.077 828 HE3 LYS 122 HE1 LYS 122 115.092 9.343 5.167 829 HZ1 LYS 122 HZ1 LYS 122 112.938 8.481 4.215 830 HZ2 LYS 122 HZ2 LYS 122 113.445 9.108 2.720 831 HZ3 LYS 122 HZ3 LYS 122 113.212 10.146 4.045 832 H SER 123 HN SER 123 116.641 11.999 -1.629 833 HA SER 123 HA SER 123 119.393 11.589 -2.300 834 HB2 SER 123 HB2 SER 123 116.880 12.273 -3.715 835 HB3 SER 123 HB1 SER 123 118.350 12.849 -4.490 836 HG SER 123 HG SER 123 117.581 10.621 -4.969 837 HA PRO 124 HA PRO 124 121.085 15.599 -1.619 838 HB2 PRO 124 HB2 PRO 124 122.538 16.043 -3.950 839 HB3 PRO 124 HB1 PRO 124 123.081 15.006 -2.618 840 HG2 PRO 124 HG2 PRO 124 121.759 14.243 -5.187 841 HG3 PRO 124 HG1 PRO 124 123.104 13.458 -4.336 842 HD2 PRO 124 HD2 PRO 124 120.601 12.467 -4.200 843 HD3 PRO 124 HD1 PRO 124 121.692 12.400 -2.801 844 H HIS 125 HN HIS 125 120.755 17.823 -2.108 845 HA HIS 125 HA HIS 125 118.317 18.477 -3.298 846 HB2 HIS 125 HB2 HIS 125 119.125 20.832 -3.216 847 HB3 HIS 125 HB1 HIS 125 119.343 19.966 -1.697 848 HD2 HIS 125 HD2 HIS 125 121.494 21.767 -4.366 849 HE1 HIS 125 HE1 HIS 125 124.160 19.910 -1.667 850 HE2 HIS 125 HE2 HIS 125 123.983 21.546 -3.602 851 H ARG 126 HN ARG 126 117.767 18.251 -5.333 852 HA ARG 126 HA ARG 126 119.321 19.504 -7.430 853 HB2 ARG 126 HB2 ARG 126 120.312 17.200 -7.222 854 HB3 ARG 126 HB1 ARG 126 118.724 16.539 -7.601 855 HG2 ARG 126 HG2 ARG 126 119.762 16.561 -9.702 856 HG3 ARG 126 HG1 ARG 126 118.858 18.070 -9.725 857 HD2 ARG 126 HD2 ARG 126 120.872 19.318 -9.096 858 HD3 ARG 126 HD1 ARG 126 121.780 17.818 -8.947 859 HE ARG 126 HE ARG 126 120.807 17.795 -11.520 860 HH11 ARG 126 HH11 ARG 126 121.954 18.683 -13.271 861 HH12 ARG 126 HH12 ARG 126 123.149 19.904 -12.987 862 HH21 ARG 126 HH21 ARG 126 122.685 19.931 -9.552 863 HH22 ARG 126 HH22 ARG 126 123.568 20.608 -10.880 864 H ASP 127 HN ASP 127 116.938 16.882 -7.527 865 HA ASP 127 HA ASP 127 114.844 18.775 -8.376 866 HB2 ASP 127 HB2 ASP 127 115.615 16.283 -9.908 867 HB3 ASP 127 HB1 ASP 127 114.251 17.339 -10.274 868 HA PRO 128 HA PRO 128 113.291 15.525 -5.480 869 HB2 PRO 128 HB2 PRO 128 111.947 17.135 -3.763 870 HB3 PRO 128 HB1 PRO 128 113.708 16.917 -3.674 871 HG2 PRO 128 HG2 PRO 128 112.142 19.177 -4.832 872 HG3 PRO 128 HG1 PRO 128 113.636 19.215 -3.880 873 HD2 PRO 128 HD2 PRO 128 113.541 19.429 -6.646 874 HD3 PRO 128 HD1 PRO 128 114.972 18.886 -5.742 875 H ALA 129 HN ALA 129 111.646 18.106 -7.187 876 HA ALA 129 HA ALA 129 109.569 16.365 -8.038 877 HB1 ALA 129 HB1 ALA 129 108.889 18.396 -5.908 878 HB2 ALA 129 HB2 ALA 129 108.668 16.647 -5.829 879 HB3 ALA 129 HB3 ALA 129 107.685 17.612 -6.931 880 HA PRO 130 HA PRO 130 109.511 19.652 -11.054 881 HB2 PRO 130 HB2 PRO 130 107.222 19.058 -12.423 882 HB3 PRO 130 HB1 PRO 130 108.693 18.070 -12.549 883 HG2 PRO 130 HG2 PRO 130 106.226 17.596 -10.926 884 HG3 PRO 130 HG1 PRO 130 107.187 16.446 -11.874 885 HD2 PRO 130 HD2 PRO 130 107.414 16.683 -9.146 886 HD3 PRO 130 HD1 PRO 130 108.756 16.163 -10.190 887 H ARG 131 HN ARG 131 109.152 21.245 -9.289 888 HA ARG 131 HA ARG 131 107.933 22.862 -8.151 889 HB2 ARG 131 HB2 ARG 131 108.269 23.706 -10.496 890 HB3 ARG 131 HB1 ARG 131 106.649 23.123 -10.875 891 HG2 ARG 131 HG2 ARG 131 105.764 24.543 -9.005 892 HG3 ARG 131 HG1 ARG 131 107.384 25.212 -8.804 893 HD2 ARG 131 HD2 ARG 131 105.740 25.322 -11.349 894 HD3 ARG 131 HD1 ARG 131 105.984 26.664 -10.236 895 HE ARG 131 HE ARG 131 108.526 25.907 -10.887 896 HH11 ARG 131 HH11 ARG 131 109.656 26.758 -12.668 897 HH12 ARG 131 HH12 ARG 131 108.778 27.376 -14.025 898 HH21 ARG 131 HH21 ARG 131 105.665 26.686 -12.664 899 HH22 ARG 131 HH22 ARG 131 106.515 27.336 -14.024 900 H GLY 132 HN GLY 132 106.738 21.380 -6.783 901 HA2 GLY 132 HA2 GLY 132 104.616 21.262 -5.733 902 HA3 GLY 132 HA1 GLY 132 103.841 21.541 -7.287 903 HA PRO 133 HA PRO 133 103.546 17.024 -6.160 904 HB2 PRO 133 HB2 PRO 133 100.775 17.327 -7.162 905 HB3 PRO 133 HB1 PRO 133 101.343 16.704 -5.603 906 HG2 PRO 133 HG2 PRO 133 100.108 19.105 -5.875 907 HG3 PRO 133 HG1 PRO 133 101.311 18.772 -4.615 908 HD2 PRO 133 HD2 PRO 133 101.627 20.318 -7.164 909 HD3 PRO 133 HD1 PRO 133 102.378 20.591 -5.576 910 H ALA 134 HN ALA 134 103.527 15.253 -7.570 911 HA ALA 134 HA ALA 134 103.996 15.895 -10.366 912 HB1 ALA 134 HB1 ALA 134 105.401 14.264 -9.079 913 HB2 ALA 134 HB2 ALA 134 104.724 13.607 -10.569 914 HB3 ALA 134 HB3 ALA 134 104.003 13.189 -9.014 915 H ARG 135 HN ARG 135 102.596 15.610 -12.000 916 HA ARG 135 HA ARG 135 99.870 14.881 -11.422 917 HB2 ARG 135 HB2 ARG 135 101.255 15.439 -14.059 918 HB3 ARG 135 HB1 ARG 135 99.518 15.256 -13.842 919 HG2 ARG 135 HG2 ARG 135 99.540 17.538 -13.564 920 HG3 ARG 135 HG1 ARG 135 100.057 17.159 -11.924 921 HD2 ARG 135 HD2 ARG 135 102.451 17.242 -12.787 922 HD3 ARG 135 HD1 ARG 135 101.800 17.892 -14.290 923 HE ARG 135 HE ARG 135 102.005 19.279 -11.752 924 HH11 ARG 135 HH11 ARG 135 101.368 21.446 -11.770 925 HH12 ARG 135 HH12 ARG 135 100.502 22.084 -13.126 926 HH21 ARG 135 HH21 ARG 135 100.496 19.080 -14.864 927 HH22 ARG 135 HH22 ARG 135 100.007 20.741 -14.882 928 H PHE 136 HN PHE 136 98.936 12.950 -11.601 929 HA PHE 136 HA PHE 136 100.488 10.739 -12.832 930 HB2 PHE 136 HB2 PHE 136 98.771 10.941 -10.390 931 HB3 PHE 136 HB1 PHE 136 98.704 9.422 -11.285 932 HD1 PHE 136 HD1 PHE 136 100.572 11.365 -8.900 933 HD2 PHE 136 HD2 PHE 136 100.936 8.298 -11.887 934 HE1 PHE 136 HE1 PHE 136 102.721 10.632 -7.893 935 HE2 PHE 136 HE2 PHE 136 103.081 7.575 -10.880 936 HZ PHE 136 HZ PHE 136 103.971 8.738 -8.886 937 H LEU 137 HN LEU 137 99.473 9.273 -14.135 938 HA LEU 137 HA LEU 137 96.802 10.023 -15.168 939 HB2 LEU 137 HB2 LEU 137 99.365 9.367 -16.540 940 HB3 LEU 137 HB1 LEU 137 97.906 8.714 -17.275 941 HG LEU 137 HG LEU 137 98.135 11.635 -16.502 942 HD11 LEU 137 HD11 LEU 137 98.584 11.908 -19.049 943 HD12 LEU 137 HD12 LEU 137 99.101 10.224 -18.989 944 HD13 LEU 137 HD13 LEU 137 99.930 11.436 -18.014 945 HD21 LEU 137 HD21 LEU 137 96.287 9.983 -18.240 946 HD22 LEU 137 HD22 LEU 137 96.460 11.713 -18.514 947 HD23 LEU 137 HD23 LEU 137 95.874 11.124 -16.964 948 HA PRO 138 HA PRO 138 96.353 5.725 -13.726 949 HB2 PRO 138 HB2 PRO 138 93.650 5.643 -13.510 950 HB3 PRO 138 HB1 PRO 138 94.664 6.484 -12.322 951 HG2 PRO 138 HG2 PRO 138 93.059 7.611 -14.571 952 HG3 PRO 138 HG1 PRO 138 93.295 8.238 -12.929 953 HD2 PRO 138 HD2 PRO 138 94.672 9.157 -15.161 954 HD3 PRO 138 HD1 PRO 138 95.260 9.316 -13.491 955 H LEU 139 HN LEU 139 96.758 4.244 -15.300 956 HA LEU 139 HA LEU 139 95.245 4.329 -17.805 957 HB2 LEU 139 HB2 LEU 139 97.321 2.228 -17.325 958 HB3 LEU 139 HB1 LEU 139 96.971 3.146 -18.785 959 HG LEU 139 HG LEU 139 98.327 4.257 -16.303 960 HD11 LEU 139 HD11 LEU 139 100.301 4.401 -17.863 961 HD12 LEU 139 HD12 LEU 139 99.388 3.425 -19.014 962 HD13 LEU 139 HD13 LEU 139 99.829 2.752 -17.444 963 HD21 LEU 139 HD21 LEU 139 97.866 5.468 -19.043 964 HD22 LEU 139 HD22 LEU 139 98.729 6.225 -17.706 965 HD23 LEU 139 HD23 LEU 139 96.998 5.924 -17.576 966 HA PRO 140 HA PRO 140 92.387 1.128 -16.561 967 HB2 PRO 140 HB2 PRO 140 92.953 -0.220 -19.179 968 HB3 PRO 140 HB1 PRO 140 91.397 0.261 -18.476 969 HG2 PRO 140 HG2 PRO 140 92.540 1.625 -20.491 970 HG3 PRO 140 HG1 PRO 140 91.566 2.418 -19.242 971 HD2 PRO 140 HD2 PRO 140 94.526 2.460 -19.624 972 HD3 PRO 140 HD1 PRO 140 93.454 3.667 -18.880 973 H GLY 141 HN GLY 141 92.751 -0.638 -15.281 974 HA2 GLY 141 HA2 GLY 141 95.337 -1.829 -15.170 975 HA3 GLY 141 HA1 GLY 141 93.939 -2.328 -14.248 Start of MODEL 8 1 H1 GLY 13 HT1 GLY 13 80.126 0.276 -11.513 2 H2 GLY 13 HT2 GLY 13 80.370 1.295 -10.175 3 H3 GLY 13 HT3 GLY 13 79.968 -0.338 -9.940 4 HA2 GLY 13 HA2 GLY 13 82.067 -1.019 -10.943 5 HA3 GLY 13 HA1 GLY 13 82.487 0.684 -11.134 6 H GLN 14 HN GLN 14 81.823 1.885 -8.873 7 HA GLN 14 HA GLN 14 82.504 2.303 -6.727 8 HB2 GLN 14 HB2 GLN 14 82.254 -0.700 -6.452 9 HB3 GLN 14 HB1 GLN 14 82.389 0.445 -5.118 10 HG2 GLN 14 HG2 GLN 14 80.059 0.033 -5.351 11 HG3 GLN 14 HG1 GLN 14 80.329 1.604 -6.105 12 HE21 GLN 14 HE21 GLN 14 78.827 1.611 -7.823 13 HE22 GLN 14 HE22 GLN 14 78.732 0.396 -9.003 14 H VAL 15 HN VAL 15 84.064 -0.842 -7.334 15 HA VAL 15 HA VAL 15 86.692 0.436 -6.827 16 HB VAL 15 HB VAL 15 86.265 -1.081 -5.051 17 HG11 VAL 15 HG11 VAL 15 85.542 -3.122 -7.174 18 HG12 VAL 15 HG12 VAL 15 84.390 -2.287 -6.132 19 HG13 VAL 15 HG13 VAL 15 85.558 -3.409 -5.435 20 HG21 VAL 15 HG21 VAL 15 88.518 -1.250 -6.271 21 HG22 VAL 15 HG22 VAL 15 87.889 -2.717 -7.018 22 HG23 VAL 15 HG23 VAL 15 88.079 -2.634 -5.268 23 H ARG 16 HN ARG 16 88.220 0.231 -8.297 24 HA ARG 16 HA ARG 16 87.880 -1.685 -10.531 25 HB2 ARG 16 HB2 ARG 16 88.549 1.258 -10.805 26 HB3 ARG 16 HB1 ARG 16 88.541 0.080 -12.118 27 HG2 ARG 16 HG2 ARG 16 86.145 -0.350 -11.735 28 HG3 ARG 16 HG1 ARG 16 86.145 0.809 -10.405 29 HD2 ARG 16 HD2 ARG 16 86.916 1.510 -13.248 30 HD3 ARG 16 HD1 ARG 16 85.304 1.758 -12.580 31 HE ARG 16 HE ARG 16 87.194 2.969 -10.867 32 HH11 ARG 16 HH11 ARG 16 87.492 5.216 -10.975 33 HH12 ARG 16 HH12 ARG 16 86.996 6.083 -12.390 34 HH21 ARG 16 HH21 ARG 16 85.833 3.261 -14.035 35 HH22 ARG 16 HH22 ARG 16 86.055 4.976 -14.121 36 H GLN 17 HN GLN 17 89.817 -2.282 -11.575 37 HA GLN 17 HA GLN 17 92.258 -1.801 -9.972 38 HB2 GLN 17 HB2 GLN 17 93.053 -3.889 -11.253 39 HB3 GLN 17 HB1 GLN 17 91.844 -4.115 -9.993 40 HG2 GLN 17 HG2 GLN 17 90.060 -4.095 -11.676 41 HG3 GLN 17 HG1 GLN 17 91.248 -3.840 -12.949 42 HE21 GLN 17 HE21 GLN 17 92.915 -5.637 -13.219 43 HE22 GLN 17 HE22 GLN 17 92.456 -7.223 -12.823 44 H ARG 18 HN ARG 18 93.696 -0.437 -10.817 45 HA ARG 18 HA ARG 18 94.146 -0.440 -13.732 46 HB2 ARG 18 HB2 ARG 18 93.554 2.062 -12.140 47 HB3 ARG 18 HB1 ARG 18 94.060 2.011 -13.823 48 HG2 ARG 18 HG2 ARG 18 91.997 0.487 -14.187 49 HG3 ARG 18 HG1 ARG 18 91.458 1.073 -12.614 50 HD2 ARG 18 HD2 ARG 18 92.148 2.790 -15.013 51 HD3 ARG 18 HD1 ARG 18 90.530 2.482 -14.397 52 HE ARG 18 HE ARG 18 92.635 4.010 -12.968 53 HH11 ARG 18 HH11 ARG 18 91.861 5.603 -11.597 54 HH12 ARG 18 HH12 ARG 18 90.157 5.813 -11.376 55 HH21 ARG 18 HH21 ARG 18 89.278 3.239 -13.511 56 HH22 ARG 18 HH22 ARG 18 88.708 4.488 -12.462 57 H TYR 19 HN TYR 19 96.105 0.618 -14.385 58 HA TYR 19 HA TYR 19 98.242 0.403 -12.371 59 HB2 TYR 19 HB2 TYR 19 98.281 0.798 -15.372 60 HB3 TYR 19 HB1 TYR 19 99.718 0.785 -14.373 61 HD1 TYR 19 HD1 TYR 19 96.768 -1.291 -15.344 62 HD2 TYR 19 HD2 TYR 19 100.763 -1.241 -13.754 63 HE1 TYR 19 HE1 TYR 19 96.874 -3.765 -15.509 64 HE2 TYR 19 HE2 TYR 19 100.868 -3.703 -13.916 65 HH TYR 19 HH TYR 19 98.211 -5.562 -15.375 66 H LEU 20 HN LEU 20 99.459 2.207 -11.688 67 HA LEU 20 HA LEU 20 98.356 4.837 -12.470 68 HB2 LEU 20 HB2 LEU 20 98.866 3.812 -9.996 69 HB3 LEU 20 HB1 LEU 20 100.389 4.636 -10.296 70 HG LEU 20 HG LEU 20 98.874 6.655 -11.005 71 HD11 LEU 20 HD11 LEU 20 96.951 4.953 -9.401 72 HD12 LEU 20 HD12 LEU 20 96.716 5.587 -11.030 73 HD13 LEU 20 HD13 LEU 20 96.739 6.684 -9.651 74 HD21 LEU 20 HD21 LEU 20 100.280 6.794 -9.059 75 HD22 LEU 20 HD22 LEU 20 99.230 5.705 -8.154 76 HD23 LEU 20 HD23 LEU 20 98.673 7.327 -8.564 77 H TYR 21 HN TYR 21 99.369 5.824 -14.097 78 HA TYR 21 HA TYR 21 102.330 5.572 -14.336 79 HB2 TYR 21 HB2 TYR 21 101.296 4.367 -16.131 80 HB3 TYR 21 HB1 TYR 21 100.179 5.686 -16.455 81 HD1 TYR 21 HD1 TYR 21 103.576 4.417 -16.904 82 HD2 TYR 21 HD2 TYR 21 100.973 7.786 -17.498 83 HE1 TYR 21 HE1 TYR 21 105.198 5.388 -18.504 84 HE2 TYR 21 HE2 TYR 21 102.601 8.758 -19.098 85 HH TYR 21 HH TYR 21 104.514 7.654 -20.670 86 H THR 22 HN THR 22 103.508 7.415 -14.840 87 HA THR 22 HA THR 22 102.031 9.954 -15.178 88 HB THR 22 HB THR 22 102.581 9.973 -12.849 89 HG1 THR 22 HG1 THR 22 104.801 11.355 -13.699 90 HG21 THR 22 HG21 THR 22 105.023 9.687 -12.199 91 HG22 THR 22 HG22 THR 22 105.270 9.013 -13.809 92 HG23 THR 22 HG23 THR 22 104.174 8.222 -12.685 93 H SER 23 HN SER 23 103.134 11.549 -16.327 94 HA SER 23 HA SER 23 105.474 10.567 -17.866 95 HB2 SER 23 HB2 SER 23 103.559 11.007 -19.279 96 HB3 SER 23 HB1 SER 23 103.335 12.597 -18.553 97 HG SER 23 HG SER 23 104.516 13.062 -20.287 98 H GLY 24 HN GLY 24 107.336 11.420 -17.258 99 HA2 GLY 24 HA2 GLY 24 107.420 14.019 -15.882 100 HA3 GLY 24 HA1 GLY 24 108.725 12.837 -15.972 101 HA PRO 25 HA PRO 25 109.688 16.252 -18.978 102 HB2 PRO 25 HB2 PRO 25 112.459 15.480 -18.190 103 HB3 PRO 25 HB1 PRO 25 111.717 17.091 -18.257 104 HG2 PRO 25 HG2 PRO 25 112.237 15.861 -15.926 105 HG3 PRO 25 HG1 PRO 25 110.830 16.919 -16.140 106 HD2 PRO 25 HD2 PRO 25 110.939 13.922 -16.050 107 HD3 PRO 25 HD1 PRO 25 109.682 15.023 -15.441 108 H HIS 26 HN HIS 26 110.367 15.965 -21.113 109 HA HIS 26 HA HIS 26 110.261 13.410 -22.226 110 HB2 HIS 26 HB2 HIS 26 111.386 14.568 -24.235 111 HB3 HIS 26 HB1 HIS 26 109.840 15.213 -23.683 112 HD2 HIS 26 HD2 HIS 26 113.494 16.398 -24.112 113 HE1 HIS 26 HE1 HIS 26 111.465 19.412 -21.961 114 HE2 HIS 26 HE2 HIS 26 113.607 18.843 -23.202 115 H GLY 27 HN GLY 27 111.630 11.775 -22.036 116 HA2 GLY 27 HA2 GLY 27 114.489 12.181 -22.386 117 HA3 GLY 27 HA1 GLY 27 114.010 11.584 -20.800 118 H LEU 28 HN LEU 28 115.094 9.617 -21.121 119 HA LEU 28 HA LEU 28 114.465 7.923 -23.371 120 HB2 LEU 28 HB2 LEU 28 116.694 7.959 -22.268 121 HB3 LEU 28 HB1 LEU 28 115.966 7.263 -20.827 122 HG LEU 28 HG LEU 28 115.078 5.437 -22.614 123 HD11 LEU 28 HD11 LEU 28 116.641 5.036 -24.394 124 HD12 LEU 28 HD12 LEU 28 117.725 6.296 -23.804 125 HD13 LEU 28 HD13 LEU 28 116.162 6.730 -24.498 126 HD21 LEU 28 HD21 LEU 28 116.379 4.766 -20.723 127 HD22 LEU 28 HD22 LEU 28 117.815 5.591 -21.334 128 HD23 LEU 28 HD23 LEU 28 117.221 4.141 -22.143 129 H SER 29 HN SER 29 114.669 6.150 -20.498 130 HA SER 29 HA SER 29 112.263 4.779 -20.927 131 HB2 SER 29 HB2 SER 29 112.741 3.672 -18.827 132 HB3 SER 29 HB1 SER 29 114.231 3.861 -19.739 133 HG SER 29 HG SER 29 114.294 4.477 -17.453 134 H SER 30 HN SER 30 110.415 4.597 -19.573 135 HA SER 30 HA SER 30 109.482 7.189 -18.567 136 HB2 SER 30 HB2 SER 30 107.858 4.672 -18.862 137 HB3 SER 30 HB1 SER 30 107.292 6.338 -18.807 138 HG SER 30 HG SER 30 107.355 6.028 -20.917 139 H CYS 31 HN CYS 31 108.046 7.127 -16.598 140 HA CYS 31 HA CYS 31 109.204 5.324 -14.539 141 HB2 CYS 31 HB2 CYS 31 108.783 8.234 -14.626 142 HB3 CYS 31 HB1 CYS 31 108.137 7.505 -13.166 143 H HIS 32 HN HIS 32 107.808 3.847 -13.845 144 HA HIS 32 HA HIS 32 104.907 4.493 -13.783 145 HB2 HIS 32 HB2 HIS 32 105.704 2.687 -15.418 146 HB3 HIS 32 HB1 HIS 32 106.086 1.718 -13.994 147 HD2 HIS 32 HD2 HIS 32 103.946 0.051 -13.573 148 HE1 HIS 32 HE1 HIS 32 100.863 2.769 -14.513 149 HE2 HIS 32 HE2 HIS 32 101.366 0.422 -13.695 150 H LEU 33 HN LEU 33 103.948 4.410 -11.802 151 HA LEU 33 HA LEU 33 105.478 4.113 -9.461 152 HB2 LEU 33 HB2 LEU 33 103.083 5.192 -9.908 153 HB3 LEU 33 HB1 LEU 33 102.512 3.618 -9.361 154 HG LEU 33 HG LEU 33 104.318 5.538 -7.840 155 HD11 LEU 33 HD11 LEU 33 101.456 4.616 -7.540 156 HD12 LEU 33 HD12 LEU 33 102.072 6.264 -7.633 157 HD13 LEU 33 HD13 LEU 33 102.351 5.300 -6.183 158 HD21 LEU 33 HD21 LEU 33 103.916 3.753 -5.985 159 HD22 LEU 33 HD22 LEU 33 105.148 3.446 -7.204 160 HD23 LEU 33 HD23 LEU 33 103.568 2.665 -7.327 161 H GLU 34 HN GLU 34 106.143 2.404 -8.366 162 HA GLU 34 HA GLU 34 104.727 -0.174 -8.608 163 HB2 GLU 34 HB2 GLU 34 107.032 -1.266 -8.585 164 HB3 GLU 34 HB1 GLU 34 106.552 -0.498 -10.097 165 HG2 GLU 34 HG2 GLU 34 107.882 1.465 -9.591 166 HG3 GLU 34 HG1 GLU 34 108.236 0.863 -7.976 167 H ILE 35 HN ILE 35 104.449 -1.183 -6.690 168 HA ILE 35 HA ILE 35 105.829 -0.042 -4.321 169 HB ILE 35 HB ILE 35 103.233 -1.603 -4.446 170 HG12 ILE 35 HG12 ILE 35 103.763 1.344 -3.918 171 HG13 ILE 35 HG11 ILE 35 103.078 0.686 -5.404 172 HG21 ILE 35 HG21 ILE 35 104.660 -0.202 -2.158 173 HG22 ILE 35 HG22 ILE 35 104.469 -1.944 -2.340 174 HG23 ILE 35 HG23 ILE 35 103.059 -0.933 -2.054 175 HD11 ILE 35 HD11 ILE 35 101.210 1.395 -4.094 176 HD12 ILE 35 HD12 ILE 35 101.868 0.655 -2.633 177 HD13 ILE 35 HD13 ILE 35 101.262 -0.362 -3.943 178 H ARG 36 HN ARG 36 107.247 -1.264 -3.300 179 HA ARG 36 HA ARG 36 107.715 -3.989 -4.186 180 HB2 ARG 36 HB2 ARG 36 109.132 -2.018 -2.434 181 HB3 ARG 36 HB1 ARG 36 109.565 -3.718 -2.311 182 HG2 ARG 36 HG2 ARG 36 111.065 -2.822 -3.912 183 HG3 ARG 36 HG1 ARG 36 109.851 -3.651 -4.879 184 HD2 ARG 36 HD2 ARG 36 108.677 -1.508 -5.235 185 HD3 ARG 36 HD1 ARG 36 109.887 -0.682 -4.258 186 HE ARG 36 HE ARG 36 111.048 -2.146 -6.448 187 HH11 ARG 36 HH11 ARG 36 111.881 -0.904 -8.165 188 HH12 ARG 36 HH12 ARG 36 111.470 0.774 -8.290 189 HH21 ARG 36 HH21 ARG 36 109.489 0.777 -5.446 190 HH22 ARG 36 HH22 ARG 36 110.121 1.725 -6.752 191 H GLU 37 HN GLU 37 108.032 -5.714 -2.667 192 HA GLU 37 HA GLU 37 105.793 -6.074 -0.927 193 HB2 GLU 37 HB2 GLU 37 108.326 -7.704 -1.281 194 HB3 GLU 37 HB1 GLU 37 106.902 -8.224 -0.379 195 HG2 GLU 37 HG2 GLU 37 105.533 -8.072 -2.392 196 HG3 GLU 37 HG1 GLU 37 106.915 -7.465 -3.305 197 H ASP 38 HN ASP 38 109.019 -4.942 -0.666 198 HA ASP 38 HA ASP 38 109.343 -5.286 2.162 199 HB2 ASP 38 HB2 ASP 38 110.750 -3.429 0.221 200 HB3 ASP 38 HB1 ASP 38 111.274 -3.779 1.867 201 H GLY 39 HN GLY 39 107.430 -3.329 0.268 202 HA2 GLY 39 HA2 GLY 39 105.832 -1.806 1.043 203 HA3 GLY 39 HA1 GLY 39 106.738 -1.631 2.541 204 H THR 40 HN THR 40 108.814 -1.411 -0.138 205 HA THR 40 HA THR 40 109.042 1.480 0.290 206 HB THR 40 HB THR 40 110.971 1.184 -1.393 207 HG1 THR 40 HG1 THR 40 110.839 -0.714 -2.291 208 HG21 THR 40 HG21 THR 40 112.386 0.070 0.410 209 HG22 THR 40 HG22 THR 40 110.888 -0.139 1.320 210 HG23 THR 40 HG23 THR 40 111.460 1.481 0.923 211 H VAL 41 HN VAL 41 109.194 2.956 -1.584 212 HA VAL 41 HA VAL 41 107.417 2.145 -3.819 213 HB VAL 41 HB VAL 41 107.317 4.732 -2.258 214 HG11 VAL 41 HG11 VAL 41 105.930 3.771 -4.762 215 HG12 VAL 41 HG12 VAL 41 106.791 5.288 -4.500 216 HG13 VAL 41 HG13 VAL 41 105.225 5.021 -3.736 217 HG21 VAL 41 HG21 VAL 41 105.384 2.406 -2.498 218 HG22 VAL 41 HG22 VAL 41 105.042 3.920 -1.660 219 HG23 VAL 41 HG23 VAL 41 106.308 2.847 -1.062 220 H GLY 42 HN GLY 42 107.946 2.845 -5.797 221 HA2 GLY 42 HA2 GLY 42 109.726 5.042 -6.305 222 HA3 GLY 42 HA1 GLY 42 110.513 3.480 -6.532 223 H CYS 43 HN CYS 43 110.436 4.836 -8.784 224 HA CYS 43 HA CYS 43 107.957 4.139 -10.211 225 HB2 CYS 43 HB2 CYS 43 108.340 5.946 -11.524 226 HB3 CYS 43 HB1 CYS 43 109.518 6.413 -10.309 227 H ALA 44 HN ALA 44 108.070 3.074 -12.288 228 HA ALA 44 HA ALA 44 110.454 1.385 -12.729 229 HB1 ALA 44 HB1 ALA 44 109.329 -0.499 -12.139 230 HB2 ALA 44 HB2 ALA 44 108.084 -0.151 -13.340 231 HB3 ALA 44 HB3 ALA 44 107.935 0.484 -11.706 232 H ALA 45 HN ALA 45 110.868 0.864 -14.832 233 HA ALA 45 HA ALA 45 109.301 2.317 -16.888 234 HB1 ALA 45 HB1 ALA 45 111.586 2.994 -16.922 235 HB2 ALA 45 HB2 ALA 45 111.395 1.875 -18.273 236 HB3 ALA 45 HB3 ALA 45 112.159 1.332 -16.779 237 H ASP 46 HN ASP 46 109.667 -0.719 -15.552 238 HA ASP 46 HA ASP 46 109.367 -2.201 -18.071 239 HB2 ASP 46 HB2 ASP 46 109.588 -4.187 -16.608 240 HB3 ASP 46 HB1 ASP 46 110.965 -3.094 -16.502 241 H GLN 47 HN GLN 47 107.363 -0.761 -15.862 242 HA GLN 47 HA GLN 47 105.131 -1.069 -15.246 243 HB2 GLN 47 HB2 GLN 47 105.192 -2.171 -18.056 244 HB3 GLN 47 HB1 GLN 47 103.713 -1.818 -17.165 245 HG2 GLN 47 HG2 GLN 47 104.322 0.531 -16.999 246 HG3 GLN 47 HG1 GLN 47 105.887 0.211 -17.745 247 HE21 GLN 47 HE21 GLN 47 103.719 1.991 -18.779 248 HE22 GLN 47 HE22 GLN 47 103.316 1.377 -20.309 249 H SER 48 HN SER 48 105.433 -2.630 -13.582 250 HA SER 48 HA SER 48 104.956 -5.443 -14.387 251 HB2 SER 48 HB2 SER 48 106.676 -4.210 -12.281 252 HB3 SER 48 HB1 SER 48 105.986 -5.798 -11.967 253 HG SER 48 HG SER 48 108.088 -5.214 -13.429 254 HA PRO 49 HA PRO 49 101.116 -5.676 -12.190 255 HB2 PRO 49 HB2 PRO 49 102.320 -7.824 -10.471 256 HB3 PRO 49 HB1 PRO 49 100.784 -7.826 -11.362 257 HG2 PRO 49 HG2 PRO 49 102.875 -9.159 -12.288 258 HG3 PRO 49 HG1 PRO 49 101.811 -8.263 -13.389 259 HD2 PRO 49 HD2 PRO 49 104.564 -7.554 -12.441 260 HD3 PRO 49 HD1 PRO 49 103.789 -7.252 -14.010 261 H GLU 50 HN GLU 50 104.040 -5.658 -10.188 262 HA GLU 50 HA GLU 50 102.959 -5.025 -7.710 263 HB2 GLU 50 HB2 GLU 50 105.110 -3.876 -7.249 264 HB3 GLU 50 HB1 GLU 50 105.346 -5.447 -8.006 265 HG2 GLU 50 HG2 GLU 50 105.543 -4.314 -10.216 266 HG3 GLU 50 HG1 GLU 50 105.425 -2.759 -9.396 267 H SER 51 HN SER 51 102.972 -3.174 -10.602 268 HA SER 51 HA SER 51 102.559 -0.610 -9.287 269 HB2 SER 51 HB2 SER 51 102.590 -1.451 -12.184 270 HB3 SER 51 HB1 SER 51 102.341 0.201 -11.632 271 HG SER 51 HG SER 51 104.394 -0.268 -10.396 272 H LEU 52 HN LEU 52 100.650 -3.242 -10.090 273 HA LEU 52 HA LEU 52 98.309 -1.827 -10.968 274 HB2 LEU 52 HB2 LEU 52 99.162 -4.444 -11.075 275 HB3 LEU 52 HB1 LEU 52 97.958 -4.537 -9.796 276 HG LEU 52 HG LEU 52 97.479 -3.338 -12.542 277 HD11 LEU 52 HD11 LEU 52 97.869 -5.795 -12.569 278 HD12 LEU 52 HD12 LEU 52 96.207 -5.381 -12.991 279 HD13 LEU 52 HD13 LEU 52 96.583 -5.990 -11.378 280 HD21 LEU 52 HD21 LEU 52 95.456 -4.145 -10.440 281 HD22 LEU 52 HD22 LEU 52 95.179 -3.201 -11.903 282 HD23 LEU 52 HD23 LEU 52 96.085 -2.502 -10.564 283 H LEU 53 HN LEU 53 97.027 -0.670 -9.708 284 HA LEU 53 HA LEU 53 96.897 -1.307 -6.804 285 HB2 LEU 53 HB2 LEU 53 96.511 1.384 -8.119 286 HB3 LEU 53 HB1 LEU 53 96.582 1.043 -6.391 287 HG LEU 53 HG LEU 53 98.852 0.558 -8.345 288 HD11 LEU 53 HD11 LEU 53 98.251 2.974 -7.901 289 HD12 LEU 53 HD12 LEU 53 99.888 2.525 -7.419 290 HD13 LEU 53 HD13 LEU 53 98.619 2.684 -6.202 291 HD21 LEU 53 HD21 LEU 53 99.190 -0.953 -6.569 292 HD22 LEU 53 HD22 LEU 53 98.499 0.145 -5.373 293 HD23 LEU 53 HD23 LEU 53 100.099 0.462 -6.043 294 H GLN 54 HN GLN 54 94.978 -1.789 -5.990 295 HA GLN 54 HA GLN 54 92.620 -1.756 -7.670 296 HB2 GLN 54 HB2 GLN 54 93.248 -2.644 -4.872 297 HB3 GLN 54 HB1 GLN 54 91.563 -2.390 -5.311 298 HG2 GLN 54 HG2 GLN 54 93.382 -4.070 -7.028 299 HG3 GLN 54 HG1 GLN 54 92.561 -4.757 -5.628 300 HE21 GLN 54 HE21 GLN 54 91.797 -5.890 -7.956 301 HE22 GLN 54 HE22 GLN 54 90.286 -5.316 -8.475 302 H LEU 55 HN LEU 55 91.638 0.127 -8.060 303 HA LEU 55 HA LEU 55 91.821 2.338 -6.192 304 HB2 LEU 55 HB2 LEU 55 91.955 2.907 -8.508 305 HB3 LEU 55 HB1 LEU 55 90.518 1.966 -8.896 306 HG LEU 55 HG LEU 55 89.106 3.521 -7.684 307 HD11 LEU 55 HD11 LEU 55 91.752 4.673 -6.805 308 HD12 LEU 55 HD12 LEU 55 90.388 4.156 -5.812 309 HD13 LEU 55 HD13 LEU 55 90.275 5.637 -6.766 310 HD21 LEU 55 HD21 LEU 55 91.094 5.097 -9.341 311 HD22 LEU 55 HD22 LEU 55 89.404 5.503 -9.049 312 HD23 LEU 55 HD23 LEU 55 89.815 4.091 -10.021 313 H LYS 56 HN LYS 56 90.506 2.463 -4.492 314 HA LYS 56 HA LYS 56 87.734 1.428 -4.738 315 HB2 LYS 56 HB2 LYS 56 89.529 1.484 -2.302 316 HB3 LYS 56 HB1 LYS 56 87.824 1.036 -2.289 317 HG2 LYS 56 HG2 LYS 56 88.288 -0.788 -3.881 318 HG3 LYS 56 HG1 LYS 56 89.991 -0.344 -3.894 319 HD2 LYS 56 HD2 LYS 56 89.879 -2.127 -2.338 320 HD3 LYS 56 HD1 LYS 56 89.925 -0.677 -1.338 321 HE2 LYS 56 HE2 LYS 56 87.578 -0.788 -0.898 322 HE3 LYS 56 HE1 LYS 56 87.320 -1.982 -2.168 323 HZ1 LYS 56 HZ1 LYS 56 87.331 -3.039 -0.025 324 HZ2 LYS 56 HZ2 LYS 56 88.855 -2.384 0.339 325 HZ3 LYS 56 HZ3 LYS 56 88.696 -3.535 -0.901 326 H ALA 57 HN ALA 57 86.100 2.691 -4.165 327 HA ALA 57 HA ALA 57 86.724 5.492 -3.505 328 HB1 ALA 57 HB1 ALA 57 85.299 5.105 -5.442 329 HB2 ALA 57 HB2 ALA 57 84.379 5.905 -4.168 330 HB3 ALA 57 HB3 ALA 57 84.172 4.175 -4.455 331 H LEU 58 HN LEU 58 86.964 5.698 -1.316 332 HA LEU 58 HA LEU 58 85.372 4.239 0.578 333 HB2 LEU 58 HB2 LEU 58 86.931 6.792 1.037 334 HB3 LEU 58 HB1 LEU 58 86.415 5.633 2.258 335 HG LEU 58 HG LEU 58 88.388 5.093 0.019 336 HD11 LEU 58 HD11 LEU 58 88.663 5.847 2.912 337 HD12 LEU 58 HD12 LEU 58 89.656 6.302 1.530 338 HD13 LEU 58 HD13 LEU 58 89.824 4.702 2.245 339 HD21 LEU 58 HD21 LEU 58 88.734 2.972 1.510 340 HD22 LEU 58 HD22 LEU 58 87.357 3.017 0.411 341 HD23 LEU 58 HD23 LEU 58 87.123 3.343 2.129 342 H LYS 59 HN LYS 59 85.549 7.688 -0.234 343 HA LYS 59 HA LYS 59 82.647 7.960 0.214 344 HB2 LYS 59 HB2 LYS 59 84.629 10.027 1.171 345 HB3 LYS 59 HB1 LYS 59 82.922 9.891 1.566 346 HG2 LYS 59 HG2 LYS 59 83.322 7.875 2.861 347 HG3 LYS 59 HG1 LYS 59 85.016 7.850 2.375 348 HD2 LYS 59 HD2 LYS 59 83.961 10.330 3.715 349 HD3 LYS 59 HD1 LYS 59 84.283 8.914 4.712 350 HE2 LYS 59 HE2 LYS 59 86.341 9.965 2.765 351 HE3 LYS 59 HE1 LYS 59 86.208 10.597 4.407 352 HZ1 LYS 59 HZ1 LYS 59 87.349 8.155 3.514 353 HZ2 LYS 59 HZ2 LYS 59 86.133 7.862 4.663 354 HZ3 LYS 59 HZ3 LYS 59 87.436 8.883 5.043 355 HA PRO 60 HA PRO 60 82.648 10.139 -3.652 356 HB2 PRO 60 HB2 PRO 60 81.344 12.456 -2.269 357 HB3 PRO 60 HB1 PRO 60 80.839 11.588 -3.732 358 HG2 PRO 60 HG2 PRO 60 79.633 11.226 -1.348 359 HG3 PRO 60 HG1 PRO 60 79.784 9.932 -2.550 360 HD2 PRO 60 HD2 PRO 60 81.216 10.254 0.035 361 HD3 PRO 60 HD1 PRO 60 80.896 8.783 -0.908 362 H GLY 61 HN GLY 61 84.527 10.931 -4.392 363 HA2 GLY 61 HA2 GLY 61 86.037 12.684 -4.847 364 HA3 GLY 61 HA1 GLY 61 85.561 13.470 -3.347 365 H VAL 62 HN VAL 62 85.897 10.587 -2.135 366 HA VAL 62 HA VAL 62 88.842 10.770 -1.757 367 HB VAL 62 HB VAL 62 86.732 9.812 0.192 368 HG11 VAL 62 HG11 VAL 62 89.745 10.027 0.324 369 HG12 VAL 62 HG12 VAL 62 88.747 8.598 0.595 370 HG13 VAL 62 HG13 VAL 62 88.736 9.915 1.767 371 HG21 VAL 62 HG21 VAL 62 86.652 12.232 -0.045 372 HG22 VAL 62 HG22 VAL 62 88.410 12.338 0.080 373 HG23 VAL 62 HG23 VAL 62 87.451 11.842 1.478 374 H ILE 63 HN ILE 63 90.007 8.996 -2.215 375 HA ILE 63 HA ILE 63 88.631 6.391 -2.435 376 HB ILE 63 HB ILE 63 89.606 5.949 -4.560 377 HG12 ILE 63 HG12 ILE 63 90.922 7.935 -5.668 378 HG13 ILE 63 HG11 ILE 63 91.157 8.491 -4.018 379 HG21 ILE 63 HG21 ILE 63 87.556 7.456 -4.399 380 HG22 ILE 63 HG22 ILE 63 88.450 7.540 -5.915 381 HG23 ILE 63 HG23 ILE 63 88.644 8.808 -4.705 382 HD11 ILE 63 HD11 ILE 63 92.741 6.917 -3.606 383 HD12 ILE 63 HD12 ILE 63 92.808 6.736 -5.354 384 HD13 ILE 63 HD13 ILE 63 91.828 5.633 -4.397 385 H GLN 64 HN GLN 64 90.195 4.589 -2.648 386 HA GLN 64 HA GLN 64 92.770 5.086 -1.265 387 HB2 GLN 64 HB2 GLN 64 91.021 4.246 0.325 388 HB3 GLN 64 HB1 GLN 64 90.891 2.791 -0.657 389 HG2 GLN 64 HG2 GLN 64 93.291 2.342 -0.305 390 HG3 GLN 64 HG1 GLN 64 93.413 3.791 0.693 391 HE21 GLN 64 HE21 GLN 64 94.071 1.373 1.895 392 HE22 GLN 64 HE22 GLN 64 92.857 0.911 2.986 393 H ILE 65 HN ILE 65 94.442 3.680 -1.852 394 HA ILE 65 HA ILE 65 93.884 1.920 -4.172 395 HB ILE 65 HB ILE 65 96.481 2.570 -4.572 396 HG12 ILE 65 HG12 ILE 65 95.245 5.011 -3.238 397 HG13 ILE 65 HG11 ILE 65 96.571 4.050 -2.590 398 HG21 ILE 65 HG21 ILE 65 94.140 4.329 -5.389 399 HG22 ILE 65 HG22 ILE 65 94.611 2.831 -6.191 400 HG23 ILE 65 HG23 ILE 65 95.695 4.218 -6.213 401 HD11 ILE 65 HD11 ILE 65 97.733 5.778 -3.616 402 HD12 ILE 65 HD12 ILE 65 96.542 5.952 -4.903 403 HD13 ILE 65 HD13 ILE 65 97.683 4.606 -4.935 404 H LEU 66 HN LEU 66 94.348 -0.127 -3.921 405 HA LEU 66 HA LEU 66 96.284 -0.960 -1.833 406 HB2 LEU 66 HB2 LEU 66 93.993 -1.370 -1.118 407 HB3 LEU 66 HB1 LEU 66 93.620 -2.167 -2.629 408 HG LEU 66 HG LEU 66 94.096 -3.611 -0.518 409 HD11 LEU 66 HD11 LEU 66 95.774 -4.466 -2.856 410 HD12 LEU 66 HD12 LEU 66 94.029 -4.350 -3.025 411 HD13 LEU 66 HD13 LEU 66 94.730 -5.427 -1.825 412 HD21 LEU 66 HD21 LEU 66 96.958 -3.157 -1.371 413 HD22 LEU 66 HD22 LEU 66 96.379 -4.110 -0.009 414 HD23 LEU 66 HD23 LEU 66 96.222 -2.355 0.017 415 H GLY 67 HN GLY 67 98.007 -1.907 -2.747 416 HA2 GLY 67 HA2 GLY 67 98.107 -2.746 -5.470 417 HA3 GLY 67 HA1 GLY 67 99.346 -3.033 -4.259 418 H VAL 68 HN VAL 68 97.448 -4.608 -6.354 419 HA VAL 68 HA VAL 68 96.256 -6.667 -4.824 420 HB VAL 68 HB VAL 68 96.041 -7.841 -6.944 421 HG11 VAL 68 HG11 VAL 68 95.025 -5.923 -8.282 422 HG12 VAL 68 HG12 VAL 68 95.628 -4.838 -7.027 423 HG13 VAL 68 HG13 VAL 68 94.445 -6.088 -6.627 424 HG21 VAL 68 HG21 VAL 68 98.161 -7.570 -7.980 425 HG22 VAL 68 HG22 VAL 68 98.103 -5.815 -7.823 426 HG23 VAL 68 HG23 VAL 68 97.060 -6.632 -8.986 427 H LYS 69 HN LYS 69 99.373 -6.519 -6.526 428 HA LYS 69 HA LYS 69 100.162 -9.166 -5.958 429 HB2 LYS 69 HB2 LYS 69 101.182 -7.861 -7.742 430 HB3 LYS 69 HB1 LYS 69 101.841 -6.730 -6.561 431 HG2 LYS 69 HG2 LYS 69 103.226 -8.476 -5.585 432 HG3 LYS 69 HG1 LYS 69 102.487 -9.692 -6.626 433 HD2 LYS 69 HD2 LYS 69 103.434 -8.657 -8.593 434 HD3 LYS 69 HD1 LYS 69 104.019 -7.295 -7.642 435 HE2 LYS 69 HE2 LYS 69 105.864 -8.846 -8.045 436 HE3 LYS 69 HE1 LYS 69 105.444 -8.858 -6.332 437 HZ1 LYS 69 HZ1 LYS 69 104.538 -10.833 -8.356 438 HZ2 LYS 69 HZ2 LYS 69 104.106 -10.836 -6.713 439 HZ3 LYS 69 HZ3 LYS 69 105.721 -11.097 -7.170 440 H THR 70 HN THR 70 100.988 -6.120 -4.300 441 HA THR 70 HA THR 70 102.464 -7.587 -2.254 442 HB THR 70 HB THR 70 102.965 -5.353 -1.360 443 HG1 THR 70 HG1 THR 70 101.175 -4.584 -3.409 444 HG21 THR 70 HG21 THR 70 104.055 -4.458 -3.512 445 HG22 THR 70 HG22 THR 70 103.327 -5.850 -4.313 446 HG23 THR 70 HG23 THR 70 104.495 -6.091 -3.012 447 H SER 71 HN SER 71 99.287 -6.236 -2.671 448 HA SER 71 HA SER 71 97.451 -6.208 -1.275 449 HB2 SER 71 HB2 SER 71 97.207 -7.991 0.175 450 HB3 SER 71 HB1 SER 71 98.570 -8.586 -0.771 451 HG SER 71 HG SER 71 99.651 -7.104 1.045 452 H ARG 72 HN ARG 72 99.804 -4.378 -1.005 453 HA ARG 72 HA ARG 72 99.590 -3.561 1.820 454 HB2 ARG 72 HB2 ARG 72 101.557 -2.897 -0.375 455 HB3 ARG 72 HB1 ARG 72 101.517 -2.054 1.170 456 HG2 ARG 72 HG2 ARG 72 101.870 -4.172 2.356 457 HG3 ARG 72 HG1 ARG 72 101.870 -5.046 0.827 458 HD2 ARG 72 HD2 ARG 72 103.835 -3.763 0.089 459 HD3 ARG 72 HD1 ARG 72 103.827 -2.864 1.597 460 HE ARG 72 HE ARG 72 104.631 -5.664 1.238 461 HH11 ARG 72 HH11 ARG 72 105.755 -6.550 2.993 462 HH12 ARG 72 HH12 ARG 72 105.851 -5.676 4.486 463 HH21 ARG 72 HH21 ARG 72 103.979 -2.988 3.350 464 HH22 ARG 72 HH22 ARG 72 104.849 -3.662 4.685 465 H PHE 73 HN PHE 73 98.921 -1.513 2.379 466 HA PHE 73 HA PHE 73 97.316 -0.106 0.352 467 HB2 PHE 73 HB2 PHE 73 97.549 0.238 3.359 468 HB3 PHE 73 HB1 PHE 73 96.456 1.145 2.315 469 HD1 PHE 73 HD1 PHE 73 97.035 -2.006 4.055 470 HD2 PHE 73 HD2 PHE 73 94.671 -0.068 1.026 471 HE1 PHE 73 HE1 PHE 73 95.362 -3.831 4.184 472 HE2 PHE 73 HE2 PHE 73 92.999 -1.892 1.166 473 HZ PHE 73 HZ PHE 73 93.346 -3.774 2.744 474 H LEU 74 HN LEU 74 98.226 1.540 -0.719 475 HA LEU 74 HA LEU 74 100.724 2.677 0.099 476 HB2 LEU 74 HB2 LEU 74 100.282 2.529 -2.253 477 HB3 LEU 74 HB1 LEU 74 98.759 3.395 -2.084 478 HG LEU 74 HG LEU 74 99.902 5.449 -1.533 479 HD11 LEU 74 HD11 LEU 74 102.488 5.387 -1.618 480 HD12 LEU 74 HD12 LEU 74 102.322 3.653 -1.353 481 HD13 LEU 74 HD13 LEU 74 101.706 4.794 -0.157 482 HD21 LEU 74 HD21 LEU 74 101.431 4.126 -3.794 483 HD22 LEU 74 HD22 LEU 74 101.107 5.848 -3.596 484 HD23 LEU 74 HD23 LEU 74 99.787 4.736 -3.948 485 H CYS 75 HN CYS 75 100.916 4.052 1.723 486 HA CYS 75 HA CYS 75 98.876 6.163 2.066 487 HB2 CYS 75 HB2 CYS 75 100.266 4.751 4.337 488 HB3 CYS 75 HB1 CYS 75 98.940 5.911 4.437 489 H GLN 76 HN GLN 76 99.573 8.159 2.662 490 HA GLN 76 HA GLN 76 102.475 8.638 2.435 491 HB2 GLN 76 HB2 GLN 76 101.092 9.784 0.778 492 HB3 GLN 76 HB1 GLN 76 100.104 10.484 2.060 493 HG2 GLN 76 HG2 GLN 76 101.971 11.768 2.895 494 HG3 GLN 76 HG1 GLN 76 103.087 10.949 1.807 495 HE21 GLN 76 HE21 GLN 76 103.544 12.122 -0.052 496 HE22 GLN 76 HE22 GLN 76 102.514 13.273 -0.757 497 H ARG 77 HN ARG 77 103.597 9.581 4.059 498 HA ARG 77 HA ARG 77 102.241 9.912 6.618 499 HB2 ARG 77 HB2 ARG 77 104.974 10.580 6.958 500 HB3 ARG 77 HB1 ARG 77 104.213 9.043 7.355 501 HG2 ARG 77 HG2 ARG 77 104.680 8.206 5.113 502 HG3 ARG 77 HG1 ARG 77 105.352 9.769 4.652 503 HD2 ARG 77 HD2 ARG 77 107.131 8.147 5.262 504 HD3 ARG 77 HD1 ARG 77 107.112 9.546 6.334 505 HE ARG 77 HE ARG 77 105.515 7.738 7.613 506 HH11 ARG 77 HH11 ARG 77 106.301 6.216 9.099 507 HH12 ARG 77 HH12 ARG 77 107.947 5.684 8.998 508 HH21 ARG 77 HH21 ARG 77 108.700 7.666 6.257 509 HH22 ARG 77 HH22 ARG 77 109.305 6.507 7.393 510 HA PRO 78 HA PRO 78 102.036 14.319 6.878 511 HB2 PRO 78 HB2 PRO 78 104.097 14.350 9.062 512 HB3 PRO 78 HB1 PRO 78 102.468 15.059 9.042 513 HG2 PRO 78 HG2 PRO 78 102.944 12.842 10.401 514 HG3 PRO 78 HG1 PRO 78 101.439 13.029 9.478 515 HD2 PRO 78 HD2 PRO 78 103.882 11.424 8.792 516 HD3 PRO 78 HD1 PRO 78 102.168 11.038 8.534 517 H ASP 79 HN ASP 79 105.273 12.957 6.946 518 HA ASP 79 HA ASP 79 106.690 15.289 6.152 519 HB2 ASP 79 HB2 ASP 79 107.354 12.345 6.033 520 HB3 ASP 79 HB1 ASP 79 108.483 13.609 5.557 521 H GLY 80 HN GLY 80 104.538 13.316 4.483 522 HA2 GLY 80 HA2 GLY 80 103.812 13.589 2.281 523 HA3 GLY 80 HA1 GLY 80 105.233 14.573 1.953 524 H ALA 81 HN ALA 81 105.971 11.646 3.539 525 HA ALA 81 HA ALA 81 107.204 10.606 1.094 526 HB1 ALA 81 HB1 ALA 81 107.532 10.164 4.025 527 HB2 ALA 81 HB2 ALA 81 108.756 10.307 2.768 528 HB3 ALA 81 HB3 ALA 81 107.889 8.786 2.981 529 H LEU 82 HN LEU 82 106.705 8.671 0.133 530 HA LEU 82 HA LEU 82 104.043 7.560 0.758 531 HB2 LEU 82 HB2 LEU 82 105.827 7.613 -1.660 532 HB3 LEU 82 HB1 LEU 82 104.586 6.373 -1.538 533 HG LEU 82 HG LEU 82 102.841 8.038 -1.374 534 HD11 LEU 82 HD11 LEU 82 103.822 9.744 -0.040 535 HD12 LEU 82 HD12 LEU 82 103.543 10.497 -1.610 536 HD13 LEU 82 HD13 LEU 82 105.163 9.961 -1.165 537 HD21 LEU 82 HD21 LEU 82 104.886 8.612 -3.538 538 HD22 LEU 82 HD22 LEU 82 103.267 9.304 -3.540 539 HD23 LEU 82 HD23 LEU 82 103.478 7.557 -3.646 540 H TYR 83 HN TYR 83 103.753 5.477 1.427 541 HA TYR 83 HA TYR 83 105.873 3.511 1.145 542 HB2 TYR 83 HB2 TYR 83 106.218 3.094 3.481 543 HB3 TYR 83 HB1 TYR 83 106.473 4.820 3.218 544 HD1 TYR 83 HD1 TYR 83 104.569 2.331 4.985 545 HD2 TYR 83 HD2 TYR 83 104.506 6.412 3.657 546 HE1 TYR 83 HE1 TYR 83 102.765 2.825 6.609 547 HE2 TYR 83 HE2 TYR 83 102.703 6.914 5.292 548 HH TYR 83 HH TYR 83 100.855 4.637 6.738 549 H GLY 84 HN GLY 84 105.143 1.402 1.364 550 HA2 GLY 84 HA2 GLY 84 102.288 1.000 1.195 551 HA3 GLY 84 HA1 GLY 84 103.529 -0.251 1.131 552 H SER 85 HN SER 85 100.973 -0.048 2.737 553 HA SER 85 HA SER 85 102.182 -0.702 5.347 554 HB2 SER 85 HB2 SER 85 100.808 0.726 6.554 555 HB3 SER 85 HB1 SER 85 101.167 1.711 5.142 556 HG SER 85 HG SER 85 98.914 -0.000 5.383 557 H LEU 86 HN LEU 86 101.312 -2.419 6.322 558 HA LEU 86 HA LEU 86 99.530 -4.123 4.921 559 HB2 LEU 86 HB2 LEU 86 100.729 -4.133 7.681 560 HB3 LEU 86 HB1 LEU 86 99.487 -5.309 7.261 561 HG LEU 86 HG LEU 86 101.818 -6.149 6.893 562 HD11 LEU 86 HD11 LEU 86 100.698 -5.969 4.127 563 HD12 LEU 86 HD12 LEU 86 99.639 -6.645 5.363 564 HD13 LEU 86 HD13 LEU 86 101.209 -7.379 5.053 565 HD21 LEU 86 HD21 LEU 86 101.904 -4.116 4.653 566 HD22 LEU 86 HD22 LEU 86 103.198 -5.196 5.163 567 HD23 LEU 86 HD23 LEU 86 102.688 -3.873 6.212 568 H HIS 87 HN HIS 87 99.108 -1.855 7.588 569 HA HIS 87 HA HIS 87 96.267 -2.539 7.829 570 HB2 HIS 87 HB2 HIS 87 98.057 -0.676 9.401 571 HB3 HIS 87 HB1 HIS 87 96.339 -0.911 9.726 572 HD2 HIS 87 HD2 HIS 87 99.717 -2.879 10.120 573 HE1 HIS 87 HE1 HIS 87 96.652 -5.170 11.903 574 HE2 HIS 87 HE2 HIS 87 99.163 -4.975 11.575 575 H PHE 88 HN PHE 88 94.653 -0.887 7.859 576 HA PHE 88 HA PHE 88 95.054 1.094 5.729 577 HB2 PHE 88 HB2 PHE 88 93.192 -0.325 5.340 578 HB3 PHE 88 HB1 PHE 88 92.636 -0.183 7.004 579 HD1 PHE 88 HD1 PHE 88 93.643 2.322 4.373 580 HD2 PHE 88 HD2 PHE 88 90.609 0.973 7.103 581 HE1 PHE 88 HE1 PHE 88 92.196 4.219 3.712 582 HE2 PHE 88 HE2 PHE 88 89.170 2.875 6.439 583 HZ PHE 88 HZ PHE 88 89.962 4.498 4.742 584 H ASP 89 HN ASP 89 95.142 3.209 6.112 585 HA ASP 89 HA ASP 89 94.211 4.286 8.714 586 HB2 ASP 89 HB2 ASP 89 96.705 3.995 8.645 587 HB3 ASP 89 HB1 ASP 89 96.743 5.136 7.303 588 HA PRO 90 HA PRO 90 92.052 6.592 5.345 589 HB2 PRO 90 HB2 PRO 90 90.810 7.889 7.737 590 HB3 PRO 90 HB1 PRO 90 90.033 7.193 6.301 591 HG2 PRO 90 HG2 PRO 90 90.022 5.956 8.687 592 HG3 PRO 90 HG1 PRO 90 90.059 5.067 7.158 593 HD2 PRO 90 HD2 PRO 90 92.249 5.494 9.139 594 HD3 PRO 90 HD1 PRO 90 91.994 4.142 8.014 595 H GLU 91 HN GLU 91 93.309 7.988 8.339 596 HA GLU 91 HA GLU 91 93.467 10.660 7.505 597 HB2 GLU 91 HB2 GLU 91 95.042 9.131 9.572 598 HB3 GLU 91 HB1 GLU 91 95.163 10.877 9.353 599 HG2 GLU 91 HG2 GLU 91 92.761 11.123 9.766 600 HG3 GLU 91 HG1 GLU 91 92.590 9.376 9.912 601 H ALA 92 HN ALA 92 95.482 7.996 6.588 602 HA ALA 92 HA ALA 92 97.378 9.907 5.316 603 HB1 ALA 92 HB1 ALA 92 99.120 8.092 5.656 604 HB2 ALA 92 HB2 ALA 92 97.978 7.327 6.763 605 HB3 ALA 92 HB3 ALA 92 98.602 8.938 7.116 606 H CYS 93 HN CYS 93 95.455 7.038 5.045 607 HA CYS 93 HA CYS 93 96.654 6.289 2.485 608 HB2 CYS 93 HB2 CYS 93 94.385 4.947 3.935 609 HB3 CYS 93 HB1 CYS 93 95.391 4.275 2.654 610 H SER 94 HN SER 94 94.076 8.206 3.597 611 HA SER 94 HA SER 94 92.350 7.756 1.321 612 HB2 SER 94 HB2 SER 94 90.972 9.477 2.248 613 HB3 SER 94 HB1 SER 94 91.545 8.506 3.599 614 HG SER 94 HG SER 94 92.846 10.107 4.210 615 H PHE 95 HN PHE 95 92.141 9.059 -0.476 616 HA PHE 95 HA PHE 95 93.947 11.378 -0.749 617 HB2 PHE 95 HB2 PHE 95 93.734 9.141 -2.775 618 HB3 PHE 95 HB1 PHE 95 94.690 10.609 -2.937 619 HD1 PHE 95 HD1 PHE 95 94.501 7.287 -1.459 620 HD2 PHE 95 HD2 PHE 95 96.646 11.006 -1.430 621 HE1 PHE 95 HE1 PHE 95 96.402 6.177 -0.327 622 HE2 PHE 95 HE2 PHE 95 98.550 9.899 -0.291 623 HZ PHE 95 HZ PHE 95 98.435 7.485 0.254 624 H ARG 96 HN ARG 96 93.257 12.914 -2.234 625 HA ARG 96 HA ARG 96 90.439 12.696 -3.065 626 HB2 ARG 96 HB2 ARG 96 92.301 15.082 -2.951 627 HB3 ARG 96 HB1 ARG 96 90.639 15.132 -3.533 628 HG2 ARG 96 HG2 ARG 96 89.966 14.179 -1.251 629 HG3 ARG 96 HG1 ARG 96 91.613 14.548 -0.729 630 HD2 ARG 96 HD2 ARG 96 89.668 16.539 -1.925 631 HD3 ARG 96 HD1 ARG 96 90.051 16.408 -0.214 632 HE ARG 96 HE ARG 96 91.962 17.234 -2.332 633 HH11 ARG 96 HH11 ARG 96 93.595 18.609 -1.629 634 HH12 ARG 96 HH12 ARG 96 93.705 19.050 0.042 635 HH21 ARG 96 HH21 ARG 96 90.941 17.213 1.006 636 HH22 ARG 96 HH22 ARG 96 92.206 18.272 1.518 637 H GLU 97 HN GLU 97 89.872 12.646 -5.201 638 HA GLU 97 HA GLU 97 92.063 12.304 -7.127 639 HB2 GLU 97 HB2 GLU 97 90.125 10.703 -7.043 640 HB3 GLU 97 HB1 GLU 97 89.087 12.018 -7.598 641 HG2 GLU 97 HG2 GLU 97 90.454 12.277 -9.611 642 HG3 GLU 97 HG1 GLU 97 91.540 11.007 -9.059 643 H LEU 98 HN LEU 98 92.858 14.125 -7.937 644 HA LEU 98 HA LEU 98 91.089 16.422 -8.476 645 HB2 LEU 98 HB2 LEU 98 94.102 16.253 -8.701 646 HB3 LEU 98 HB1 LEU 98 93.114 17.712 -8.673 647 HG LEU 98 HG LEU 98 93.437 15.733 -6.400 648 HD11 LEU 98 HD11 LEU 98 94.623 17.541 -5.286 649 HD12 LEU 98 HD12 LEU 98 94.310 18.624 -6.641 650 HD13 LEU 98 HD13 LEU 98 95.383 17.241 -6.850 651 HD21 LEU 98 HD21 LEU 98 91.672 18.150 -6.793 652 HD22 LEU 98 HD22 LEU 98 92.196 17.677 -5.176 653 HD23 LEU 98 HD23 LEU 98 91.245 16.562 -6.154 654 H LEU 99 HN LEU 99 90.540 17.004 -10.512 655 HA LEU 99 HA LEU 99 91.914 15.654 -12.768 656 HB2 LEU 99 HB2 LEU 99 89.070 15.768 -12.060 657 HB3 LEU 99 HB1 LEU 99 89.351 16.334 -13.700 658 HG LEU 99 HG LEU 99 88.912 13.877 -13.560 659 HD11 LEU 99 HD11 LEU 99 91.766 14.121 -14.461 660 HD12 LEU 99 HD12 LEU 99 90.547 15.106 -15.267 661 HD13 LEU 99 HD13 LEU 99 90.396 13.351 -15.255 662 HD21 LEU 99 HD21 LEU 99 90.381 13.856 -11.303 663 HD22 LEU 99 HD22 LEU 99 91.640 13.387 -12.439 664 HD23 LEU 99 HD23 LEU 99 90.173 12.423 -12.305 665 H LEU 100 HN LEU 100 92.555 16.808 -14.429 666 HA LEU 100 HA LEU 100 92.188 19.745 -14.319 667 HB2 LEU 100 HB2 LEU 100 94.345 18.051 -15.609 668 HB3 LEU 100 HB1 LEU 100 94.256 19.808 -15.696 669 HG LEU 100 HG LEU 100 94.394 18.257 -13.092 670 HD11 LEU 100 HD11 LEU 100 96.463 17.846 -14.220 671 HD12 LEU 100 HD12 LEU 100 96.783 19.145 -13.074 672 HD13 LEU 100 HD13 LEU 100 96.565 19.512 -14.785 673 HD21 LEU 100 HD21 LEU 100 93.538 20.378 -12.563 674 HD22 LEU 100 HD22 LEU 100 94.440 21.179 -13.848 675 HD23 LEU 100 HD23 LEU 100 95.270 20.641 -12.390 676 H GLU 101 HN GLU 101 91.396 20.810 -16.088 677 HA GLU 101 HA GLU 101 89.696 19.509 -17.873 678 HB2 GLU 101 HB2 GLU 101 91.147 22.135 -18.296 679 HB3 GLU 101 HB1 GLU 101 89.692 21.603 -19.140 680 HG2 GLU 101 HG2 GLU 101 88.479 21.501 -17.009 681 HG3 GLU 101 HG1 GLU 101 89.934 22.008 -16.154 682 H ASP 102 HN ASP 102 93.094 19.899 -17.875 683 HA ASP 102 HA ASP 102 93.601 19.570 -20.653 684 HB2 ASP 102 HB2 ASP 102 95.290 19.142 -18.189 685 HB3 ASP 102 HB1 ASP 102 95.907 18.916 -19.823 686 H GLY 103 HN GLY 103 92.441 17.412 -18.300 687 HA2 GLY 103 HA2 GLY 103 91.703 15.225 -18.773 688 HA3 GLY 103 HA1 GLY 103 92.788 15.164 -20.154 689 H TYR 104 HN TYR 104 94.069 16.298 -17.130 690 HA TYR 104 HA TYR 104 95.521 13.724 -16.789 691 HB2 TYR 104 HB2 TYR 104 96.322 16.568 -16.161 692 HB3 TYR 104 HB1 TYR 104 97.200 15.164 -15.556 693 HD1 TYR 104 HD1 TYR 104 96.108 16.935 -18.626 694 HD2 TYR 104 HD2 TYR 104 98.657 13.897 -16.975 695 HE1 TYR 104 HE1 TYR 104 97.329 16.793 -20.780 696 HE2 TYR 104 HE2 TYR 104 99.881 13.757 -19.131 697 HH TYR 104 HH TYR 104 100.124 14.613 -21.163 698 H ASN 105 HN ASN 105 95.715 12.863 -14.700 699 HA ASN 105 HA ASN 105 93.879 14.034 -12.672 700 HB2 ASN 105 HB2 ASN 105 94.592 11.112 -12.946 701 HB3 ASN 105 HB1 ASN 105 93.326 11.829 -11.953 702 HD21 ASN 105 HD21 ASN 105 91.432 11.028 -12.897 703 HD22 ASN 105 HD22 ASN 105 91.043 11.197 -14.542 704 H VAL 106 HN VAL 106 94.600 14.238 -10.602 705 HA VAL 106 HA VAL 106 97.284 13.187 -9.934 706 HB VAL 106 HB VAL 106 96.395 15.937 -9.059 707 HG11 VAL 106 HG11 VAL 106 99.062 14.509 -9.331 708 HG12 VAL 106 HG12 VAL 106 98.280 15.040 -7.841 709 HG13 VAL 106 HG13 VAL 106 98.911 16.229 -8.980 710 HG21 VAL 106 HG21 VAL 106 96.303 16.087 -11.449 711 HG22 VAL 106 HG22 VAL 106 97.766 15.118 -11.631 712 HG23 VAL 106 HG23 VAL 106 97.867 16.753 -10.977 713 H TYR 107 HN TYR 107 97.650 12.990 -7.616 714 HA TYR 107 HA TYR 107 95.125 12.749 -6.062 715 HB2 TYR 107 HB2 TYR 107 97.546 10.939 -6.036 716 HB3 TYR 107 HB1 TYR 107 96.164 10.796 -4.951 717 HD1 TYR 107 HD1 TYR 107 97.346 10.441 -8.419 718 HD2 TYR 107 HD2 TYR 107 93.986 10.040 -5.769 719 HE1 TYR 107 HE1 TYR 107 96.130 9.156 -10.156 720 HE2 TYR 107 HE2 TYR 107 92.771 8.753 -7.509 721 HH TYR 107 HH TYR 107 93.503 8.753 -10.640 722 H GLN 108 HN GLN 108 95.122 13.366 -3.969 723 HA GLN 108 HA GLN 108 97.594 14.248 -2.660 724 HB2 GLN 108 HB2 GLN 108 96.820 16.258 -3.822 725 HB3 GLN 108 HB1 GLN 108 95.209 16.059 -3.138 726 HG2 GLN 108 HG2 GLN 108 96.063 16.411 -0.889 727 HG3 GLN 108 HG1 GLN 108 97.720 16.444 -1.484 728 HE21 GLN 108 HE21 GLN 108 95.516 18.533 -0.342 729 HE22 GLN 108 HE22 GLN 108 95.831 19.891 -1.311 730 H SER 109 HN SER 109 97.398 14.327 -0.373 731 HA SER 109 HA SER 109 95.459 12.536 0.713 732 HB2 SER 109 HB2 SER 109 96.415 13.323 2.923 733 HB3 SER 109 HB1 SER 109 97.591 12.654 1.797 734 HG SER 109 HG SER 109 97.004 15.409 1.808 735 H GLU 110 HN GLU 110 93.613 12.952 1.897 736 HA GLU 110 HA GLU 110 92.430 15.571 1.499 737 HB2 GLU 110 HB2 GLU 110 90.384 14.565 1.989 738 HB3 GLU 110 HB1 GLU 110 91.288 13.260 1.233 739 HG2 GLU 110 HG2 GLU 110 90.380 12.216 3.123 740 HG3 GLU 110 HG1 GLU 110 91.996 12.647 3.672 741 H ALA 111 HN ALA 111 93.564 13.595 4.191 742 HA ALA 111 HA ALA 111 92.621 15.386 6.212 743 HB1 ALA 111 HB1 ALA 111 94.565 13.083 6.272 744 HB2 ALA 111 HB2 ALA 111 92.884 13.096 6.808 745 HB3 ALA 111 HB3 ALA 111 94.103 14.000 7.706 746 H HIS 112 HN HIS 112 95.862 14.793 4.818 747 HA HIS 112 HA HIS 112 96.915 17.048 6.383 748 HB2 HIS 112 HB2 HIS 112 98.372 15.110 4.587 749 HB3 HIS 112 HB1 HIS 112 99.084 16.242 5.733 750 HD2 HIS 112 HD2 HIS 112 96.513 15.286 7.978 751 HE1 HIS 112 HE1 HIS 112 98.927 11.823 8.082 752 HE2 HIS 112 HE2 HIS 112 97.054 13.073 9.256 753 H GLY 113 HN GLY 113 95.887 16.377 3.139 754 HA2 GLY 113 HA2 GLY 113 95.778 17.795 1.307 755 HA3 GLY 113 HA1 GLY 113 96.334 19.090 2.359 756 H LEU 114 HN LEU 114 98.391 16.406 2.472 757 HA LEU 114 HA LEU 114 100.550 17.836 1.273 758 HB2 LEU 114 HB2 LEU 114 100.198 15.084 2.412 759 HB3 LEU 114 HB1 LEU 114 101.685 15.495 1.564 760 HG LEU 114 HG LEU 114 100.677 17.362 3.707 761 HD11 LEU 114 HD11 LEU 114 102.438 14.980 4.331 762 HD12 LEU 114 HD12 LEU 114 100.703 14.981 4.637 763 HD13 LEU 114 HD13 LEU 114 101.742 16.139 5.460 764 HD21 LEU 114 HD21 LEU 114 102.709 17.729 2.113 765 HD22 LEU 114 HD22 LEU 114 103.526 16.535 3.122 766 HD23 LEU 114 HD23 LEU 114 102.934 18.037 3.834 767 HA PRO 115 HA PRO 115 99.490 16.478 -2.964 768 HB2 PRO 115 HB2 PRO 115 102.322 17.222 -3.550 769 HB3 PRO 115 HB1 PRO 115 100.830 17.749 -4.353 770 HG2 PRO 115 HG2 PRO 115 102.232 19.353 -2.701 771 HG3 PRO 115 HG1 PRO 115 100.471 19.453 -2.866 772 HD2 PRO 115 HD2 PRO 115 102.086 18.343 -0.612 773 HD3 PRO 115 HD1 PRO 115 100.464 19.075 -0.599 774 H LEU 116 HN LEU 116 99.862 14.543 -4.067 775 HA LEU 116 HA LEU 116 101.563 12.616 -2.694 776 HB2 LEU 116 HB2 LEU 116 99.212 12.113 -3.503 777 HB3 LEU 116 HB1 LEU 116 99.840 12.166 -5.145 778 HG LEU 116 HG LEU 116 101.272 10.407 -3.163 779 HD11 LEU 116 HD11 LEU 116 98.888 9.902 -2.780 780 HD12 LEU 116 HD12 LEU 116 99.727 8.558 -3.552 781 HD13 LEU 116 HD13 LEU 116 98.681 9.608 -4.506 782 HD21 LEU 116 HD21 LEU 116 102.197 10.491 -5.395 783 HD22 LEU 116 HD22 LEU 116 100.612 10.231 -6.122 784 HD23 LEU 116 HD23 LEU 116 101.393 8.936 -5.221 785 H HIS 117 HN HIS 117 103.553 12.108 -3.307 786 HA HIS 117 HA HIS 117 104.360 12.256 -6.108 787 HB2 HIS 117 HB2 HIS 117 106.320 13.691 -5.581 788 HB3 HIS 117 HB1 HIS 117 104.787 14.537 -5.360 789 HD2 HIS 117 HD2 HIS 117 107.798 13.292 -3.212 790 HE1 HIS 117 HE1 HIS 117 105.028 15.089 -0.585 791 HE2 HIS 117 HE2 HIS 117 107.364 14.112 -0.773 792 H LEU 118 HN LEU 118 106.327 11.170 -6.532 793 HA LEU 118 HA LEU 118 106.769 8.839 -5.048 794 HB2 LEU 118 HB2 LEU 118 108.612 10.235 -7.001 795 HB3 LEU 118 HB1 LEU 118 108.735 8.548 -6.513 796 HG LEU 118 HG LEU 118 106.317 9.782 -7.867 797 HD11 LEU 118 HD11 LEU 118 108.174 9.706 -9.424 798 HD12 LEU 118 HD12 LEU 118 107.060 8.396 -9.817 799 HD13 LEU 118 HD13 LEU 118 108.557 8.053 -8.945 800 HD21 LEU 118 HD21 LEU 118 105.927 7.193 -8.243 801 HD22 LEU 118 HD22 LEU 118 105.469 7.927 -6.711 802 HD23 LEU 118 HD23 LEU 118 106.981 7.026 -6.838 803 HA PRO 119 HA PRO 119 109.399 10.278 -1.788 804 HB2 PRO 119 HB2 PRO 119 110.813 8.036 -1.162 805 HB3 PRO 119 HB1 PRO 119 109.077 8.196 -0.818 806 HG2 PRO 119 HG2 PRO 119 110.429 6.812 -3.099 807 HG3 PRO 119 HG1 PRO 119 109.074 6.262 -2.094 808 HD2 PRO 119 HD2 PRO 119 108.700 7.346 -4.567 809 HD3 PRO 119 HD1 PRO 119 107.513 7.536 -3.262 810 H GLY 120 HN GLY 120 111.519 10.928 -1.276 811 HA2 GLY 120 HA2 GLY 120 113.815 11.232 -1.616 812 HA3 GLY 120 HA1 GLY 120 113.702 10.337 -3.128 813 H ASN 121 HN ASN 121 111.238 12.614 -2.822 814 HA ASN 121 HA ASN 121 110.751 14.429 -4.176 815 HB2 ASN 121 HB2 ASN 121 113.376 15.330 -2.965 816 HB3 ASN 121 HB1 ASN 121 112.110 16.377 -3.606 817 HD21 ASN 121 HD21 ASN 121 110.717 13.661 -2.111 818 HD22 ASN 121 HD22 ASN 121 110.374 14.363 -0.605 819 H LYS 122 HN LYS 122 113.668 15.838 -4.754 820 HA LYS 122 HA LYS 122 113.584 15.422 -7.550 821 HB2 LYS 122 HB2 LYS 122 114.568 17.414 -6.466 822 HB3 LYS 122 HB1 LYS 122 115.871 16.410 -5.838 823 HG2 LYS 122 HG2 LYS 122 116.633 15.880 -8.083 824 HG3 LYS 122 HG1 LYS 122 115.231 16.680 -8.791 825 HD2 LYS 122 HD2 LYS 122 116.900 18.312 -9.015 826 HD3 LYS 122 HD1 LYS 122 116.101 18.802 -7.525 827 HE2 LYS 122 HE2 LYS 122 118.379 18.887 -6.958 828 HE3 LYS 122 HE1 LYS 122 117.895 17.310 -6.351 829 HZ1 LYS 122 HZ1 LYS 122 119.289 16.322 -7.734 830 HZ2 LYS 122 HZ2 LYS 122 119.897 17.850 -8.160 831 HZ3 LYS 122 HZ3 LYS 122 118.651 17.143 -9.074 832 H SER 123 HN SER 123 115.770 14.143 -5.039 833 HA SER 123 HA SER 123 116.008 11.576 -5.874 834 HB2 SER 123 HB2 SER 123 117.430 13.353 -7.749 835 HB3 SER 123 HB1 SER 123 118.398 12.004 -7.162 836 HG SER 123 HG SER 123 117.316 10.974 -8.654 837 HA PRO 124 HA PRO 124 120.080 12.456 -3.515 838 HB2 PRO 124 HB2 PRO 124 120.937 15.021 -3.183 839 HB3 PRO 124 HB1 PRO 124 121.316 14.077 -4.640 840 HG2 PRO 124 HG2 PRO 124 119.131 16.083 -4.219 841 HG3 PRO 124 HG1 PRO 124 120.288 15.955 -5.560 842 HD2 PRO 124 HD2 PRO 124 117.781 14.985 -5.795 843 HD3 PRO 124 HD1 PRO 124 119.170 14.150 -6.532 844 H HIS 125 HN HIS 125 120.455 12.926 -1.245 845 HA HIS 125 HA HIS 125 118.054 13.296 0.243 846 HB2 HIS 125 HB2 HIS 125 119.591 13.271 2.226 847 HB3 HIS 125 HB1 HIS 125 119.788 11.889 1.150 848 HD2 HIS 125 HD2 HIS 125 122.330 11.635 0.046 849 HE1 HIS 125 HE1 HIS 125 123.885 15.321 1.388 850 HE2 HIS 125 HE2 HIS 125 124.461 13.127 0.248 851 H ARG 126 HN ARG 126 117.101 15.119 0.820 852 HA ARG 126 HA ARG 126 118.642 17.485 1.522 853 HB2 ARG 126 HB2 ARG 126 118.287 17.557 -0.992 854 HB3 ARG 126 HB1 ARG 126 116.559 17.690 -0.658 855 HG2 ARG 126 HG2 ARG 126 116.939 19.726 0.651 856 HG3 ARG 126 HG1 ARG 126 118.680 19.579 0.405 857 HD2 ARG 126 HD2 ARG 126 118.375 19.820 -2.020 858 HD3 ARG 126 HD1 ARG 126 116.630 19.911 -1.803 859 HE ARG 126 HE ARG 126 116.870 22.101 -1.005 860 HH11 ARG 126 HH11 ARG 126 118.079 24.000 -0.744 861 HH12 ARG 126 HH12 ARG 126 119.808 23.942 -0.844 862 HH21 ARG 126 HH21 ARG 126 119.927 20.524 -1.416 863 HH22 ARG 126 HH22 ARG 126 120.852 21.974 -1.218 864 H ASP 127 HN ASP 127 117.449 18.974 2.764 865 HA ASP 127 HA ASP 127 115.594 18.032 4.521 866 HB2 ASP 127 HB2 ASP 127 114.853 20.516 4.687 867 HB3 ASP 127 HB1 ASP 127 116.533 20.122 5.034 868 HA PRO 128 HA PRO 128 111.700 17.493 2.469 869 HB2 PRO 128 HB2 PRO 128 110.368 19.353 4.401 870 HB3 PRO 128 HB1 PRO 128 109.965 17.672 3.994 871 HG2 PRO 128 HG2 PRO 128 111.148 18.293 6.300 872 HG3 PRO 128 HG1 PRO 128 111.555 16.806 5.424 873 HD2 PRO 128 HD2 PRO 128 113.121 19.351 5.645 874 HD3 PRO 128 HD1 PRO 128 113.694 17.671 5.561 875 H ALA 129 HN ALA 129 110.665 18.420 0.757 876 HA ALA 129 HA ALA 129 110.001 21.163 0.516 877 HB1 ALA 129 HB1 ALA 129 111.637 21.854 -1.169 878 HB2 ALA 129 HB2 ALA 129 112.457 20.300 -1.030 879 HB3 ALA 129 HB3 ALA 129 112.457 21.421 0.330 880 HA PRO 130 HA PRO 130 108.314 18.088 -2.585 881 HB2 PRO 130 HB2 PRO 130 105.755 17.939 -1.664 882 HB3 PRO 130 HB1 PRO 130 107.062 16.934 -1.006 883 HG2 PRO 130 HG2 PRO 130 105.857 19.431 0.104 884 HG3 PRO 130 HG1 PRO 130 106.353 17.951 0.944 885 HD2 PRO 130 HD2 PRO 130 107.890 20.248 0.870 886 HD3 PRO 130 HD1 PRO 130 108.569 18.618 1.083 887 H ARG 131 HN ARG 131 108.265 19.400 -4.349 888 HA ARG 131 HA ARG 131 105.973 21.226 -4.646 889 HB2 ARG 131 HB2 ARG 131 108.870 21.969 -5.097 890 HB3 ARG 131 HB1 ARG 131 107.516 22.892 -5.752 891 HG2 ARG 131 HG2 ARG 131 106.628 23.226 -3.482 892 HG3 ARG 131 HG1 ARG 131 107.960 22.285 -2.814 893 HD2 ARG 131 HD2 ARG 131 109.573 23.927 -3.700 894 HD3 ARG 131 HD1 ARG 131 108.245 24.865 -4.378 895 HE ARG 131 HE ARG 131 107.723 25.624 -2.228 896 HH11 ARG 131 HH11 ARG 131 108.206 25.876 -0.020 897 HH12 ARG 131 HH12 ARG 131 109.383 24.848 0.726 898 HH21 ARG 131 HH21 ARG 131 110.067 23.079 -2.175 899 HH22 ARG 131 HH22 ARG 131 110.440 23.267 -0.494 900 H GLY 132 HN GLY 132 105.305 21.535 -6.786 901 HA2 GLY 132 HA2 GLY 132 105.059 21.045 -9.030 902 HA3 GLY 132 HA1 GLY 132 106.707 20.422 -9.021 903 HA PRO 133 HA PRO 133 103.743 16.852 -7.451 904 HB2 PRO 133 HB2 PRO 133 101.225 17.685 -8.803 905 HB3 PRO 133 HB1 PRO 133 101.464 17.035 -7.171 906 HG2 PRO 133 HG2 PRO 133 100.879 19.630 -7.625 907 HG3 PRO 133 HG1 PRO 133 101.885 19.101 -6.264 908 HD2 PRO 133 HD2 PRO 133 102.717 20.413 -8.824 909 HD3 PRO 133 HD1 PRO 133 103.434 20.542 -7.202 910 H ALA 134 HN ALA 134 103.537 14.973 -8.620 911 HA ALA 134 HA ALA 134 104.222 15.118 -11.453 912 HB1 ALA 134 HB1 ALA 134 105.399 13.551 -9.927 913 HB2 ALA 134 HB2 ALA 134 104.597 12.721 -11.260 914 HB3 ALA 134 HB3 ALA 134 103.873 12.711 -9.652 915 H ARG 135 HN ARG 135 102.786 14.931 -13.045 916 HA ARG 135 HA ARG 135 99.993 14.510 -12.509 917 HB2 ARG 135 HB2 ARG 135 101.579 14.706 -15.083 918 HB3 ARG 135 HB1 ARG 135 99.819 14.591 -15.016 919 HG2 ARG 135 HG2 ARG 135 99.706 16.649 -13.698 920 HG3 ARG 135 HG1 ARG 135 101.467 16.753 -13.670 921 HD2 ARG 135 HD2 ARG 135 101.468 16.894 -16.154 922 HD3 ARG 135 HD1 ARG 135 99.711 16.866 -16.136 923 HE ARG 135 HE ARG 135 99.703 19.047 -15.183 924 HH11 ARG 135 HH11 ARG 135 100.700 21.082 -15.110 925 HH12 ARG 135 HH12 ARG 135 102.412 21.214 -15.335 926 HH21 ARG 135 HH21 ARG 135 102.900 17.816 -15.765 927 HH22 ARG 135 HH22 ARG 135 103.650 19.374 -15.708 928 H PHE 136 HN PHE 136 98.872 12.645 -12.585 929 HA PHE 136 HA PHE 136 100.253 10.219 -13.610 930 HB2 PHE 136 HB2 PHE 136 98.781 10.761 -11.073 931 HB3 PHE 136 HB1 PHE 136 98.468 9.198 -11.825 932 HD1 PHE 136 HD1 PHE 136 100.860 11.196 -9.950 933 HD2 PHE 136 HD2 PHE 136 100.400 7.686 -12.379 934 HE1 PHE 136 HE1 PHE 136 103.013 10.299 -9.076 935 HE2 PHE 136 HE2 PHE 136 102.533 6.793 -11.502 936 HZ PHE 136 HZ PHE 136 103.840 8.097 -9.855 937 H LEU 137 HN LEU 137 99.038 8.704 -14.671 938 HA LEU 137 HA LEU 137 96.305 9.438 -15.521 939 HB2 LEU 137 HB2 LEU 137 98.543 8.401 -17.272 940 HB3 LEU 137 HB1 LEU 137 96.885 8.685 -17.791 941 HG LEU 137 HG LEU 137 98.576 10.878 -16.569 942 HD11 LEU 137 HD11 LEU 137 98.287 10.157 -19.502 943 HD12 LEU 137 HD12 LEU 137 99.759 9.998 -18.543 944 HD13 LEU 137 HD13 LEU 137 99.093 11.594 -18.876 945 HD21 LEU 137 HD21 LEU 137 96.263 11.471 -16.625 946 HD22 LEU 137 HD22 LEU 137 96.041 10.769 -18.226 947 HD23 LEU 137 HD23 LEU 137 96.971 12.251 -18.035 948 HA PRO 138 HA PRO 138 96.234 5.114 -13.912 949 HB2 PRO 138 HB2 PRO 138 93.296 5.511 -14.226 950 HB3 PRO 138 HB1 PRO 138 94.210 4.953 -12.811 951 HG2 PRO 138 HG2 PRO 138 93.121 7.411 -12.941 952 HG3 PRO 138 HG1 PRO 138 94.632 7.085 -12.074 953 HD2 PRO 138 HD2 PRO 138 94.231 8.424 -14.723 954 HD3 PRO 138 HD1 PRO 138 95.475 8.711 -13.485 955 H LEU 139 HN LEU 139 96.156 3.226 -15.134 956 HA LEU 139 HA LEU 139 94.990 3.416 -17.855 957 HB2 LEU 139 HB2 LEU 139 97.035 1.324 -17.202 958 HB3 LEU 139 HB1 LEU 139 96.717 2.141 -18.723 959 HG LEU 139 HG LEU 139 97.957 3.507 -16.314 960 HD11 LEU 139 HD11 LEU 139 99.174 2.124 -18.709 961 HD12 LEU 139 HD12 LEU 139 99.555 1.893 -17.003 962 HD13 LEU 139 HD13 LEU 139 100.036 3.379 -17.820 963 HD21 LEU 139 HD21 LEU 139 97.605 4.255 -19.228 964 HD22 LEU 139 HD22 LEU 139 98.581 5.172 -18.082 965 HD23 LEU 139 HD23 LEU 139 96.840 5.032 -17.844 966 HA PRO 140 HA PRO 140 92.014 0.331 -16.490 967 HB2 PRO 140 HB2 PRO 140 92.451 -0.878 -19.201 968 HB3 PRO 140 HB1 PRO 140 90.928 -0.473 -18.382 969 HG2 PRO 140 HG2 PRO 140 91.923 1.048 -20.353 970 HG3 PRO 140 HG1 PRO 140 91.040 1.743 -18.983 971 HD2 PRO 140 HD2 PRO 140 93.963 1.845 -19.571 972 HD3 PRO 140 HD1 PRO 140 92.950 2.970 -18.639 973 H GLY 141 HN GLY 141 92.395 -1.433 -15.277 974 HA2 GLY 141 HA2 GLY 141 94.863 -2.678 -15.027 975 HA3 GLY 141 HA1 GLY 141 93.342 -3.368 -14.470 Start of MODEL 9 1 H1 GLY 13 HT1 GLY 13 81.906 1.536 -12.280 2 H2 GLY 13 HT2 GLY 13 82.108 2.791 -11.153 3 H3 GLY 13 HT3 GLY 13 80.591 2.053 -11.342 4 HA2 GLY 13 HA2 GLY 13 81.081 0.365 -9.992 5 HA3 GLY 13 HA1 GLY 13 82.692 0.197 -10.692 6 H GLN 14 HN GLN 14 81.605 0.389 -7.841 7 HA GLN 14 HA GLN 14 82.538 2.811 -6.691 8 HB2 GLN 14 HB2 GLN 14 82.285 0.075 -5.409 9 HB3 GLN 14 HB1 GLN 14 82.409 1.617 -4.560 10 HG2 GLN 14 HG2 GLN 14 80.197 0.893 -6.498 11 HG3 GLN 14 HG1 GLN 14 80.054 0.818 -4.744 12 HE21 GLN 14 HE21 GLN 14 79.205 2.744 -7.257 13 HE22 GLN 14 HE22 GLN 14 79.260 4.265 -6.505 14 H VAL 15 HN VAL 15 84.018 -0.284 -7.413 15 HA VAL 15 HA VAL 15 86.693 0.852 -6.823 16 HB VAL 15 HB VAL 15 86.283 -0.640 -5.023 17 HG11 VAL 15 HG11 VAL 15 85.222 -2.524 -7.139 18 HG12 VAL 15 HG12 VAL 15 84.333 -1.817 -5.789 19 HG13 VAL 15 HG13 VAL 15 85.576 -3.031 -5.488 20 HG21 VAL 15 HG21 VAL 15 87.720 -2.395 -7.019 21 HG22 VAL 15 HG22 VAL 15 88.033 -2.224 -5.292 22 HG23 VAL 15 HG23 VAL 15 88.452 -0.915 -6.398 23 H ARG 16 HN ARG 16 88.246 0.414 -8.286 24 HA ARG 16 HA ARG 16 87.651 -1.435 -10.522 25 HB2 ARG 16 HB2 ARG 16 88.369 1.491 -10.783 26 HB3 ARG 16 HB1 ARG 16 88.454 0.339 -12.117 27 HG2 ARG 16 HG2 ARG 16 86.052 -0.174 -11.824 28 HG3 ARG 16 HG1 ARG 16 85.971 0.986 -10.497 29 HD2 ARG 16 HD2 ARG 16 86.637 2.796 -12.026 30 HD3 ARG 16 HD1 ARG 16 86.739 1.645 -13.353 31 HE ARG 16 HE ARG 16 84.168 1.410 -12.319 32 HH11 ARG 16 HH11 ARG 16 82.440 2.555 -13.256 33 HH12 ARG 16 HH12 ARG 16 82.758 3.981 -14.186 34 HH21 ARG 16 HH21 ARG 16 86.187 3.858 -13.696 35 HH22 ARG 16 HH22 ARG 16 84.877 4.726 -14.425 36 H GLN 17 HN GLN 17 89.488 -2.168 -11.671 37 HA GLN 17 HA GLN 17 92.006 -1.950 -10.147 38 HB2 GLN 17 HB2 GLN 17 92.473 -3.894 -12.025 39 HB3 GLN 17 HB1 GLN 17 91.829 -4.218 -10.419 40 HG2 GLN 17 HG2 GLN 17 89.564 -4.131 -11.271 41 HG3 GLN 17 HG1 GLN 17 90.146 -3.661 -12.866 42 HE21 GLN 17 HE21 GLN 17 92.480 -5.526 -12.774 43 HE22 GLN 17 HE22 GLN 17 91.835 -7.084 -12.961 44 H ARG 18 HN ARG 18 93.501 -0.575 -10.851 45 HA ARG 18 HA ARG 18 93.958 -0.266 -13.739 46 HB2 ARG 18 HB2 ARG 18 93.412 2.064 -11.884 47 HB3 ARG 18 HB1 ARG 18 93.940 2.190 -13.562 48 HG2 ARG 18 HG2 ARG 18 91.887 0.922 -14.237 49 HG3 ARG 18 HG1 ARG 18 91.345 0.990 -12.565 50 HD2 ARG 18 HD2 ARG 18 91.407 3.456 -12.644 51 HD3 ARG 18 HD1 ARG 18 91.923 3.384 -14.327 52 HE ARG 18 HE ARG 18 89.586 1.895 -14.181 53 HH11 ARG 18 HH11 ARG 18 87.572 2.827 -14.668 54 HH12 ARG 18 HH12 ARG 18 87.367 4.542 -14.552 55 HH21 ARG 18 HH21 ARG 18 90.630 5.129 -13.534 56 HH22 ARG 18 HH22 ARG 18 89.100 5.848 -13.917 57 H TYR 19 HN TYR 19 95.988 0.740 -14.249 58 HA TYR 19 HA TYR 19 98.054 0.306 -12.172 59 HB2 TYR 19 HB2 TYR 19 98.169 0.673 -15.176 60 HB3 TYR 19 HB1 TYR 19 99.607 0.644 -14.164 61 HD1 TYR 19 HD1 TYR 19 96.607 -1.338 -15.146 62 HD2 TYR 19 HD2 TYR 19 100.539 -1.407 -13.419 63 HE1 TYR 19 HE1 TYR 19 96.592 -3.816 -15.207 64 HE2 TYR 19 HE2 TYR 19 100.521 -3.886 -13.474 65 HH TYR 19 HH TYR 19 97.948 -5.665 -15.081 66 H LEU 20 HN LEU 20 99.182 2.030 -11.307 67 HA LEU 20 HA LEU 20 98.410 4.726 -12.222 68 HB2 LEU 20 HB2 LEU 20 98.606 3.680 -9.698 69 HB3 LEU 20 HB1 LEU 20 100.201 4.394 -9.858 70 HG LEU 20 HG LEU 20 98.977 6.525 -10.660 71 HD11 LEU 20 HD11 LEU 20 96.758 5.882 -11.080 72 HD12 LEU 20 HD12 LEU 20 96.633 6.618 -9.485 73 HD13 LEU 20 HD13 LEU 20 96.672 4.865 -9.643 74 HD21 LEU 20 HD21 LEU 20 98.596 7.251 -8.331 75 HD22 LEU 20 HD22 LEU 20 100.072 6.297 -8.458 76 HD23 LEU 20 HD23 LEU 20 98.607 5.568 -7.804 77 H TYR 21 HN TYR 21 99.712 5.706 -13.653 78 HA TYR 21 HA TYR 21 102.636 5.220 -13.519 79 HB2 TYR 21 HB2 TYR 21 102.407 4.038 -15.455 80 HB3 TYR 21 HB1 TYR 21 100.747 4.572 -15.665 81 HD1 TYR 21 HD1 TYR 21 104.296 5.409 -16.352 82 HD2 TYR 21 HD2 TYR 21 100.189 6.439 -17.067 83 HE1 TYR 21 HE1 TYR 21 104.994 6.919 -18.195 84 HE2 TYR 21 HE2 TYR 21 100.884 7.943 -18.910 85 HH TYR 21 HH TYR 21 103.546 7.830 -20.470 86 H THR 22 HN THR 22 103.953 6.939 -14.080 87 HA THR 22 HA THR 22 102.686 9.514 -14.758 88 HB THR 22 HB THR 22 102.906 9.705 -12.390 89 HG1 THR 22 HG1 THR 22 103.791 11.564 -12.738 90 HG21 THR 22 HG21 THR 22 105.745 8.745 -12.747 91 HG22 THR 22 HG22 THR 22 104.424 7.758 -12.137 92 HG23 THR 22 HG23 THR 22 104.969 9.163 -11.223 93 H SER 23 HN SER 23 104.185 11.101 -15.551 94 HA SER 23 HA SER 23 106.586 9.904 -16.828 95 HB2 SER 23 HB2 SER 23 104.743 12.094 -17.803 96 HB3 SER 23 HB1 SER 23 106.235 11.607 -18.601 97 HG SER 23 HG SER 23 105.008 9.389 -18.229 98 H GLY 24 HN GLY 24 108.465 10.717 -16.158 99 HA2 GLY 24 HA2 GLY 24 108.489 13.307 -14.734 100 HA3 GLY 24 HA1 GLY 24 109.723 12.056 -14.611 101 HA PRO 25 HA PRO 25 110.660 15.377 -17.941 102 HB2 PRO 25 HB2 PRO 25 112.549 16.840 -16.562 103 HB3 PRO 25 HB1 PRO 25 110.820 17.240 -16.582 104 HG2 PRO 25 HG2 PRO 25 112.400 15.787 -14.503 105 HG3 PRO 25 HG1 PRO 25 111.136 17.015 -14.302 106 HD2 PRO 25 HD2 PRO 25 110.634 14.360 -13.972 107 HD3 PRO 25 HD1 PRO 25 109.409 15.483 -14.607 108 H HIS 26 HN HIS 26 112.359 15.107 -19.348 109 HA HIS 26 HA HIS 26 114.040 13.829 -20.323 110 HB2 HIS 26 HB2 HIS 26 115.339 15.006 -17.860 111 HB3 HIS 26 HB1 HIS 26 116.240 14.232 -19.164 112 HD2 HIS 26 HD2 HIS 26 116.343 15.719 -21.590 113 HE1 HIS 26 HE1 HIS 26 114.422 19.158 -20.069 114 HE2 HIS 26 HE2 HIS 26 115.727 18.218 -22.034 115 H GLY 27 HN GLY 27 112.308 12.295 -18.525 116 HA2 GLY 27 HA2 GLY 27 113.845 10.566 -16.875 117 HA3 GLY 27 HA1 GLY 27 112.215 10.258 -17.458 118 H LEU 28 HN LEU 28 114.293 8.330 -17.195 119 HA LEU 28 HA LEU 28 115.595 7.709 -19.632 120 HB2 LEU 28 HB2 LEU 28 114.655 5.914 -17.376 121 HB3 LEU 28 HB1 LEU 28 115.679 5.385 -18.703 122 HG LEU 28 HG LEU 28 117.315 7.215 -18.039 123 HD11 LEU 28 HD11 LEU 28 116.093 8.704 -16.685 124 HD12 LEU 28 HD12 LEU 28 117.032 7.797 -15.507 125 HD13 LEU 28 HD13 LEU 28 115.333 7.404 -15.766 126 HD21 LEU 28 HD21 LEU 28 118.087 5.877 -15.992 127 HD22 LEU 28 HD22 LEU 28 117.849 4.955 -17.476 128 HD23 LEU 28 HD23 LEU 28 116.629 4.906 -16.203 129 H SER 29 HN SER 29 112.512 6.769 -18.224 130 HA SER 29 HA SER 29 111.259 6.392 -20.771 131 HB2 SER 29 HB2 SER 29 112.533 4.296 -20.653 132 HB3 SER 29 HB1 SER 29 111.840 3.952 -19.072 133 HG SER 29 HG SER 29 110.538 2.905 -20.469 134 H SER 30 HN SER 30 109.109 4.841 -20.044 135 HA SER 30 HA SER 30 107.624 6.630 -18.427 136 HB2 SER 30 HB2 SER 30 107.072 3.911 -19.569 137 HB3 SER 30 HB1 SER 30 105.929 4.659 -18.455 138 HG SER 30 HG SER 30 105.428 5.226 -20.579 139 H CYS 31 HN CYS 31 106.834 6.440 -16.340 140 HA CYS 31 HA CYS 31 108.275 4.494 -14.627 141 HB2 CYS 31 HB2 CYS 31 107.807 7.385 -14.395 142 HB3 CYS 31 HB1 CYS 31 107.348 6.516 -12.936 143 H HIS 32 HN HIS 32 107.078 2.945 -13.853 144 HA HIS 32 HA HIS 32 104.162 3.343 -13.507 145 HB2 HIS 32 HB2 HIS 32 105.742 0.774 -13.801 146 HB3 HIS 32 HB1 HIS 32 103.992 0.903 -13.641 147 HD2 HIS 32 HD2 HIS 32 102.667 1.348 -16.032 148 HE1 HIS 32 HE1 HIS 32 106.050 2.142 -18.421 149 HE2 HIS 32 HE2 HIS 32 103.534 1.808 -18.450 150 H LEU 33 HN LEU 33 103.589 3.686 -11.476 151 HA LEU 33 HA LEU 33 105.245 3.373 -9.229 152 HB2 LEU 33 HB2 LEU 33 102.963 4.668 -9.594 153 HB3 LEU 33 HB1 LEU 33 102.250 3.193 -8.964 154 HG LEU 33 HG LEU 33 104.310 4.950 -7.594 155 HD11 LEU 33 HD11 LEU 33 101.392 4.332 -7.098 156 HD12 LEU 33 HD12 LEU 33 102.123 5.904 -7.424 157 HD13 LEU 33 HD13 LEU 33 102.427 5.092 -5.889 158 HD21 LEU 33 HD21 LEU 33 104.912 2.795 -6.903 159 HD22 LEU 33 HD22 LEU 33 103.244 2.212 -6.923 160 HD23 LEU 33 HD23 LEU 33 103.784 3.307 -5.651 161 H GLU 34 HN GLU 34 105.846 1.618 -8.137 162 HA GLU 34 HA GLU 34 104.129 -0.788 -8.175 163 HB2 GLU 34 HB2 GLU 34 106.259 -2.144 -8.277 164 HB3 GLU 34 HB1 GLU 34 105.836 -1.303 -9.766 165 HG2 GLU 34 HG2 GLU 34 107.447 0.418 -9.358 166 HG3 GLU 34 HG1 GLU 34 107.721 -0.139 -7.709 167 H ILE 35 HN ILE 35 104.006 -1.885 -6.291 168 HA ILE 35 HA ILE 35 105.409 -0.698 -3.959 169 HB ILE 35 HB ILE 35 102.911 -2.418 -4.019 170 HG12 ILE 35 HG12 ILE 35 103.233 0.563 -3.529 171 HG13 ILE 35 HG11 ILE 35 102.625 -0.147 -5.026 172 HG21 ILE 35 HG21 ILE 35 104.251 -0.844 -1.792 173 HG22 ILE 35 HG22 ILE 35 104.223 -2.602 -1.926 174 HG23 ILE 35 HG23 ILE 35 102.727 -1.718 -1.649 175 HD11 ILE 35 HD11 ILE 35 100.716 0.477 -3.677 176 HD12 ILE 35 HD12 ILE 35 101.379 -0.361 -2.273 177 HD13 ILE 35 HD13 ILE 35 100.831 -1.284 -3.673 178 H ARG 36 HN ARG 36 106.869 -1.858 -2.904 179 HA ARG 36 HA ARG 36 107.534 -4.527 -3.808 180 HB2 ARG 36 HB2 ARG 36 108.714 -2.538 -1.904 181 HB3 ARG 36 HB1 ARG 36 109.209 -4.219 -1.764 182 HG2 ARG 36 HG2 ARG 36 110.783 -3.142 -3.218 183 HG3 ARG 36 HG1 ARG 36 109.770 -4.160 -4.238 184 HD2 ARG 36 HD2 ARG 36 108.410 -2.222 -4.862 185 HD3 ARG 36 HD1 ARG 36 109.346 -1.192 -3.782 186 HE ARG 36 HE ARG 36 110.144 -2.126 -6.403 187 HH11 ARG 36 HH11 ARG 36 112.149 -1.382 -7.145 188 HH12 ARG 36 HH12 ARG 36 113.256 -0.633 -6.042 189 HH21 ARG 36 HH21 ARG 36 111.153 -0.968 -3.300 190 HH22 ARG 36 HH22 ARG 36 112.687 -0.394 -3.860 191 H GLU 37 HN GLU 37 107.722 -6.334 -2.380 192 HA GLU 37 HA GLU 37 105.399 -6.737 -0.768 193 HB2 GLU 37 HB2 GLU 37 107.892 -8.446 -0.940 194 HB3 GLU 37 HB1 GLU 37 106.295 -8.951 -0.383 195 HG2 GLU 37 HG2 GLU 37 105.361 -8.464 -2.612 196 HG3 GLU 37 HG1 GLU 37 106.958 -7.969 -3.167 197 H ASP 38 HN ASP 38 108.604 -5.632 -0.270 198 HA ASP 38 HA ASP 38 108.696 -6.126 2.564 199 HB2 ASP 38 HB2 ASP 38 110.384 -4.371 0.768 200 HB3 ASP 38 HB1 ASP 38 110.727 -4.703 2.463 201 H GLY 39 HN GLY 39 107.039 -3.945 0.637 202 HA2 GLY 39 HA2 GLY 39 105.510 -2.351 1.510 203 HA3 GLY 39 HA1 GLY 39 106.497 -2.209 2.957 204 H THR 40 HN THR 40 108.380 -2.172 0.121 205 HA THR 40 HA THR 40 108.886 0.692 0.473 206 HB THR 40 HB THR 40 110.283 -0.884 -1.651 207 HG1 THR 40 HG1 THR 40 111.697 -1.435 0.322 208 HG21 THR 40 HG21 THR 40 112.212 0.401 -0.813 209 HG22 THR 40 HG22 THR 40 111.200 1.083 0.460 210 HG23 THR 40 HG23 THR 40 110.866 1.460 -1.230 211 H VAL 41 HN VAL 41 109.079 2.068 -1.524 212 HA VAL 41 HA VAL 41 107.101 1.324 -3.603 213 HB VAL 41 HB VAL 41 107.206 3.909 -2.035 214 HG11 VAL 41 HG11 VAL 41 105.915 3.208 -4.671 215 HG12 VAL 41 HG12 VAL 41 106.810 4.663 -4.231 216 HG13 VAL 41 HG13 VAL 41 105.179 4.411 -3.612 217 HG21 VAL 41 HG21 VAL 41 105.968 1.937 -1.075 218 HG22 VAL 41 HG22 VAL 41 104.955 1.934 -2.518 219 HG23 VAL 41 HG23 VAL 41 104.931 3.318 -1.427 220 H GLY 42 HN GLY 42 107.597 1.921 -5.642 221 HA2 GLY 42 HA2 GLY 42 109.507 3.979 -6.264 222 HA3 GLY 42 HA1 GLY 42 110.165 2.359 -6.491 223 H CYS 43 HN CYS 43 110.032 3.886 -8.697 224 HA CYS 43 HA CYS 43 107.524 3.276 -10.105 225 HB2 CYS 43 HB2 CYS 43 107.959 5.261 -11.112 226 HB3 CYS 43 HB1 CYS 43 109.466 5.383 -10.223 227 H ALA 44 HN ALA 44 107.618 2.304 -12.259 228 HA ALA 44 HA ALA 44 109.949 0.556 -12.764 229 HB1 ALA 44 HB1 ALA 44 107.119 -0.274 -12.239 230 HB2 ALA 44 HB2 ALA 44 108.618 -1.084 -11.799 231 HB3 ALA 44 HB3 ALA 44 108.026 -1.171 -13.457 232 H ALA 45 HN ALA 45 110.385 0.240 -14.917 233 HA ALA 45 HA ALA 45 108.741 1.787 -16.842 234 HB1 ALA 45 HB1 ALA 45 110.738 1.863 -18.225 235 HB2 ALA 45 HB2 ALA 45 111.591 0.788 -17.117 236 HB3 ALA 45 HB3 ALA 45 111.143 2.414 -16.599 237 H ASP 46 HN ASP 46 109.265 -1.337 -15.797 238 HA ASP 46 HA ASP 46 108.756 -2.534 -18.462 239 HB2 ASP 46 HB2 ASP 46 110.769 -3.270 -17.179 240 HB3 ASP 46 HB1 ASP 46 109.687 -3.877 -15.928 241 H GLN 47 HN GLN 47 106.803 -1.341 -16.320 242 HA GLN 47 HA GLN 47 104.772 -1.908 -15.371 243 HB2 GLN 47 HB2 GLN 47 104.801 -3.442 -17.964 244 HB3 GLN 47 HB1 GLN 47 103.378 -3.371 -16.925 245 HG2 GLN 47 HG2 GLN 47 103.409 -0.917 -17.045 246 HG3 GLN 47 HG1 GLN 47 104.838 -0.975 -18.069 247 HE21 GLN 47 HE21 GLN 47 102.842 0.332 -19.266 248 HE22 GLN 47 HE22 GLN 47 102.025 -0.624 -20.406 249 H SER 48 HN SER 48 105.152 -2.950 -13.490 250 HA SER 48 HA SER 48 105.548 -5.883 -13.542 251 HB2 SER 48 HB2 SER 48 106.073 -5.381 -11.029 252 HB3 SER 48 HB1 SER 48 107.267 -4.957 -12.252 253 HG SER 48 HG SER 48 105.871 -3.356 -10.573 254 HA PRO 49 HA PRO 49 101.407 -6.527 -12.176 255 HB2 PRO 49 HB2 PRO 49 101.756 -8.533 -10.274 256 HB3 PRO 49 HB1 PRO 49 101.691 -8.801 -12.023 257 HG2 PRO 49 HG2 PRO 49 104.069 -8.582 -10.232 258 HG3 PRO 49 HG1 PRO 49 103.791 -9.662 -11.611 259 HD2 PRO 49 HD2 PRO 49 105.360 -7.468 -11.829 260 HD3 PRO 49 HD1 PRO 49 104.341 -8.018 -13.181 261 H GLU 50 HN GLU 50 103.853 -6.026 -9.698 262 HA GLU 50 HA GLU 50 102.120 -5.499 -7.529 263 HB2 GLU 50 HB2 GLU 50 104.263 -4.030 -6.822 264 HB3 GLU 50 HB1 GLU 50 104.266 -5.788 -6.729 265 HG2 GLU 50 HG2 GLU 50 105.404 -5.979 -8.837 266 HG3 GLU 50 HG1 GLU 50 105.186 -4.262 -9.173 267 H SER 51 HN SER 51 102.564 -3.788 -10.383 268 HA SER 51 HA SER 51 102.103 -1.145 -9.252 269 HB2 SER 51 HB2 SER 51 102.328 -2.111 -12.106 270 HB3 SER 51 HB1 SER 51 102.126 -0.432 -11.633 271 HG SER 51 HG SER 51 104.055 -0.998 -10.213 272 H LEU 52 HN LEU 52 100.214 -3.776 -9.947 273 HA LEU 52 HA LEU 52 97.931 -2.384 -11.063 274 HB2 LEU 52 HB2 LEU 52 98.702 -4.921 -11.278 275 HB3 LEU 52 HB1 LEU 52 97.772 -5.108 -9.794 276 HG LEU 52 HG LEU 52 96.742 -3.980 -12.413 277 HD11 LEU 52 HD11 LEU 52 96.377 -6.606 -10.970 278 HD12 LEU 52 HD12 LEU 52 96.907 -6.339 -12.628 279 HD13 LEU 52 HD13 LEU 52 95.227 -6.043 -12.180 280 HD21 LEU 52 HD21 LEU 52 95.467 -4.312 -9.690 281 HD22 LEU 52 HD22 LEU 52 94.523 -4.153 -11.168 282 HD23 LEU 52 HD23 LEU 52 95.583 -2.844 -10.661 283 H LEU 53 HN LEU 53 96.753 -1.081 -9.800 284 HA LEU 53 HA LEU 53 96.438 -1.761 -6.924 285 HB2 LEU 53 HB2 LEU 53 96.606 0.944 -8.245 286 HB3 LEU 53 HB1 LEU 53 96.302 0.669 -6.530 287 HG LEU 53 HG LEU 53 98.727 -0.627 -7.764 288 HD11 LEU 53 HD11 LEU 53 100.052 1.423 -7.286 289 HD12 LEU 53 HD12 LEU 53 98.551 2.298 -6.985 290 HD13 LEU 53 HD13 LEU 53 98.891 1.656 -8.591 291 HD21 LEU 53 HD21 LEU 53 99.574 -0.540 -5.566 292 HD22 LEU 53 HD22 LEU 53 97.858 -0.847 -5.315 293 HD23 LEU 53 HD23 LEU 53 98.500 0.779 -5.098 294 H GLN 54 HN GLN 54 94.477 -2.040 -6.184 295 HA GLN 54 HA GLN 54 92.166 -1.454 -7.886 296 HB2 GLN 54 HB2 GLN 54 92.432 -2.829 -5.202 297 HB3 GLN 54 HB1 GLN 54 90.893 -2.567 -6.025 298 HG2 GLN 54 HG2 GLN 54 91.739 -3.820 -7.985 299 HG3 GLN 54 HG1 GLN 54 93.255 -4.103 -7.134 300 HE21 GLN 54 HE21 GLN 54 92.151 -6.431 -7.767 301 HE22 GLN 54 HE22 GLN 54 91.301 -7.136 -6.477 302 H LEU 55 HN LEU 55 91.672 0.692 -7.874 303 HA LEU 55 HA LEU 55 91.930 2.223 -5.431 304 HB2 LEU 55 HB2 LEU 55 91.500 4.153 -6.716 305 HB3 LEU 55 HB1 LEU 55 92.523 3.113 -7.700 306 HG LEU 55 HG LEU 55 90.107 2.229 -8.543 307 HD11 LEU 55 HD11 LEU 55 88.392 3.784 -8.474 308 HD12 LEU 55 HD12 LEU 55 89.486 5.161 -8.341 309 HD13 LEU 55 HD13 LEU 55 89.162 4.155 -6.935 310 HD21 LEU 55 HD21 LEU 55 90.349 3.823 -10.455 311 HD22 LEU 55 HD22 LEU 55 91.869 3.043 -10.017 312 HD23 LEU 55 HD23 LEU 55 91.559 4.709 -9.524 313 H LYS 56 HN LYS 56 90.471 2.342 -3.938 314 HA LYS 56 HA LYS 56 87.661 1.677 -4.575 315 HB2 LYS 56 HB2 LYS 56 89.146 1.770 -1.927 316 HB3 LYS 56 HB1 LYS 56 87.444 1.353 -2.123 317 HG2 LYS 56 HG2 LYS 56 88.081 -0.549 -3.568 318 HG3 LYS 56 HG1 LYS 56 89.781 -0.140 -3.352 319 HD2 LYS 56 HD2 LYS 56 89.572 -0.502 -0.927 320 HD3 LYS 56 HD1 LYS 56 87.862 -0.885 -1.126 321 HE2 LYS 56 HE2 LYS 56 88.980 -2.991 -1.043 322 HE3 LYS 56 HE1 LYS 56 88.607 -2.721 -2.746 323 HZ1 LYS 56 HZ1 LYS 56 91.116 -3.087 -1.552 324 HZ2 LYS 56 HZ2 LYS 56 91.064 -1.515 -2.194 325 HZ3 LYS 56 HZ3 LYS 56 90.756 -2.853 -3.193 326 H ALA 57 HN ALA 57 86.039 3.084 -4.149 327 HA ALA 57 HA ALA 57 86.807 5.864 -3.539 328 HB1 ALA 57 HB1 ALA 57 85.442 5.387 -5.555 329 HB2 ALA 57 HB2 ALA 57 84.599 6.432 -4.411 330 HB3 ALA 57 HB3 ALA 57 84.180 4.721 -4.520 331 H LEU 58 HN LEU 58 86.953 6.057 -1.319 332 HA LEU 58 HA LEU 58 85.175 4.706 0.477 333 HB2 LEU 58 HB2 LEU 58 86.793 7.199 1.043 334 HB3 LEU 58 HB1 LEU 58 86.163 6.054 2.221 335 HG LEU 58 HG LEU 58 88.340 5.554 0.171 336 HD11 LEU 58 HD11 LEU 58 89.644 5.076 2.273 337 HD12 LEU 58 HD12 LEU 58 88.254 5.627 3.201 338 HD13 LEU 58 HD13 LEU 58 89.106 6.749 2.142 339 HD21 LEU 58 HD21 LEU 58 87.137 3.502 0.255 340 HD22 LEU 58 HD22 LEU 58 86.816 3.670 1.983 341 HD23 LEU 58 HD23 LEU 58 88.444 3.294 1.418 342 H LYS 59 HN LYS 59 85.485 8.054 -0.581 343 HA LYS 59 HA LYS 59 82.602 8.505 -0.240 344 HB2 LYS 59 HB2 LYS 59 84.697 10.436 0.803 345 HB3 LYS 59 HB1 LYS 59 82.959 10.566 0.983 346 HG2 LYS 59 HG2 LYS 59 82.890 8.665 2.473 347 HG3 LYS 59 HG1 LYS 59 84.585 8.304 2.169 348 HD2 LYS 59 HD2 LYS 59 83.881 11.029 3.230 349 HD3 LYS 59 HD1 LYS 59 83.873 9.661 4.341 350 HE2 LYS 59 HE2 LYS 59 86.189 9.133 3.779 351 HE3 LYS 59 HE1 LYS 59 86.211 10.402 2.558 352 HZ1 LYS 59 HZ1 LYS 59 85.349 11.449 5.038 353 HZ2 LYS 59 HZ2 LYS 59 86.688 11.895 4.094 354 HZ3 LYS 59 HZ3 LYS 59 86.832 10.648 5.238 355 HA PRO 60 HA PRO 60 83.181 10.453 -4.181 356 HB2 PRO 60 HB2 PRO 60 81.652 12.805 -3.827 357 HB3 PRO 60 HB1 PRO 60 81.038 11.244 -4.400 358 HG2 PRO 60 HG2 PRO 60 80.940 12.423 -1.664 359 HG3 PRO 60 HG1 PRO 60 79.744 11.420 -2.507 360 HD2 PRO 60 HD2 PRO 60 81.303 10.380 -0.583 361 HD3 PRO 60 HD1 PRO 60 80.869 9.427 -2.019 362 H GLY 61 HN GLY 61 85.147 11.248 -4.594 363 HA2 GLY 61 HA2 GLY 61 86.574 13.144 -4.924 364 HA3 GLY 61 HA1 GLY 61 85.949 13.850 -3.438 365 H VAL 62 HN VAL 62 86.231 10.904 -2.360 366 HA VAL 62 HA VAL 62 89.146 11.038 -1.789 367 HB VAL 62 HB VAL 62 86.914 10.207 0.089 368 HG11 VAL 62 HG11 VAL 62 88.897 8.863 0.485 369 HG12 VAL 62 HG12 VAL 62 88.812 10.096 1.742 370 HG13 VAL 62 HG13 VAL 62 89.928 10.290 0.390 371 HG21 VAL 62 HG21 VAL 62 88.791 12.594 0.067 372 HG22 VAL 62 HG22 VAL 62 87.699 12.185 1.394 373 HG23 VAL 62 HG23 VAL 62 87.044 12.639 -0.180 374 H ILE 63 HN ILE 63 90.267 9.203 -2.163 375 HA ILE 63 HA ILE 63 88.785 6.661 -2.487 376 HB ILE 63 HB ILE 63 89.946 6.168 -4.527 377 HG12 ILE 63 HG12 ILE 63 91.313 8.440 -5.367 378 HG13 ILE 63 HG11 ILE 63 91.682 8.431 -3.646 379 HG21 ILE 63 HG21 ILE 63 88.940 7.810 -5.969 380 HG22 ILE 63 HG22 ILE 63 89.000 9.040 -4.706 381 HG23 ILE 63 HG23 ILE 63 87.907 7.665 -4.547 382 HD11 ILE 63 HD11 ILE 63 93.400 7.161 -4.741 383 HD12 ILE 63 HD12 ILE 63 92.217 6.231 -5.659 384 HD13 ILE 63 HD13 ILE 63 92.367 5.994 -3.920 385 H GLN 64 HN GLN 64 90.241 4.783 -2.561 386 HA GLN 64 HA GLN 64 92.762 5.124 -1.035 387 HB2 GLN 64 HB2 GLN 64 90.921 4.352 0.476 388 HB3 GLN 64 HB1 GLN 64 90.697 2.951 -0.570 389 HG2 GLN 64 HG2 GLN 64 93.010 2.253 -0.165 390 HG3 GLN 64 HG1 GLN 64 93.278 3.673 0.844 391 HE21 GLN 64 HE21 GLN 64 93.635 1.105 1.946 392 HE22 GLN 64 HE22 GLN 64 92.400 0.803 3.069 393 H ILE 65 HN ILE 65 94.413 3.696 -1.689 394 HA ILE 65 HA ILE 65 93.753 1.966 -4.016 395 HB ILE 65 HB ILE 65 96.365 2.444 -4.439 396 HG12 ILE 65 HG12 ILE 65 95.365 4.971 -3.085 397 HG13 ILE 65 HG11 ILE 65 96.531 3.853 -2.375 398 HG21 ILE 65 HG21 ILE 65 94.458 2.937 -5.989 399 HG22 ILE 65 HG22 ILE 65 95.714 4.172 -6.020 400 HG23 ILE 65 HG23 ILE 65 94.212 4.464 -5.142 401 HD11 ILE 65 HD11 ILE 65 97.840 5.560 -3.387 402 HD12 ILE 65 HD12 ILE 65 96.845 5.564 -4.844 403 HD13 ILE 65 HD13 ILE 65 97.912 4.201 -4.511 404 H LEU 66 HN LEU 66 94.085 -0.082 -3.816 405 HA LEU 66 HA LEU 66 95.968 -1.099 -1.775 406 HB2 LEU 66 HB2 LEU 66 93.602 -1.312 -1.086 407 HB3 LEU 66 HB1 LEU 66 93.241 -2.183 -2.564 408 HG LEU 66 HG LEU 66 93.632 -3.479 -0.312 409 HD11 LEU 66 HD11 LEU 66 93.227 -4.944 -1.988 410 HD12 LEU 66 HD12 LEU 66 94.941 -5.298 -1.810 411 HD13 LEU 66 HD13 LEU 66 94.390 -4.218 -3.086 412 HD21 LEU 66 HD21 LEU 66 96.503 -3.289 -1.254 413 HD22 LEU 66 HD22 LEU 66 95.896 -4.162 0.143 414 HD23 LEU 66 HD23 LEU 66 95.858 -2.403 0.124 415 H GLY 67 HN GLY 67 97.529 -2.335 -2.620 416 HA2 GLY 67 HA2 GLY 67 97.456 -3.138 -5.397 417 HA3 GLY 67 HA1 GLY 67 98.776 -3.403 -4.270 418 H VAL 68 HN VAL 68 96.966 -5.062 -6.211 419 HA VAL 68 HA VAL 68 95.691 -7.027 -4.589 420 HB VAL 68 HB VAL 68 95.386 -8.234 -6.654 421 HG11 VAL 68 HG11 VAL 68 94.401 -6.433 -8.038 422 HG12 VAL 68 HG12 VAL 68 95.295 -5.232 -7.103 423 HG13 VAL 68 HG13 VAL 68 94.036 -6.196 -6.330 424 HG21 VAL 68 HG21 VAL 68 96.526 -7.219 -8.741 425 HG22 VAL 68 HG22 VAL 68 97.530 -8.199 -7.677 426 HG23 VAL 68 HG23 VAL 68 97.624 -6.439 -7.605 427 H LYS 69 HN LYS 69 98.800 -6.977 -6.312 428 HA LYS 69 HA LYS 69 99.560 -9.607 -5.608 429 HB2 LYS 69 HB2 LYS 69 100.574 -8.411 -7.488 430 HB3 LYS 69 HB1 LYS 69 101.287 -7.256 -6.367 431 HG2 LYS 69 HG2 LYS 69 102.603 -9.013 -5.315 432 HG3 LYS 69 HG1 LYS 69 101.835 -10.232 -6.330 433 HD2 LYS 69 HD2 LYS 69 102.806 -9.168 -8.323 434 HD3 LYS 69 HD1 LYS 69 103.558 -7.941 -7.306 435 HE2 LYS 69 HE2 LYS 69 104.810 -9.703 -6.112 436 HE3 LYS 69 HE1 LYS 69 104.072 -10.925 -7.149 437 HZ1 LYS 69 HZ1 LYS 69 106.336 -10.154 -7.839 438 HZ2 LYS 69 HZ2 LYS 69 105.647 -8.645 -8.203 439 HZ3 LYS 69 HZ3 LYS 69 105.144 -10.035 -9.040 440 H THR 70 HN THR 70 100.352 -6.466 -4.140 441 HA THR 70 HA THR 70 101.889 -7.797 -2.046 442 HB THR 70 HB THR 70 102.154 -5.388 -1.229 443 HG1 THR 70 HG1 THR 70 100.224 -4.853 -2.653 444 HG21 THR 70 HG21 THR 70 103.751 -4.865 -3.069 445 HG22 THR 70 HG22 THR 70 103.060 -6.190 -4.008 446 HG23 THR 70 HG23 THR 70 103.894 -6.523 -2.491 447 H SER 71 HN SER 71 98.669 -6.563 -2.483 448 HA SER 71 HA SER 71 96.866 -6.488 -1.057 449 HB2 SER 71 HB2 SER 71 96.638 -8.332 0.288 450 HB3 SER 71 HB1 SER 71 98.100 -8.848 -0.547 451 HG SER 71 HG SER 71 97.843 -7.595 1.981 452 H ARG 72 HN ARG 72 99.238 -4.630 -0.750 453 HA ARG 72 HA ARG 72 98.845 -3.808 2.067 454 HB2 ARG 72 HB2 ARG 72 101.105 -3.320 0.121 455 HB3 ARG 72 HB1 ARG 72 100.942 -2.459 1.646 456 HG2 ARG 72 HG2 ARG 72 101.001 -4.586 2.877 457 HG3 ARG 72 HG1 ARG 72 101.130 -5.469 1.356 458 HD2 ARG 72 HD2 ARG 72 103.242 -4.286 0.855 459 HD3 ARG 72 HD1 ARG 72 103.122 -3.430 2.388 460 HE ARG 72 HE ARG 72 103.911 -6.201 2.003 461 HH11 ARG 72 HH11 ARG 72 104.640 -7.254 3.873 462 HH12 ARG 72 HH12 ARG 72 104.387 -6.529 5.426 463 HH21 ARG 72 HH21 ARG 72 102.741 -3.752 4.149 464 HH22 ARG 72 HH22 ARG 72 103.297 -4.548 5.584 465 H PHE 73 HN PHE 73 98.167 -1.766 2.529 466 HA PHE 73 HA PHE 73 96.940 -0.252 0.353 467 HB2 PHE 73 HB2 PHE 73 96.986 0.252 3.343 468 HB3 PHE 73 HB1 PHE 73 95.990 1.107 2.166 469 HD1 PHE 73 HD1 PHE 73 96.328 -1.891 4.204 470 HD2 PHE 73 HD2 PHE 73 94.261 -0.167 0.848 471 HE1 PHE 73 HE1 PHE 73 94.567 -3.629 4.388 472 HE2 PHE 73 HE2 PHE 73 92.507 -1.907 1.036 473 HZ PHE 73 HZ PHE 73 92.661 -3.638 2.803 474 H LEU 74 HN LEU 74 97.964 1.396 -0.639 475 HA LEU 74 HA LEU 74 100.537 2.282 0.280 476 HB2 LEU 74 HB2 LEU 74 100.204 2.194 -2.081 477 HB3 LEU 74 HB1 LEU 74 98.745 3.176 -1.983 478 HG LEU 74 HG LEU 74 100.015 5.139 -1.368 479 HD11 LEU 74 HD11 LEU 74 102.281 3.168 -1.061 480 HD12 LEU 74 HD12 LEU 74 101.685 4.354 0.100 481 HD13 LEU 74 HD13 LEU 74 102.593 4.886 -1.310 482 HD21 LEU 74 HD21 LEU 74 101.671 5.238 -3.316 483 HD22 LEU 74 HD22 LEU 74 100.016 4.816 -3.740 484 HD23 LEU 74 HD23 LEU 74 101.247 3.560 -3.643 485 H CYS 75 HN CYS 75 100.777 3.598 1.939 486 HA CYS 75 HA CYS 75 98.943 5.904 2.224 487 HB2 CYS 75 HB2 CYS 75 100.134 4.423 4.560 488 HB3 CYS 75 HB1 CYS 75 98.830 5.609 4.564 489 H GLN 76 HN GLN 76 99.865 7.821 2.929 490 HA GLN 76 HA GLN 76 102.810 7.943 2.741 491 HB2 GLN 76 HB2 GLN 76 101.549 9.249 1.090 492 HB3 GLN 76 HB1 GLN 76 100.728 10.110 2.392 493 HG2 GLN 76 HG2 GLN 76 102.720 11.183 3.092 494 HG3 GLN 76 HG1 GLN 76 103.741 10.061 2.201 495 HE21 GLN 76 HE21 GLN 76 101.141 10.744 0.188 496 HE22 GLN 76 HE22 GLN 76 101.826 12.017 -0.698 497 H ARG 77 HN ARG 77 104.006 8.624 4.409 498 HA ARG 77 HA ARG 77 102.681 9.073 6.959 499 HB2 ARG 77 HB2 ARG 77 105.461 9.351 7.367 500 HB3 ARG 77 HB1 ARG 77 104.507 7.897 7.645 501 HG2 ARG 77 HG2 ARG 77 104.934 7.132 5.382 502 HG3 ARG 77 HG1 ARG 77 105.734 8.653 4.991 503 HD2 ARG 77 HD2 ARG 77 107.379 6.873 5.477 504 HD3 ARG 77 HD1 ARG 77 107.484 8.189 6.642 505 HE ARG 77 HE ARG 77 106.668 6.747 8.298 506 HH11 ARG 77 HH11 ARG 77 106.140 4.680 9.063 507 HH12 ARG 77 HH12 ARG 77 105.911 3.378 7.944 508 HH21 ARG 77 HH21 ARG 77 106.496 5.334 5.140 509 HH22 ARG 77 HH22 ARG 77 106.096 3.752 5.721 510 HA PRO 78 HA PRO 78 103.009 13.460 7.418 511 HB2 PRO 78 HB2 PRO 78 105.027 13.150 9.615 512 HB3 PRO 78 HB1 PRO 78 103.488 14.036 9.613 513 HG2 PRO 78 HG2 PRO 78 103.740 11.693 10.865 514 HG3 PRO 78 HG1 PRO 78 102.242 12.141 10.027 515 HD2 PRO 78 HD2 PRO 78 104.358 10.201 9.189 516 HD3 PRO 78 HD1 PRO 78 102.608 10.167 8.892 517 H ASP 79 HN ASP 79 106.066 11.707 7.427 518 HA ASP 79 HA ASP 79 107.718 13.922 6.727 519 HB2 ASP 79 HB2 ASP 79 108.087 10.931 6.497 520 HB3 ASP 79 HB1 ASP 79 109.326 12.091 6.024 521 H GLY 80 HN GLY 80 105.326 12.305 5.091 522 HA2 GLY 80 HA2 GLY 80 104.528 12.698 2.958 523 HA3 GLY 80 HA1 GLY 80 105.994 13.598 2.591 524 H ALA 81 HN ALA 81 106.575 10.549 3.986 525 HA ALA 81 HA ALA 81 107.666 9.565 1.466 526 HB1 ALA 81 HB1 ALA 81 107.932 8.854 4.356 527 HB2 ALA 81 HB2 ALA 81 109.182 9.082 3.139 528 HB3 ALA 81 HB3 ALA 81 108.253 7.584 3.175 529 H LEU 82 HN LEU 82 106.964 7.850 0.322 530 HA LEU 82 HA LEU 82 104.247 6.887 0.869 531 HB2 LEU 82 HB2 LEU 82 106.089 6.948 -1.505 532 HB3 LEU 82 HB1 LEU 82 104.804 5.743 -1.477 533 HG LEU 82 HG LEU 82 103.115 7.464 -1.227 534 HD11 LEU 82 HD11 LEU 82 104.057 9.930 -1.519 535 HD12 LEU 82 HD12 LEU 82 105.500 9.234 -0.780 536 HD13 LEU 82 HD13 LEU 82 103.958 9.182 0.073 537 HD21 LEU 82 HD21 LEU 82 103.684 8.837 -3.363 538 HD22 LEU 82 HD22 LEU 82 103.571 7.086 -3.509 539 HD23 LEU 82 HD23 LEU 82 105.151 7.861 -3.424 540 H TYR 83 HN TYR 83 103.785 4.862 1.539 541 HA TYR 83 HA TYR 83 105.696 2.694 1.196 542 HB2 TYR 83 HB2 TYR 83 105.933 2.180 3.539 543 HB3 TYR 83 HB1 TYR 83 106.387 3.869 3.320 544 HD1 TYR 83 HD1 TYR 83 104.307 1.620 5.139 545 HD2 TYR 83 HD2 TYR 83 104.466 5.636 3.616 546 HE1 TYR 83 HE1 TYR 83 102.544 2.297 6.743 547 HE2 TYR 83 HE2 TYR 83 102.703 6.312 5.227 548 HH TYR 83 HH TYR 83 101.778 4.394 7.850 549 H GLY 84 HN GLY 84 104.746 0.631 1.503 550 HA2 GLY 84 HA2 GLY 84 101.837 0.609 1.253 551 HA3 GLY 84 HA1 GLY 84 102.918 -0.769 1.059 552 H SER 85 HN SER 85 100.446 0.003 2.841 553 HA SER 85 HA SER 85 101.591 -1.044 5.377 554 HB2 SER 85 HB2 SER 85 100.227 0.368 6.628 555 HB3 SER 85 HB1 SER 85 100.686 1.409 5.284 556 HG SER 85 HG SER 85 98.410 -0.218 5.053 557 H LEU 86 HN LEU 86 100.757 -2.854 6.109 558 HA LEU 86 HA LEU 86 98.824 -4.333 4.657 559 HB2 LEU 86 HB2 LEU 86 100.743 -5.042 6.382 560 HB3 LEU 86 HB1 LEU 86 99.414 -4.968 7.529 561 HG LEU 86 HG LEU 86 99.539 -7.229 6.728 562 HD11 LEU 86 HD11 LEU 86 97.339 -7.579 6.003 563 HD12 LEU 86 HD12 LEU 86 97.296 -6.077 5.081 564 HD13 LEU 86 HD13 LEU 86 97.254 -6.034 6.847 565 HD21 LEU 86 HD21 LEU 86 99.095 -6.451 3.855 566 HD22 LEU 86 HD22 LEU 86 99.845 -7.894 4.530 567 HD23 LEU 86 HD23 LEU 86 100.733 -6.377 4.510 568 H HIS 87 HN HIS 87 98.693 -2.236 7.459 569 HA HIS 87 HA HIS 87 95.847 -2.786 7.918 570 HB2 HIS 87 HB2 HIS 87 97.247 -2.623 9.883 571 HB3 HIS 87 HB1 HIS 87 97.878 -1.064 9.357 572 HD2 HIS 87 HD2 HIS 87 94.082 -2.234 9.782 573 HE1 HIS 87 HE1 HIS 87 94.674 1.387 11.872 574 HE2 HIS 87 HE2 HIS 87 92.956 -0.367 11.219 575 H PHE 88 HN PHE 88 94.255 -1.165 7.823 576 HA PHE 88 HA PHE 88 94.767 0.889 5.803 577 HB2 PHE 88 HB2 PHE 88 92.842 -0.455 5.398 578 HB3 PHE 88 HB1 PHE 88 92.273 -0.261 7.051 579 HD1 PHE 88 HD1 PHE 88 93.448 2.160 4.401 580 HD2 PHE 88 HD2 PHE 88 90.317 1.003 7.110 581 HE1 PHE 88 HE1 PHE 88 92.093 4.107 3.684 582 HE2 PHE 88 HE2 PHE 88 88.977 2.954 6.390 583 HZ PHE 88 HZ PHE 88 89.866 4.508 4.677 584 H ASP 89 HN ASP 89 94.881 2.996 6.194 585 HA ASP 89 HA ASP 89 94.003 4.090 8.798 586 HB2 ASP 89 HB2 ASP 89 96.443 3.638 8.849 587 HB3 ASP 89 HB1 ASP 89 96.641 4.695 7.454 588 HA PRO 90 HA PRO 90 92.120 6.553 5.373 589 HB2 PRO 90 HB2 PRO 90 90.860 7.891 7.734 590 HB3 PRO 90 HB1 PRO 90 90.105 7.265 6.255 591 HG2 PRO 90 HG2 PRO 90 89.919 5.996 8.613 592 HG3 PRO 90 HG1 PRO 90 89.970 5.127 7.074 593 HD2 PRO 90 HD2 PRO 90 92.091 5.401 9.153 594 HD3 PRO 90 HD1 PRO 90 91.809 4.078 7.999 595 H GLU 91 HN GLU 91 93.370 7.821 8.420 596 HA GLU 91 HA GLU 91 93.712 10.496 7.698 597 HB2 GLU 91 HB2 GLU 91 95.234 8.762 9.651 598 HB3 GLU 91 HB1 GLU 91 95.513 10.494 9.490 599 HG2 GLU 91 HG2 GLU 91 93.939 10.400 11.225 600 HG3 GLU 91 HG1 GLU 91 92.922 10.705 9.822 601 H ALA 92 HN ALA 92 95.457 7.773 6.513 602 HA ALA 92 HA ALA 92 97.420 9.623 5.271 603 HB1 ALA 92 HB1 ALA 92 99.130 7.762 5.611 604 HB2 ALA 92 HB2 ALA 92 97.987 7.063 6.758 605 HB3 ALA 92 HB3 ALA 92 98.659 8.667 7.050 606 H CYS 93 HN CYS 93 95.473 6.736 5.025 607 HA CYS 93 HA CYS 93 96.648 5.995 2.455 608 HB2 CYS 93 HB2 CYS 93 94.293 4.733 3.830 609 HB3 CYS 93 HB1 CYS 93 95.348 4.019 2.611 610 H SER 94 HN SER 94 94.104 7.997 3.542 611 HA SER 94 HA SER 94 92.422 7.651 1.208 612 HB2 SER 94 HB2 SER 94 92.436 9.623 3.494 613 HB3 SER 94 HB1 SER 94 91.322 9.757 2.146 614 HG SER 94 HG SER 94 91.632 7.562 3.918 615 H PHE 95 HN PHE 95 92.301 9.034 -0.559 616 HA PHE 95 HA PHE 95 94.237 11.252 -0.704 617 HB2 PHE 95 HB2 PHE 95 93.966 9.078 -2.788 618 HB3 PHE 95 HB1 PHE 95 94.990 10.506 -2.904 619 HD1 PHE 95 HD1 PHE 95 94.659 7.154 -1.536 620 HD2 PHE 95 HD2 PHE 95 96.875 10.823 -1.256 621 HE1 PHE 95 HE1 PHE 95 96.475 5.965 -0.345 622 HE2 PHE 95 HE2 PHE 95 98.692 9.631 -0.063 623 HZ PHE 95 HZ PHE 95 98.500 7.201 0.381 624 H ARG 96 HN ARG 96 93.687 12.875 -2.083 625 HA ARG 96 HA ARG 96 90.881 12.991 -2.904 626 HB2 ARG 96 HB2 ARG 96 91.796 14.851 -1.583 627 HB3 ARG 96 HB1 ARG 96 93.027 15.129 -2.814 628 HG2 ARG 96 HG2 ARG 96 91.303 15.659 -4.468 629 HG3 ARG 96 HG1 ARG 96 90.036 15.284 -3.298 630 HD2 ARG 96 HD2 ARG 96 90.765 17.108 -1.860 631 HD3 ARG 96 HD1 ARG 96 92.133 17.438 -2.917 632 HE ARG 96 HE ARG 96 90.679 18.497 -4.415 633 HH11 ARG 96 HH11 ARG 96 88.675 19.428 -4.927 634 HH12 ARG 96 HH12 ARG 96 87.270 19.012 -4.003 635 HH21 ARG 96 HH21 ARG 96 88.975 16.841 -1.901 636 HH22 ARG 96 HH22 ARG 96 87.440 17.542 -2.289 637 H GLU 97 HN GLU 97 90.231 13.242 -5.007 638 HA GLU 97 HA GLU 97 92.202 12.550 -7.065 639 HB2 GLU 97 HB2 GLU 97 89.184 12.761 -7.083 640 HB3 GLU 97 HB1 GLU 97 90.143 12.410 -8.520 641 HG2 GLU 97 HG2 GLU 97 91.113 10.438 -7.372 642 HG3 GLU 97 HG1 GLU 97 90.103 10.775 -5.967 643 H LEU 98 HN LEU 98 93.256 14.128 -8.049 644 HA LEU 98 HA LEU 98 91.933 16.757 -8.432 645 HB2 LEU 98 HB2 LEU 98 94.882 16.086 -8.588 646 HB3 LEU 98 HB1 LEU 98 94.155 17.689 -8.631 647 HG LEU 98 HG LEU 98 94.002 15.772 -6.284 648 HD11 LEU 98 HD11 LEU 98 95.710 18.202 -6.862 649 HD12 LEU 98 HD12 LEU 98 96.247 16.575 -6.443 650 HD13 LEU 98 HD13 LEU 98 95.461 17.583 -5.228 651 HD21 LEU 98 HD21 LEU 98 92.931 18.551 -6.801 652 HD22 LEU 98 HD22 LEU 98 93.249 17.988 -5.159 653 HD23 LEU 98 HD23 LEU 98 92.078 17.144 -6.166 654 H LEU 99 HN LEU 99 91.364 17.309 -10.446 655 HA LEU 99 HA LEU 99 92.690 15.937 -12.713 656 HB2 LEU 99 HB2 LEU 99 89.849 16.113 -12.037 657 HB3 LEU 99 HB1 LEU 99 90.157 16.769 -13.638 658 HG LEU 99 HG LEU 99 89.639 14.356 -13.719 659 HD11 LEU 99 HD11 LEU 99 91.179 13.876 -15.362 660 HD12 LEU 99 HD12 LEU 99 92.548 14.456 -14.424 661 HD13 LEU 99 HD13 LEU 99 91.470 15.607 -15.209 662 HD21 LEU 99 HD21 LEU 99 92.257 13.705 -12.404 663 HD22 LEU 99 HD22 LEU 99 90.810 12.718 -12.571 664 HD23 LEU 99 HD23 LEU 99 90.850 14.025 -11.390 665 H LEU 100 HN LEU 100 93.501 17.135 -14.262 666 HA LEU 100 HA LEU 100 93.177 20.074 -14.062 667 HB2 LEU 100 HB2 LEU 100 95.361 18.425 -15.361 668 HB3 LEU 100 HB1 LEU 100 95.301 20.185 -15.303 669 HG LEU 100 HG LEU 100 95.393 18.367 -12.873 670 HD11 LEU 100 HD11 LEU 100 97.537 18.238 -13.856 671 HD12 LEU 100 HD12 LEU 100 97.705 19.531 -12.671 672 HD13 LEU 100 HD13 LEU 100 97.501 19.921 -14.380 673 HD21 LEU 100 HD21 LEU 100 96.059 20.740 -11.875 674 HD22 LEU 100 HD22 LEU 100 94.365 20.314 -12.084 675 HD23 LEU 100 HD23 LEU 100 95.165 21.346 -13.269 676 H GLU 101 HN GLU 101 92.509 21.244 -15.796 677 HA GLU 101 HA GLU 101 90.857 20.114 -17.726 678 HB2 GLU 101 HB2 GLU 101 90.877 22.519 -17.130 679 HB3 GLU 101 HB1 GLU 101 92.429 22.694 -17.949 680 HG2 GLU 101 HG2 GLU 101 91.418 21.992 -20.067 681 HG3 GLU 101 HG1 GLU 101 89.870 21.740 -19.263 682 H ASP 102 HN ASP 102 94.280 20.353 -17.593 683 HA ASP 102 HA ASP 102 94.816 20.059 -20.384 684 HB2 ASP 102 HB2 ASP 102 96.476 19.693 -17.898 685 HB3 ASP 102 HB1 ASP 102 97.124 19.437 -19.518 686 H GLY 103 HN GLY 103 93.636 17.878 -18.063 687 HA2 GLY 103 HA2 GLY 103 92.940 15.688 -18.570 688 HA3 GLY 103 HA1 GLY 103 94.060 15.654 -19.922 689 H TYR 104 HN TYR 104 95.328 16.760 -16.894 690 HA TYR 104 HA TYR 104 96.706 14.150 -16.530 691 HB2 TYR 104 HB2 TYR 104 97.596 16.945 -15.783 692 HB3 TYR 104 HB1 TYR 104 98.465 15.466 -15.372 693 HD1 TYR 104 HD1 TYR 104 98.041 17.997 -17.843 694 HD2 TYR 104 HD2 TYR 104 98.988 13.841 -17.352 695 HE1 TYR 104 HE1 TYR 104 99.086 17.975 -20.090 696 HE2 TYR 104 HE2 TYR 104 100.040 13.817 -19.597 697 HH TYR 104 HH TYR 104 101.159 15.750 -21.125 698 H ASN 105 HN ASN 105 96.532 13.115 -14.609 699 HA ASN 105 HA ASN 105 94.798 14.372 -12.556 700 HB2 ASN 105 HB2 ASN 105 95.313 11.416 -12.850 701 HB3 ASN 105 HB1 ASN 105 93.995 12.225 -12.007 702 HD21 ASN 105 HD21 ASN 105 92.252 11.349 -13.225 703 HD22 ASN 105 HD22 ASN 105 92.036 11.661 -14.879 704 H VAL 106 HN VAL 106 95.338 14.283 -10.399 705 HA VAL 106 HA VAL 106 97.921 13.079 -9.641 706 HB VAL 106 HB VAL 106 97.225 15.842 -8.654 707 HG11 VAL 106 HG11 VAL 106 99.833 14.344 -9.064 708 HG12 VAL 106 HG12 VAL 106 98.996 14.535 -7.523 709 HG13 VAL 106 HG13 VAL 106 99.672 15.944 -8.342 710 HG21 VAL 106 HG21 VAL 106 98.844 16.638 -10.479 711 HG22 VAL 106 HG22 VAL 106 97.219 16.203 -11.009 712 HG23 VAL 106 HG23 VAL 106 98.558 15.083 -11.261 713 H TYR 107 HN TYR 107 98.119 12.724 -7.354 714 HA TYR 107 HA TYR 107 95.507 12.605 -5.938 715 HB2 TYR 107 HB2 TYR 107 97.888 10.735 -5.792 716 HB3 TYR 107 HB1 TYR 107 96.432 10.598 -4.805 717 HD1 TYR 107 HD1 TYR 107 97.777 10.434 -8.250 718 HD2 TYR 107 HD2 TYR 107 94.364 9.736 -5.735 719 HE1 TYR 107 HE1 TYR 107 96.678 9.190 -10.090 720 HE2 TYR 107 HE2 TYR 107 93.260 8.484 -7.582 721 HH TYR 107 HH TYR 107 93.344 8.167 -9.889 722 H GLN 108 HN GLN 108 95.403 13.351 -3.885 723 HA GLN 108 HA GLN 108 97.871 14.246 -2.519 724 HB2 GLN 108 HB2 GLN 108 96.985 16.201 -3.686 725 HB3 GLN 108 HB1 GLN 108 95.385 15.911 -3.007 726 HG2 GLN 108 HG2 GLN 108 96.208 16.335 -0.758 727 HG3 GLN 108 HG1 GLN 108 97.864 16.460 -1.352 728 HE21 GLN 108 HE21 GLN 108 96.535 18.626 0.040 729 HE22 GLN 108 HE22 GLN 108 96.356 19.904 -1.061 730 H SER 109 HN SER 109 97.800 14.042 -0.288 731 HA SER 109 HA SER 109 95.797 12.336 0.823 732 HB2 SER 109 HB2 SER 109 98.157 12.501 1.668 733 HB3 SER 109 HB1 SER 109 97.758 14.088 2.319 734 HG SER 109 HG SER 109 96.522 13.183 3.808 735 H GLU 110 HN GLU 110 93.778 12.956 1.272 736 HA GLU 110 HA GLU 110 92.992 15.684 1.450 737 HB2 GLU 110 HB2 GLU 110 90.781 14.810 1.882 738 HB3 GLU 110 HB1 GLU 110 91.540 13.846 0.620 739 HG2 GLU 110 HG2 GLU 110 90.626 12.212 2.030 740 HG3 GLU 110 HG1 GLU 110 92.299 12.297 2.572 741 H ALA 111 HN ALA 111 93.886 13.271 3.814 742 HA ALA 111 HA ALA 111 92.676 14.432 6.078 743 HB1 ALA 111 HB1 ALA 111 93.994 12.955 7.368 744 HB2 ALA 111 HB2 ALA 111 95.257 12.886 6.138 745 HB3 ALA 111 HB3 ALA 111 93.701 12.110 5.847 746 H HIS 112 HN HIS 112 96.077 14.718 4.989 747 HA HIS 112 HA HIS 112 96.364 17.065 6.774 748 HB2 HIS 112 HB2 HIS 112 98.488 15.264 5.615 749 HB3 HIS 112 HB1 HIS 112 98.730 16.557 6.781 750 HD2 HIS 112 HD2 HIS 112 98.364 12.861 6.943 751 HE1 HIS 112 HE1 HIS 112 96.499 14.199 10.486 752 HE2 HIS 112 HE2 HIS 112 97.411 12.163 9.270 753 H GLY 113 HN GLY 113 96.288 16.144 3.455 754 HA2 GLY 113 HA2 GLY 113 96.306 17.620 1.624 755 HA3 GLY 113 HA1 GLY 113 96.923 18.884 2.678 756 H LEU 114 HN LEU 114 98.533 15.857 2.882 757 HA LEU 114 HA LEU 114 101.000 16.975 2.018 758 HB2 LEU 114 HB2 LEU 114 100.098 14.191 2.725 759 HB3 LEU 114 HB1 LEU 114 101.729 14.491 2.132 760 HG LEU 114 HG LEU 114 100.688 16.188 4.396 761 HD11 LEU 114 HD11 LEU 114 101.416 14.557 6.046 762 HD12 LEU 114 HD12 LEU 114 101.896 13.431 4.777 763 HD13 LEU 114 HD13 LEU 114 100.194 13.813 5.017 764 HD21 LEU 114 HD21 LEU 114 103.087 16.133 5.029 765 HD22 LEU 114 HD22 LEU 114 102.877 16.696 3.371 766 HD23 LEU 114 HD23 LEU 114 103.411 15.044 3.681 767 HA PRO 115 HA PRO 115 100.395 16.047 -2.341 768 HB2 PRO 115 HB2 PRO 115 102.880 16.555 -3.286 769 HB3 PRO 115 HB1 PRO 115 101.835 17.859 -2.684 770 HG2 PRO 115 HG2 PRO 115 104.060 16.429 -1.283 771 HG3 PRO 115 HG1 PRO 115 103.724 18.169 -1.362 772 HD2 PRO 115 HD2 PRO 115 102.998 16.629 0.782 773 HD3 PRO 115 HD1 PRO 115 102.074 18.062 0.271 774 H LEU 116 HN LEU 116 100.638 14.246 -3.689 775 HA LEU 116 HA LEU 116 102.171 11.999 -2.556 776 HB2 LEU 116 HB2 LEU 116 99.701 11.840 -3.161 777 HB3 LEU 116 HB1 LEU 116 100.194 11.940 -4.846 778 HG LEU 116 HG LEU 116 101.634 9.891 -3.198 779 HD11 LEU 116 HD11 LEU 116 99.821 8.269 -3.341 780 HD12 LEU 116 HD12 LEU 116 98.763 9.481 -4.058 781 HD13 LEU 116 HD13 LEU 116 99.312 9.664 -2.396 782 HD21 LEU 116 HD21 LEU 116 101.880 10.304 -5.722 783 HD22 LEU 116 HD22 LEU 116 100.272 9.603 -5.885 784 HD23 LEU 116 HD23 LEU 116 101.592 8.637 -5.228 785 H HIS 117 HN HIS 117 104.092 11.550 -3.345 786 HA HIS 117 HA HIS 117 104.629 11.641 -6.204 787 HB2 HIS 117 HB2 HIS 117 106.655 13.050 -5.901 788 HB3 HIS 117 HB1 HIS 117 105.173 13.936 -5.529 789 HD2 HIS 117 HD2 HIS 117 104.795 14.546 -2.783 790 HE1 HIS 117 HE1 HIS 117 108.529 13.080 -1.476 791 HE2 HIS 117 HE2 HIS 117 106.476 14.408 -0.791 792 H LEU 118 HN LEU 118 106.789 10.666 -6.668 793 HA LEU 118 HA LEU 118 107.200 8.362 -5.027 794 HB2 LEU 118 HB2 LEU 118 108.935 9.406 -7.269 795 HB3 LEU 118 HB1 LEU 118 108.921 7.766 -6.632 796 HG LEU 118 HG LEU 118 106.541 9.115 -7.940 797 HD11 LEU 118 HD11 LEU 118 107.053 7.496 -9.799 798 HD12 LEU 118 HD12 LEU 118 108.571 7.125 -8.980 799 HD13 LEU 118 HD13 LEU 118 108.273 8.752 -9.590 800 HD21 LEU 118 HD21 LEU 118 107.063 6.367 -6.791 801 HD22 LEU 118 HD22 LEU 118 105.866 6.594 -8.065 802 HD23 LEU 118 HD23 LEU 118 105.680 7.427 -6.524 803 HA PRO 119 HA PRO 119 110.310 9.805 -2.183 804 HB2 PRO 119 HB2 PRO 119 112.108 7.600 -3.147 805 HB3 PRO 119 HB1 PRO 119 111.634 8.021 -1.488 806 HG2 PRO 119 HG2 PRO 119 110.569 5.923 -2.706 807 HG3 PRO 119 HG1 PRO 119 109.580 6.971 -1.673 808 HD2 PRO 119 HD2 PRO 119 109.663 6.815 -4.667 809 HD3 PRO 119 HD1 PRO 119 108.286 7.115 -3.583 810 H GLY 120 HN GLY 120 111.916 11.323 -2.272 811 HA2 GLY 120 HA2 GLY 120 113.522 11.545 -4.764 812 HA3 GLY 120 HA1 GLY 120 112.756 12.941 -4.014 813 H ASN 121 HN ASN 121 114.067 10.494 -1.931 814 HA ASN 121 HA ASN 121 115.915 12.401 -0.803 815 HB2 ASN 121 HB2 ASN 121 115.553 9.451 -0.228 816 HB3 ASN 121 HB1 ASN 121 116.472 10.588 0.757 817 HD21 ASN 121 HD21 ASN 121 113.993 12.447 -0.332 818 HD22 ASN 121 HD22 ASN 121 112.854 12.176 0.899 819 H LYS 122 HN LYS 122 117.333 12.833 -2.549 820 HA LYS 122 HA LYS 122 119.633 11.152 -2.650 821 HB2 LYS 122 HB2 LYS 122 118.190 9.836 -4.146 822 HB3 LYS 122 HB1 LYS 122 117.921 11.262 -5.146 823 HG2 LYS 122 HG2 LYS 122 120.317 11.377 -5.669 824 HG3 LYS 122 HG1 LYS 122 120.628 9.996 -4.617 825 HD2 LYS 122 HD2 LYS 122 119.155 8.598 -6.039 826 HD3 LYS 122 HD1 LYS 122 118.882 9.985 -7.095 827 HE2 LYS 122 HE2 LYS 122 121.248 10.086 -7.657 828 HE3 LYS 122 HE1 LYS 122 121.608 8.791 -6.517 829 HZ1 LYS 122 HZ1 LYS 122 119.754 8.485 -8.813 830 HZ2 LYS 122 HZ2 LYS 122 120.369 7.259 -7.808 831 HZ3 LYS 122 HZ3 LYS 122 121.400 8.081 -8.880 832 H SER 123 HN SER 123 117.758 13.787 -4.039 833 HA SER 123 HA SER 123 119.922 15.627 -3.892 834 HB2 SER 123 HB2 SER 123 120.861 14.534 -5.789 835 HB3 SER 123 HB1 SER 123 119.291 14.407 -6.578 836 HG SER 123 HG SER 123 119.819 16.966 -5.948 837 HA PRO 124 HA PRO 124 115.444 17.068 -4.509 838 HB2 PRO 124 HB2 PRO 124 115.127 18.195 -2.013 839 HB3 PRO 124 HB1 PRO 124 114.728 16.506 -2.385 840 HG2 PRO 124 HG2 PRO 124 117.187 17.625 -1.103 841 HG3 PRO 124 HG1 PRO 124 116.245 16.185 -0.668 842 HD2 PRO 124 HD2 PRO 124 118.560 16.003 -2.068 843 HD3 PRO 124 HD1 PRO 124 117.210 14.879 -2.342 844 H HIS 125 HN HIS 125 114.896 19.152 -5.111 845 HA HIS 125 HA HIS 125 117.075 21.077 -5.250 846 HB2 HIS 125 HB2 HIS 125 114.267 21.057 -6.364 847 HB3 HIS 125 HB1 HIS 125 115.381 22.407 -6.568 848 HD2 HIS 125 HD2 HIS 125 116.131 22.065 -9.217 849 HE1 HIS 125 HE1 HIS 125 117.225 17.995 -8.981 850 HE2 HIS 125 HE2 HIS 125 117.179 20.039 -10.487 851 H ARG 126 HN ARG 126 117.407 22.595 -3.785 852 HA ARG 126 HA ARG 126 115.492 23.165 -1.709 853 HB2 ARG 126 HB2 ARG 126 117.866 23.172 -1.177 854 HB3 ARG 126 HB1 ARG 126 118.159 24.432 -2.377 855 HG2 ARG 126 HG2 ARG 126 116.877 26.035 -1.133 856 HG3 ARG 126 HG1 ARG 126 116.265 24.790 -0.044 857 HD2 ARG 126 HD2 ARG 126 119.202 25.471 -0.308 858 HD3 ARG 126 HD1 ARG 126 118.147 26.193 0.903 859 HE ARG 126 HE ARG 126 117.887 23.396 1.064 860 HH11 ARG 126 HH11 ARG 126 118.978 22.292 2.717 861 HH12 ARG 126 HH12 ARG 126 120.342 23.029 3.490 862 HH21 ARG 126 HH21 ARG 126 120.234 25.895 1.543 863 HH22 ARG 126 HH22 ARG 126 121.063 25.060 2.813 864 H ASP 127 HN ASP 127 116.120 24.359 -4.834 865 HA ASP 127 HA ASP 127 115.669 27.002 -4.935 866 HB2 ASP 127 HB2 ASP 127 114.189 24.948 -6.597 867 HB3 ASP 127 HB1 ASP 127 114.437 26.634 -7.038 868 HA PRO 128 HA PRO 128 111.878 27.897 -2.821 869 HB2 PRO 128 HB2 PRO 128 111.018 30.144 -4.142 870 HB3 PRO 128 HB1 PRO 128 112.392 30.145 -3.016 871 HG2 PRO 128 HG2 PRO 128 112.404 29.983 -6.005 872 HG3 PRO 128 HG1 PRO 128 113.407 30.977 -4.930 873 HD2 PRO 128 HD2 PRO 128 114.352 28.683 -5.996 874 HD3 PRO 128 HD1 PRO 128 114.803 29.189 -4.355 875 H ALA 129 HN ALA 129 109.596 27.779 -3.006 876 HA ALA 129 HA ALA 129 107.596 27.061 -3.868 877 HB1 ALA 129 HB1 ALA 129 108.678 27.372 -6.659 878 HB2 ALA 129 HB2 ALA 129 108.287 28.788 -5.684 879 HB3 ALA 129 HB3 ALA 129 107.032 27.613 -6.072 880 HA PRO 130 HA PRO 130 109.854 22.983 -4.553 881 HB2 PRO 130 HB2 PRO 130 107.969 22.252 -2.344 882 HB3 PRO 130 HB1 PRO 130 109.684 21.838 -2.544 883 HG2 PRO 130 HG2 PRO 130 108.927 23.665 -0.776 884 HG3 PRO 130 HG1 PRO 130 110.405 23.883 -1.734 885 HD2 PRO 130 HD2 PRO 130 107.718 25.191 -2.097 886 HD3 PRO 130 HD1 PRO 130 109.346 25.881 -2.281 887 H ARG 131 HN ARG 131 106.535 24.054 -4.363 888 HA ARG 131 HA ARG 131 105.009 21.895 -5.008 889 HB2 ARG 131 HB2 ARG 131 104.800 24.545 -6.459 890 HB3 ARG 131 HB1 ARG 131 103.516 23.365 -6.226 891 HG2 ARG 131 HG2 ARG 131 104.928 24.679 -3.895 892 HG3 ARG 131 HG1 ARG 131 103.503 25.385 -4.651 893 HD2 ARG 131 HD2 ARG 131 102.288 23.231 -4.228 894 HD3 ARG 131 HD1 ARG 131 103.686 22.662 -3.325 895 HE ARG 131 HE ARG 131 101.825 24.776 -2.509 896 HH11 ARG 131 HH11 ARG 131 101.921 25.291 -0.310 897 HH12 ARG 131 HH12 ARG 131 103.221 24.689 0.664 898 HH21 ARG 131 HH21 ARG 131 104.757 23.005 -1.949 899 HH22 ARG 131 HH22 ARG 131 104.831 23.408 -0.266 900 H GLY 132 HN GLY 132 105.123 20.348 -6.485 901 HA2 GLY 132 HA2 GLY 132 105.283 20.640 -9.221 902 HA3 GLY 132 HA1 GLY 132 106.951 20.469 -8.682 903 HA PRO 133 HA PRO 133 105.002 16.346 -7.288 904 HB2 PRO 133 HB2 PRO 133 102.323 15.942 -7.588 905 HB3 PRO 133 HB1 PRO 133 103.004 16.769 -6.171 906 HG2 PRO 133 HG2 PRO 133 101.776 17.948 -8.633 907 HG3 PRO 133 HG1 PRO 133 101.521 18.387 -6.933 908 HD2 PRO 133 HD2 PRO 133 103.192 19.801 -8.561 909 HD3 PRO 133 HD1 PRO 133 103.497 19.625 -6.817 910 H ALA 134 HN ALA 134 104.890 14.427 -8.518 911 HA ALA 134 HA ALA 134 105.109 14.764 -11.357 912 HB1 ALA 134 HB1 ALA 134 105.017 12.298 -9.607 913 HB2 ALA 134 HB2 ALA 134 106.449 13.068 -10.292 914 HB3 ALA 134 HB3 ALA 134 105.291 12.258 -11.349 915 H ARG 135 HN ARG 135 103.584 14.576 -12.872 916 HA ARG 135 HA ARG 135 100.827 14.275 -12.126 917 HB2 ARG 135 HB2 ARG 135 100.439 14.426 -14.597 918 HB3 ARG 135 HB1 ARG 135 101.382 15.764 -13.944 919 HG2 ARG 135 HG2 ARG 135 103.462 14.677 -14.671 920 HG3 ARG 135 HG1 ARG 135 102.542 13.312 -15.305 921 HD2 ARG 135 HD2 ARG 135 101.354 14.848 -16.836 922 HD3 ARG 135 HD1 ARG 135 102.312 16.190 -16.225 923 HE ARG 135 HE ARG 135 103.235 14.041 -17.990 924 HH11 ARG 135 HH11 ARG 135 105.266 14.418 -18.939 925 HH12 ARG 135 HH12 ARG 135 106.249 15.729 -18.376 926 HH21 ARG 135 HH21 ARG 135 103.987 16.751 -15.962 927 HH22 ARG 135 HH22 ARG 135 105.523 17.050 -16.705 928 H PHE 136 HN PHE 136 99.527 12.541 -12.295 929 HA PHE 136 HA PHE 136 100.737 10.007 -13.272 930 HB2 PHE 136 HB2 PHE 136 99.139 10.681 -10.837 931 HB3 PHE 136 HB1 PHE 136 98.830 9.116 -11.587 932 HD1 PHE 136 HD1 PHE 136 101.203 11.108 -9.637 933 HD2 PHE 136 HD2 PHE 136 100.675 7.503 -11.909 934 HE1 PHE 136 HE1 PHE 136 103.235 10.142 -8.585 935 HE2 PHE 136 HE2 PHE 136 102.698 6.547 -10.870 936 HZ PHE 136 HZ PHE 136 103.981 7.856 -9.199 937 H LEU 137 HN LEU 137 99.490 8.593 -14.397 938 HA LEU 137 HA LEU 137 96.829 9.483 -15.325 939 HB2 LEU 137 HB2 LEU 137 99.166 8.532 -16.986 940 HB3 LEU 137 HB1 LEU 137 97.516 8.593 -17.600 941 HG LEU 137 HG LEU 137 98.559 11.087 -16.290 942 HD11 LEU 137 HD11 LEU 137 99.586 11.783 -18.484 943 HD12 LEU 137 HD12 LEU 137 99.492 10.098 -18.996 944 HD13 LEU 137 HD13 LEU 137 100.495 10.547 -17.616 945 HD21 LEU 137 HD21 LEU 137 96.253 10.797 -17.318 946 HD22 LEU 137 HD22 LEU 137 97.051 10.675 -18.886 947 HD23 LEU 137 HD23 LEU 137 97.180 12.162 -17.944 948 HA PRO 138 HA PRO 138 96.496 5.135 -14.011 949 HB2 PRO 138 HB2 PRO 138 93.805 4.950 -13.783 950 HB3 PRO 138 HB1 PRO 138 94.791 5.825 -12.593 951 HG2 PRO 138 HG2 PRO 138 93.184 6.904 -14.872 952 HG3 PRO 138 HG1 PRO 138 93.314 7.502 -13.207 953 HD2 PRO 138 HD2 PRO 138 94.721 8.585 -15.312 954 HD3 PRO 138 HD1 PRO 138 95.298 8.633 -13.630 955 H LEU 139 HN LEU 139 96.338 3.265 -15.169 956 HA LEU 139 HA LEU 139 95.156 3.411 -17.879 957 HB2 LEU 139 HB2 LEU 139 97.021 1.199 -17.084 958 HB3 LEU 139 HB1 LEU 139 96.781 1.945 -18.657 959 HG LEU 139 HG LEU 139 98.121 3.305 -16.298 960 HD11 LEU 139 HD11 LEU 139 99.344 2.156 -18.822 961 HD12 LEU 139 HD12 LEU 139 99.405 1.377 -17.242 962 HD13 LEU 139 HD13 LEU 139 100.203 2.930 -17.490 963 HD21 LEU 139 HD21 LEU 139 97.686 4.048 -19.200 964 HD22 LEU 139 HD22 LEU 139 98.825 4.882 -18.144 965 HD23 LEU 139 HD23 LEU 139 97.103 4.910 -17.778 966 HA PRO 140 HA PRO 140 91.995 0.525 -16.499 967 HB2 PRO 140 HB2 PRO 140 92.379 -0.886 -19.109 968 HB3 PRO 140 HB1 PRO 140 90.890 -0.248 -18.382 969 HG2 PRO 140 HG2 PRO 140 92.108 0.978 -20.431 970 HG3 PRO 140 HG1 PRO 140 91.267 1.883 -19.159 971 HD2 PRO 140 HD2 PRO 140 94.209 1.562 -19.607 972 HD3 PRO 140 HD1 PRO 140 93.304 2.917 -18.898 973 H GLY 141 HN GLY 141 92.219 -1.271 -15.211 974 HA2 GLY 141 HA2 GLY 141 94.603 -2.620 -14.819 975 HA3 GLY 141 HA1 GLY 141 93.026 -3.264 -14.375 Start of MODEL 10 1 H1 GLY 13 HT1 GLY 13 80.531 0.225 -10.718 2 H2 GLY 13 HT2 GLY 13 80.592 1.646 -11.649 3 H3 GLY 13 HT3 GLY 13 80.612 1.737 -9.953 4 HA2 GLY 13 HA2 GLY 13 82.722 0.114 -11.064 5 HA3 GLY 13 HA1 GLY 13 82.801 1.818 -11.511 6 H GLN 14 HN GLN 14 81.920 -0.051 -8.594 7 HA GLN 14 HA GLN 14 82.771 1.930 -6.761 8 HB2 GLN 14 HB2 GLN 14 81.194 0.122 -6.175 9 HB3 GLN 14 HB1 GLN 14 82.494 -1.057 -6.345 10 HG2 GLN 14 HG2 GLN 14 83.759 0.089 -4.546 11 HG3 GLN 14 HG1 GLN 14 82.442 1.246 -4.373 12 HE21 GLN 14 HE21 GLN 14 83.517 -0.890 -2.457 13 HE22 GLN 14 HE22 GLN 14 82.146 -1.798 -2.033 14 H VAL 15 HN VAL 15 84.366 -0.911 -8.140 15 HA VAL 15 HA VAL 15 86.954 0.120 -7.145 16 HB VAL 15 HB VAL 15 86.512 -1.710 -5.715 17 HG11 VAL 15 HG11 VAL 15 85.712 -3.256 -8.197 18 HG12 VAL 15 HG12 VAL 15 84.614 -2.653 -6.955 19 HG13 VAL 15 HG13 VAL 15 85.781 -3.915 -6.562 20 HG21 VAL 15 HG21 VAL 15 88.272 -3.247 -6.230 21 HG22 VAL 15 HG22 VAL 15 88.764 -1.702 -6.923 22 HG23 VAL 15 HG23 VAL 15 88.104 -2.964 -7.962 23 H ARG 16 HN ARG 16 88.590 0.121 -8.528 24 HA ARG 16 HA ARG 16 88.319 -1.258 -11.127 25 HB2 ARG 16 HB2 ARG 16 88.909 1.684 -10.738 26 HB3 ARG 16 HB1 ARG 16 89.140 0.818 -12.257 27 HG2 ARG 16 HG2 ARG 16 86.766 0.247 -12.336 28 HG3 ARG 16 HG1 ARG 16 86.507 1.006 -10.764 29 HD2 ARG 16 HD2 ARG 16 85.831 2.549 -12.531 30 HD3 ARG 16 HD1 ARG 16 87.260 3.175 -11.713 31 HE ARG 16 HE ARG 16 88.042 1.617 -13.953 32 HH11 ARG 16 HH11 ARG 16 88.747 2.713 -15.812 33 HH12 ARG 16 HH12 ARG 16 88.328 4.377 -16.042 34 HH21 ARG 16 HH21 ARG 16 86.545 4.610 -13.076 35 HH22 ARG 16 HH22 ARG 16 87.085 5.454 -14.490 36 H GLN 17 HN GLN 17 90.282 -1.630 -12.203 37 HA GLN 17 HA GLN 17 92.690 -1.511 -10.477 38 HB2 GLN 17 HB2 GLN 17 93.409 -3.355 -12.216 39 HB3 GLN 17 HB1 GLN 17 92.332 -3.784 -10.892 40 HG2 GLN 17 HG2 GLN 17 90.402 -3.517 -12.354 41 HG3 GLN 17 HG1 GLN 17 91.447 -2.976 -13.665 42 HE21 GLN 17 HE21 GLN 17 93.564 -5.012 -12.897 43 HE22 GLN 17 HE22 GLN 17 92.958 -6.495 -13.455 44 H ARG 18 HN ARG 18 94.147 0.020 -11.085 45 HA ARG 18 HA ARG 18 94.643 0.432 -13.957 46 HB2 ARG 18 HB2 ARG 18 94.103 2.771 -12.124 47 HB3 ARG 18 HB1 ARG 18 94.314 2.796 -13.873 48 HG2 ARG 18 HG2 ARG 18 92.249 1.374 -14.072 49 HG3 ARG 18 HG1 ARG 18 92.007 1.575 -12.338 50 HD2 ARG 18 HD2 ARG 18 92.207 3.849 -14.329 51 HD3 ARG 18 HD1 ARG 18 90.700 3.220 -13.667 52 HE ARG 18 HE ARG 18 92.396 3.904 -11.525 53 HH11 ARG 18 HH11 ARG 18 92.115 5.892 -10.465 54 HH12 ARG 18 HH12 ARG 18 91.227 7.161 -11.238 55 HH21 ARG 18 HH21 ARG 18 90.611 5.334 -14.121 56 HH22 ARG 18 HH22 ARG 18 90.385 6.850 -13.315 57 H TYR 19 HN TYR 19 96.568 1.671 -14.401 58 HA TYR 19 HA TYR 19 98.656 1.333 -12.328 59 HB2 TYR 19 HB2 TYR 19 98.813 1.899 -15.307 60 HB3 TYR 19 HB1 TYR 19 100.208 1.812 -14.240 61 HD1 TYR 19 HD1 TYR 19 97.298 -0.153 -15.503 62 HD2 TYR 19 HD2 TYR 19 101.174 -0.273 -13.649 63 HE1 TYR 19 HE1 TYR 19 97.354 -2.618 -15.771 64 HE2 TYR 19 HE2 TYR 19 101.226 -2.736 -13.916 65 HH TYR 19 HH TYR 19 99.890 -4.568 -14.325 66 H LEU 20 HN LEU 20 99.581 3.132 -11.377 67 HA LEU 20 HA LEU 20 98.486 5.749 -12.143 68 HB2 LEU 20 HB2 LEU 20 98.995 4.594 -9.689 69 HB3 LEU 20 HB1 LEU 20 100.422 5.605 -9.892 70 HG LEU 20 HG LEU 20 98.714 7.473 -10.545 71 HD11 LEU 20 HD11 LEU 20 96.481 7.235 -9.865 72 HD12 LEU 20 HD12 LEU 20 96.840 5.863 -8.820 73 HD13 LEU 20 HD13 LEU 20 96.831 5.659 -10.569 74 HD21 LEU 20 HD21 LEU 20 99.058 6.379 -7.741 75 HD22 LEU 20 HD22 LEU 20 98.294 7.934 -8.071 76 HD23 LEU 20 HD23 LEU 20 99.980 7.669 -8.514 77 H TYR 21 HN TYR 21 99.503 6.901 -13.619 78 HA TYR 21 HA TYR 21 102.475 6.768 -13.770 79 HB2 TYR 21 HB2 TYR 21 101.760 5.679 -15.719 80 HB3 TYR 21 HB1 TYR 21 100.372 6.741 -15.923 81 HD1 TYR 21 HD1 TYR 21 104.115 7.025 -15.675 82 HD2 TYR 21 HD2 TYR 21 100.523 8.326 -17.637 83 HE1 TYR 21 HE1 TYR 21 105.456 8.475 -17.174 84 HE2 TYR 21 HE2 TYR 21 101.865 9.767 -19.139 85 HH TYR 21 HH TYR 21 104.282 9.783 -19.996 86 H THR 22 HN THR 22 103.570 8.629 -13.793 87 HA THR 22 HA THR 22 102.117 11.183 -14.146 88 HB THR 22 HB THR 22 102.402 10.975 -11.767 89 HG1 THR 22 HG1 THR 22 104.603 12.488 -12.024 90 HG21 THR 22 HG21 THR 22 104.587 10.489 -10.780 91 HG22 THR 22 HG22 THR 22 105.296 10.371 -12.392 92 HG23 THR 22 HG23 THR 22 104.101 9.187 -11.864 93 H SER 23 HN SER 23 103.548 12.980 -14.709 94 HA SER 23 HA SER 23 105.926 12.055 -16.232 95 HB2 SER 23 HB2 SER 23 105.528 13.860 -17.762 96 HB3 SER 23 HB1 SER 23 104.004 13.003 -17.549 97 HG SER 23 HG SER 23 103.393 15.023 -17.183 98 H GLY 24 HN GLY 24 107.840 13.064 -15.970 99 HA2 GLY 24 HA2 GLY 24 108.131 15.585 -14.620 100 HA3 GLY 24 HA1 GLY 24 108.625 14.224 -13.618 101 HA PRO 25 HA PRO 25 112.515 14.185 -15.705 102 HB2 PRO 25 HB2 PRO 25 113.212 11.565 -15.670 103 HB3 PRO 25 HB1 PRO 25 113.079 12.519 -14.177 104 HG2 PRO 25 HG2 PRO 25 111.090 10.639 -15.392 105 HG3 PRO 25 HG1 PRO 25 111.625 10.766 -13.705 106 HD2 PRO 25 HD2 PRO 25 109.297 11.898 -14.582 107 HD3 PRO 25 HD1 PRO 25 110.268 12.609 -13.270 108 H HIS 26 HN HIS 26 113.617 13.624 -17.694 109 HA HIS 26 HA HIS 26 112.094 12.131 -19.713 110 HB2 HIS 26 HB2 HIS 26 112.528 14.068 -21.339 111 HB3 HIS 26 HB1 HIS 26 111.233 14.288 -20.163 112 HD2 HIS 26 HD2 HIS 26 111.487 16.964 -19.493 113 HE1 HIS 26 HE1 HIS 26 115.643 16.984 -18.757 114 HE2 HIS 26 HE2 HIS 26 113.520 18.371 -18.654 115 H GLY 27 HN GLY 27 113.358 11.605 -21.594 116 HA2 GLY 27 HA2 GLY 27 115.368 11.334 -22.794 117 HA3 GLY 27 HA1 GLY 27 116.254 12.053 -21.451 118 H LEU 28 HN LEU 28 114.095 9.893 -20.170 119 HA LEU 28 HA LEU 28 116.011 7.627 -20.256 120 HB2 LEU 28 HB2 LEU 28 114.622 8.918 -17.920 121 HB3 LEU 28 HB1 LEU 28 115.071 7.216 -17.841 122 HG LEU 28 HG LEU 28 117.122 9.270 -18.681 123 HD11 LEU 28 HD11 LEU 28 116.213 10.135 -16.582 124 HD12 LEU 28 HD12 LEU 28 117.801 9.427 -16.283 125 HD13 LEU 28 HD13 LEU 28 116.342 8.539 -15.841 126 HD21 LEU 28 HD21 LEU 28 117.228 6.584 -17.253 127 HD22 LEU 28 HD22 LEU 28 118.634 7.596 -17.578 128 HD23 LEU 28 HD23 LEU 28 117.723 6.903 -18.915 129 H SER 29 HN SER 29 113.034 7.742 -18.441 130 HA SER 29 HA SER 29 111.485 6.337 -20.445 131 HB2 SER 29 HB2 SER 29 112.814 4.486 -19.651 132 HB3 SER 29 HB1 SER 29 112.512 4.933 -17.974 133 HG SER 29 HG SER 29 110.878 3.662 -19.830 134 H SER 30 HN SER 30 109.327 5.676 -19.532 135 HA SER 30 HA SER 30 108.199 7.864 -18.095 136 HB2 SER 30 HB2 SER 30 106.735 6.883 -19.641 137 HB3 SER 30 HB1 SER 30 107.148 5.249 -19.130 138 HG SER 30 HG SER 30 106.195 5.915 -17.046 139 H CYS 31 HN CYS 31 107.782 8.109 -15.970 140 HA CYS 31 HA CYS 31 108.706 5.999 -14.159 141 HB2 CYS 31 HB2 CYS 31 108.408 8.912 -14.048 142 HB3 CYS 31 HB1 CYS 31 107.786 8.142 -12.595 143 H HIS 32 HN HIS 32 107.343 4.525 -13.439 144 HA HIS 32 HA HIS 32 104.460 5.189 -13.157 145 HB2 HIS 32 HB2 HIS 32 105.813 2.526 -13.678 146 HB3 HIS 32 HB1 HIS 32 104.084 2.747 -13.406 147 HD2 HIS 32 HD2 HIS 32 106.753 3.495 -16.197 148 HE1 HIS 32 HE1 HIS 32 102.934 4.400 -17.753 149 HE2 HIS 32 HE2 HIS 32 105.398 4.172 -18.324 150 H LEU 33 HN LEU 33 103.678 5.175 -11.134 151 HA LEU 33 HA LEU 33 105.291 4.900 -8.879 152 HB2 LEU 33 HB2 LEU 33 102.856 5.898 -9.209 153 HB3 LEU 33 HB1 LEU 33 102.347 4.293 -8.697 154 HG LEU 33 HG LEU 33 104.161 6.183 -7.162 155 HD11 LEU 33 HD11 LEU 33 101.876 6.890 -6.984 156 HD12 LEU 33 HD12 LEU 33 102.249 6.020 -5.497 157 HD13 LEU 33 HD13 LEU 33 101.314 5.231 -6.767 158 HD21 LEU 33 HD21 LEU 33 104.978 4.072 -6.579 159 HD22 LEU 33 HD22 LEU 33 103.396 3.302 -6.726 160 HD23 LEU 33 HD23 LEU 33 103.747 4.345 -5.349 161 H GLU 34 HN GLU 34 106.123 3.176 -7.914 162 HA GLU 34 HA GLU 34 104.863 0.517 -8.298 163 HB2 GLU 34 HB2 GLU 34 106.848 0.825 -9.748 164 HB3 GLU 34 HB1 GLU 34 107.821 1.165 -8.321 165 HG2 GLU 34 HG2 GLU 34 107.250 -1.086 -7.429 166 HG3 GLU 34 HG1 GLU 34 106.348 -1.415 -8.908 167 H ILE 35 HN ILE 35 104.604 -0.641 -6.465 168 HA ILE 35 HA ILE 35 105.816 0.437 -3.974 169 HB ILE 35 HB ILE 35 103.408 -1.369 -4.314 170 HG12 ILE 35 HG12 ILE 35 103.604 1.546 -3.484 171 HG13 ILE 35 HG11 ILE 35 103.106 0.997 -5.085 172 HG21 ILE 35 HG21 ILE 35 104.530 -1.808 -2.205 173 HG22 ILE 35 HG22 ILE 35 103.110 -0.824 -1.863 174 HG23 ILE 35 HG23 ILE 35 104.710 -0.083 -1.890 175 HD11 ILE 35 HD11 ILE 35 101.707 0.524 -2.447 176 HD12 ILE 35 HD12 ILE 35 101.305 -0.376 -3.910 177 HD13 ILE 35 HD13 ILE 35 101.086 1.372 -3.864 178 H ARG 36 HN ARG 36 107.376 -0.654 -3.053 179 HA ARG 36 HA ARG 36 108.180 -3.247 -4.054 180 HB2 ARG 36 HB2 ARG 36 109.287 -1.185 -2.204 181 HB3 ARG 36 HB1 ARG 36 109.885 -2.829 -2.015 182 HG2 ARG 36 HG2 ARG 36 111.388 -1.791 -3.530 183 HG3 ARG 36 HG1 ARG 36 110.349 -2.778 -4.550 184 HD2 ARG 36 HD2 ARG 36 109.000 -0.824 -5.125 185 HD3 ARG 36 HD1 ARG 36 109.927 0.176 -4.008 186 HE ARG 36 HE ARG 36 111.776 -0.925 -5.762 187 HH11 ARG 36 HH11 ARG 36 112.480 0.226 -7.586 188 HH12 ARG 36 HH12 ARG 36 111.478 1.468 -8.260 189 HH21 ARG 36 HH21 ARG 36 108.950 1.064 -5.922 190 HH22 ARG 36 HH22 ARG 36 109.479 1.939 -7.319 191 H GLU 37 HN GLU 37 108.568 -5.069 -2.709 192 HA GLU 37 HA GLU 37 106.363 -5.777 -1.063 193 HB2 GLU 37 HB2 GLU 37 107.682 -7.403 -2.421 194 HB3 GLU 37 HB1 GLU 37 109.058 -7.137 -1.351 195 HG2 GLU 37 HG2 GLU 37 107.724 -7.907 0.567 196 HG3 GLU 37 HG1 GLU 37 106.342 -8.164 -0.497 197 H ASP 38 HN ASP 38 109.535 -4.479 -0.574 198 HA ASP 38 HA ASP 38 109.749 -4.994 2.223 199 HB2 ASP 38 HB2 ASP 38 111.114 -2.999 0.405 200 HB3 ASP 38 HB1 ASP 38 111.533 -3.227 2.102 201 H GLY 39 HN GLY 39 107.738 -3.019 0.456 202 HA2 GLY 39 HA2 GLY 39 106.043 -1.654 1.346 203 HA3 GLY 39 HA1 GLY 39 106.958 -1.512 2.844 204 H THR 40 HN THR 40 108.925 -1.062 0.117 205 HA THR 40 HA THR 40 109.093 1.811 0.681 206 HB THR 40 HB THR 40 110.914 1.376 -1.329 207 HG1 THR 40 HG1 THR 40 111.327 -0.923 0.106 208 HG21 THR 40 HG21 THR 40 111.211 0.844 1.640 209 HG22 THR 40 HG22 THR 40 111.522 2.358 0.790 210 HG23 THR 40 HG23 THR 40 112.573 0.967 0.526 211 H VAL 41 HN VAL 41 108.935 3.406 -0.998 212 HA VAL 41 HA VAL 41 107.190 2.595 -3.265 213 HB VAL 41 HB VAL 41 107.045 5.051 -1.504 214 HG11 VAL 41 HG11 VAL 41 105.012 5.525 -3.033 215 HG12 VAL 41 HG12 VAL 41 105.775 4.413 -4.170 216 HG13 VAL 41 HG13 VAL 41 106.613 5.884 -3.679 217 HG21 VAL 41 HG21 VAL 41 104.902 3.016 -2.158 218 HG22 VAL 41 HG22 VAL 41 104.911 4.203 -0.854 219 HG23 VAL 41 HG23 VAL 41 105.998 2.817 -0.790 220 H GLY 42 HN GLY 42 107.694 3.342 -5.236 221 HA2 GLY 42 HA2 GLY 42 109.319 5.643 -5.735 222 HA3 GLY 42 HA1 GLY 42 110.234 4.149 -5.948 223 H CYS 43 HN CYS 43 110.017 5.578 -8.181 224 HA CYS 43 HA CYS 43 107.629 4.761 -9.654 225 HB2 CYS 43 HB2 CYS 43 108.026 6.633 -10.864 226 HB3 CYS 43 HB1 CYS 43 109.378 6.973 -9.795 227 H ALA 44 HN ALA 44 107.851 3.744 -11.797 228 HA ALA 44 HA ALA 44 110.182 1.925 -12.025 229 HB1 ALA 44 HB1 ALA 44 108.592 0.421 -11.209 230 HB2 ALA 44 HB2 ALA 44 108.373 0.261 -12.949 231 HB3 ALA 44 HB3 ALA 44 107.253 1.244 -12.006 232 H ALA 45 HN ALA 45 110.873 1.525 -14.083 233 HA ALA 45 HA ALA 45 109.614 3.130 -16.240 234 HB1 ALA 45 HB1 ALA 45 112.451 2.303 -15.670 235 HB2 ALA 45 HB2 ALA 45 111.803 3.920 -15.949 236 HB3 ALA 45 HB3 ALA 45 111.955 2.784 -17.292 237 H ASP 46 HN ASP 46 110.044 -0.045 -15.144 238 HA ASP 46 HA ASP 46 109.977 -1.207 -17.851 239 HB2 ASP 46 HB2 ASP 46 110.241 -2.558 -15.158 240 HB3 ASP 46 HB1 ASP 46 110.370 -3.344 -16.730 241 H GLN 47 HN GLN 47 107.823 -0.054 -15.680 242 HA GLN 47 HA GLN 47 105.612 -0.504 -15.147 243 HB2 GLN 47 HB2 GLN 47 105.798 -1.194 -18.081 244 HB3 GLN 47 HB1 GLN 47 104.269 -1.067 -17.209 245 HG2 GLN 47 HG2 GLN 47 104.773 1.248 -16.608 246 HG3 GLN 47 HG1 GLN 47 106.343 1.135 -17.400 247 HE21 GLN 47 HE21 GLN 47 103.237 2.252 -17.905 248 HE22 GLN 47 HE22 GLN 47 103.201 2.190 -19.601 249 H SER 48 HN SER 48 105.649 -2.179 -13.678 250 HA SER 48 HA SER 48 105.194 -4.895 -14.784 251 HB2 SER 48 HB2 SER 48 106.347 -4.729 -12.055 252 HB3 SER 48 HB1 SER 48 106.765 -5.803 -13.388 253 HG SER 48 HG SER 48 107.736 -3.290 -12.720 254 HA PRO 49 HA PRO 49 101.499 -5.405 -12.435 255 HB2 PRO 49 HB2 PRO 49 102.778 -7.349 -10.544 256 HB3 PRO 49 HB1 PRO 49 101.312 -7.532 -11.529 257 HG2 PRO 49 HG2 PRO 49 103.559 -8.739 -12.231 258 HG3 PRO 49 HG1 PRO 49 102.511 -7.999 -13.457 259 HD2 PRO 49 HD2 PRO 49 105.094 -6.973 -12.318 260 HD3 PRO 49 HD1 PRO 49 104.490 -6.895 -13.988 261 H GLU 50 HN GLU 50 104.333 -5.157 -10.320 262 HA GLU 50 HA GLU 50 103.025 -4.390 -7.971 263 HB2 GLU 50 HB2 GLU 50 105.351 -3.098 -7.624 264 HB3 GLU 50 HB1 GLU 50 105.234 -4.851 -7.517 265 HG2 GLU 50 HG2 GLU 50 106.006 -5.124 -9.776 266 HG3 GLU 50 HG1 GLU 50 105.910 -3.390 -10.081 267 H SER 51 HN SER 51 103.466 -2.625 -10.891 268 HA SER 51 HA SER 51 103.028 -0.037 -9.635 269 HB2 SER 51 HB2 SER 51 103.469 -0.971 -12.462 270 HB3 SER 51 HB1 SER 51 102.865 0.650 -12.141 271 HG SER 51 HG SER 51 104.791 0.391 -10.482 272 H LEU 52 HN LEU 52 101.175 -2.645 -10.409 273 HA LEU 52 HA LEU 52 98.824 -1.200 -11.365 274 HB2 LEU 52 HB2 LEU 52 99.664 -3.610 -12.015 275 HB3 LEU 52 HB1 LEU 52 98.866 -4.095 -10.523 276 HG LEU 52 HG LEU 52 97.597 -2.686 -12.881 277 HD11 LEU 52 HD11 LEU 52 97.846 -5.021 -13.330 278 HD12 LEU 52 HD12 LEU 52 96.171 -4.793 -12.829 279 HD13 LEU 52 HD13 LEU 52 97.349 -5.454 -11.695 280 HD21 LEU 52 HD21 LEU 52 96.554 -3.310 -10.122 281 HD22 LEU 52 HD22 LEU 52 95.481 -3.095 -11.500 282 HD23 LEU 52 HD23 LEU 52 96.516 -1.774 -10.986 283 H LEU 53 HN LEU 53 97.566 -0.181 -9.925 284 HA LEU 53 HA LEU 53 97.392 -1.243 -7.154 285 HB2 LEU 53 HB2 LEU 53 96.944 1.592 -8.102 286 HB3 LEU 53 HB1 LEU 53 96.962 1.023 -6.434 287 HG LEU 53 HG LEU 53 99.318 0.876 -8.340 288 HD11 LEU 53 HD11 LEU 53 98.933 3.179 -7.799 289 HD12 LEU 53 HD12 LEU 53 100.244 2.634 -6.753 290 HD13 LEU 53 HD13 LEU 53 98.610 2.794 -6.108 291 HD21 LEU 53 HD21 LEU 53 99.668 -0.840 -6.777 292 HD22 LEU 53 HD22 LEU 53 98.859 0.035 -5.477 293 HD23 LEU 53 HD23 LEU 53 100.471 0.521 -6.001 294 H GLN 54 HN GLN 54 95.474 -1.917 -6.466 295 HA GLN 54 HA GLN 54 93.151 -1.673 -8.190 296 HB2 GLN 54 HB2 GLN 54 93.688 -3.025 -5.548 297 HB3 GLN 54 HB1 GLN 54 92.039 -2.855 -6.156 298 HG2 GLN 54 HG2 GLN 54 92.656 -4.008 -8.226 299 HG3 GLN 54 HG1 GLN 54 94.324 -4.135 -7.678 300 HE21 GLN 54 HE21 GLN 54 93.181 -4.622 -4.821 301 HE22 GLN 54 HE22 GLN 54 92.747 -6.262 -4.853 302 H LEU 55 HN LEU 55 91.937 0.076 -8.209 303 HA LEU 55 HA LEU 55 91.977 1.940 -5.954 304 HB2 LEU 55 HB2 LEU 55 92.279 2.797 -8.232 305 HB3 LEU 55 HB1 LEU 55 90.720 2.129 -8.706 306 HG LEU 55 HG LEU 55 90.640 3.900 -6.302 307 HD11 LEU 55 HD11 LEU 55 92.293 5.090 -7.726 308 HD12 LEU 55 HD12 LEU 55 90.772 5.975 -7.604 309 HD13 LEU 55 HD13 LEU 55 91.144 5.055 -9.064 310 HD21 LEU 55 HD21 LEU 55 88.636 2.910 -7.524 311 HD22 LEU 55 HD22 LEU 55 89.026 3.977 -8.868 312 HD23 LEU 55 HD23 LEU 55 88.583 4.657 -7.303 313 H LYS 56 HN LYS 56 90.455 1.935 -4.445 314 HA LYS 56 HA LYS 56 87.804 0.735 -5.072 315 HB2 LYS 56 HB2 LYS 56 89.365 0.685 -2.479 316 HB3 LYS 56 HB1 LYS 56 87.695 0.145 -2.656 317 HG2 LYS 56 HG2 LYS 56 88.376 -1.538 -4.298 318 HG3 LYS 56 HG1 LYS 56 90.039 -0.961 -4.232 319 HD2 LYS 56 HD2 LYS 56 90.077 -2.819 -2.793 320 HD3 LYS 56 HD1 LYS 56 89.880 -1.469 -1.679 321 HE2 LYS 56 HE2 LYS 56 87.473 -1.872 -1.556 322 HE3 LYS 56 HE1 LYS 56 87.594 -3.138 -2.778 323 HZ1 LYS 56 HZ1 LYS 56 88.926 -3.172 -0.122 324 HZ2 LYS 56 HZ2 LYS 56 89.003 -4.401 -1.293 325 HZ3 LYS 56 HZ3 LYS 56 87.527 -4.042 -0.531 326 H ALA 57 HN ALA 57 86.025 1.870 -4.550 327 HA ALA 57 HA ALA 57 86.427 4.649 -3.690 328 HB1 ALA 57 HB1 ALA 57 85.154 4.384 -5.708 329 HB2 ALA 57 HB2 ALA 57 84.037 4.882 -4.436 330 HB3 ALA 57 HB3 ALA 57 84.098 3.193 -4.946 331 H LEU 58 HN LEU 58 86.565 4.691 -1.507 332 HA LEU 58 HA LEU 58 84.952 3.095 0.241 333 HB2 LEU 58 HB2 LEU 58 86.306 5.720 0.883 334 HB3 LEU 58 HB1 LEU 58 85.841 4.455 2.016 335 HG LEU 58 HG LEU 58 87.926 4.196 -0.170 336 HD11 LEU 58 HD11 LEU 58 88.986 5.457 1.474 337 HD12 LEU 58 HD12 LEU 58 89.337 3.829 2.045 338 HD13 LEU 58 HD13 LEU 58 88.035 4.760 2.784 339 HD21 LEU 58 HD21 LEU 58 88.394 2.033 1.206 340 HD22 LEU 58 HD22 LEU 58 87.024 2.028 0.099 341 HD23 LEU 58 HD23 LEU 58 86.758 2.250 1.829 342 H LYS 59 HN LYS 59 84.818 6.387 -0.961 343 HA LYS 59 HA LYS 59 81.962 6.577 -0.481 344 HB2 LYS 59 HB2 LYS 59 82.556 7.343 1.644 345 HB3 LYS 59 HB1 LYS 59 84.100 7.965 1.076 346 HG2 LYS 59 HG2 LYS 59 83.072 9.907 0.120 347 HG3 LYS 59 HG1 LYS 59 81.456 9.240 0.348 348 HD2 LYS 59 HD2 LYS 59 81.988 10.897 2.095 349 HD3 LYS 59 HD1 LYS 59 81.763 9.290 2.779 350 HE2 LYS 59 HE2 LYS 59 84.070 8.988 3.150 351 HE3 LYS 59 HE1 LYS 59 84.513 10.259 2.008 352 HZ1 LYS 59 HZ1 LYS 59 84.788 11.079 4.216 353 HZ2 LYS 59 HZ2 LYS 59 83.218 10.605 4.656 354 HZ3 LYS 59 HZ3 LYS 59 83.446 11.862 3.536 355 HA PRO 60 HA PRO 60 82.405 8.720 -4.423 356 HB2 PRO 60 HB2 PRO 60 80.422 10.598 -3.155 357 HB3 PRO 60 HB1 PRO 60 80.429 9.913 -4.793 358 HG2 PRO 60 HG2 PRO 60 78.846 8.929 -2.868 359 HG3 PRO 60 HG1 PRO 60 79.582 7.886 -4.098 360 HD2 PRO 60 HD2 PRO 60 80.229 8.093 -1.210 361 HD3 PRO 60 HD1 PRO 60 80.562 6.767 -2.342 362 H GLY 61 HN GLY 61 84.307 9.768 -4.613 363 HA2 GLY 61 HA2 GLY 61 85.429 11.897 -4.752 364 HA3 GLY 61 HA1 GLY 61 84.674 12.363 -3.233 365 H VAL 62 HN VAL 62 85.319 9.505 -2.237 366 HA VAL 62 HA VAL 62 88.201 9.954 -1.660 367 HB VAL 62 HB VAL 62 86.007 8.875 0.122 368 HG11 VAL 62 HG11 VAL 62 89.014 8.921 0.477 369 HG12 VAL 62 HG12 VAL 62 87.945 7.520 0.547 370 HG13 VAL 62 HG13 VAL 62 87.891 8.734 1.824 371 HG21 VAL 62 HG21 VAL 62 86.018 11.272 0.112 372 HG22 VAL 62 HG22 VAL 62 87.780 11.327 0.195 373 HG23 VAL 62 HG23 VAL 62 86.847 10.774 1.586 374 H ILE 63 HN ILE 63 89.527 8.313 -2.185 375 HA ILE 63 HA ILE 63 88.366 5.624 -2.654 376 HB ILE 63 HB ILE 63 89.723 5.387 -4.650 377 HG12 ILE 63 HG12 ILE 63 90.649 7.899 -5.371 378 HG13 ILE 63 HG11 ILE 63 90.941 7.920 -3.636 379 HG21 ILE 63 HG21 ILE 63 88.516 6.961 -6.076 380 HG22 ILE 63 HG22 ILE 63 88.172 7.988 -4.685 381 HG23 ILE 63 HG23 ILE 63 87.453 6.387 -4.793 382 HD11 ILE 63 HD11 ILE 63 92.880 7.058 -4.958 383 HD12 ILE 63 HD12 ILE 63 91.874 5.719 -5.504 384 HD13 ILE 63 HD13 ILE 63 92.273 5.881 -3.796 385 H GLN 64 HN GLN 64 90.054 3.939 -2.834 386 HA GLN 64 HA GLN 64 92.443 4.465 -1.162 387 HB2 GLN 64 HB2 GLN 64 90.679 3.375 0.211 388 HB3 GLN 64 HB1 GLN 64 90.644 2.037 -0.936 389 HG2 GLN 64 HG2 GLN 64 92.975 1.523 -0.477 390 HG3 GLN 64 HG1 GLN 64 93.119 2.942 0.559 391 HE21 GLN 64 HE21 GLN 64 93.671 0.363 1.607 392 HE22 GLN 64 HE22 GLN 64 92.462 -0.043 2.726 393 H ILE 65 HN ILE 65 94.255 3.230 -1.711 394 HA ILE 65 HA ILE 65 94.036 1.690 -4.240 395 HB ILE 65 HB ILE 65 96.534 2.474 -4.439 396 HG12 ILE 65 HG12 ILE 65 95.354 4.601 -2.614 397 HG13 ILE 65 HG11 ILE 65 96.601 3.448 -2.146 398 HG21 ILE 65 HG21 ILE 65 94.688 3.145 -5.948 399 HG22 ILE 65 HG22 ILE 65 95.790 4.487 -5.640 400 HG23 ILE 65 HG23 ILE 65 94.232 4.417 -4.815 401 HD11 ILE 65 HD11 ILE 65 96.773 5.814 -3.971 402 HD12 ILE 65 HD12 ILE 65 97.829 4.437 -4.297 403 HD13 ILE 65 HD13 ILE 65 97.910 5.266 -2.744 404 H LEU 66 HN LEU 66 94.779 -0.302 -4.271 405 HA LEU 66 HA LEU 66 96.540 -1.267 -2.097 406 HB2 LEU 66 HB2 LEU 66 94.275 -1.884 -1.530 407 HB3 LEU 66 HB1 LEU 66 93.973 -2.487 -3.146 408 HG LEU 66 HG LEU 66 94.432 -4.206 -1.299 409 HD11 LEU 66 HD11 LEU 66 96.447 -4.721 -3.420 410 HD12 LEU 66 HD12 LEU 66 94.808 -4.413 -3.968 411 HD13 LEU 66 HD13 LEU 66 95.131 -5.727 -2.846 412 HD21 LEU 66 HD21 LEU 66 97.322 -3.478 -1.774 413 HD22 LEU 66 HD22 LEU 66 96.659 -4.585 -0.574 414 HD23 LEU 66 HD23 LEU 66 96.404 -2.851 -0.406 415 H GLY 67 HN GLY 67 98.349 -2.051 -2.963 416 HA2 GLY 67 HA2 GLY 67 98.611 -2.642 -5.763 417 HA3 GLY 67 HA1 GLY 67 99.856 -2.838 -4.541 418 H VAL 68 HN VAL 68 98.184 -4.491 -6.758 419 HA VAL 68 HA VAL 68 97.234 -6.775 -5.398 420 HB VAL 68 HB VAL 68 97.136 -7.805 -7.576 421 HG11 VAL 68 HG11 VAL 68 95.475 -6.080 -7.095 422 HG12 VAL 68 HG12 VAL 68 95.924 -6.005 -8.798 423 HG13 VAL 68 HG13 VAL 68 96.576 -4.823 -7.661 424 HG21 VAL 68 HG21 VAL 68 99.266 -7.333 -8.527 425 HG22 VAL 68 HG22 VAL 68 99.066 -5.595 -8.304 426 HG23 VAL 68 HG23 VAL 68 98.119 -6.443 -9.529 427 H LYS 69 HN LYS 69 100.388 -6.144 -6.937 428 HA LYS 69 HA LYS 69 101.419 -8.738 -6.577 429 HB2 LYS 69 HB2 LYS 69 102.327 -6.828 -8.029 430 HB3 LYS 69 HB1 LYS 69 103.086 -6.225 -6.561 431 HG2 LYS 69 HG2 LYS 69 103.542 -9.117 -7.259 432 HG3 LYS 69 HG1 LYS 69 104.370 -7.904 -8.226 433 HD2 LYS 69 HD2 LYS 69 105.313 -6.908 -6.161 434 HD3 LYS 69 HD1 LYS 69 104.518 -8.154 -5.204 435 HE2 LYS 69 HE2 LYS 69 105.771 -9.898 -6.399 436 HE3 LYS 69 HE1 LYS 69 106.562 -8.663 -7.380 437 HZ1 LYS 69 HZ1 LYS 69 107.969 -9.306 -5.546 438 HZ2 LYS 69 HZ2 LYS 69 106.744 -8.937 -4.429 439 HZ3 LYS 69 HZ3 LYS 69 107.467 -7.700 -5.342 440 H THR 70 HN THR 70 101.734 -5.835 -4.548 441 HA THR 70 HA THR 70 103.128 -7.402 -2.493 442 HB THR 70 HB THR 70 103.562 -5.270 -1.432 443 HG1 THR 70 HG1 THR 70 101.441 -4.544 -2.962 444 HG21 THR 70 HG21 THR 70 104.941 -5.997 -3.399 445 HG22 THR 70 HG22 THR 70 104.902 -4.248 -3.172 446 HG23 THR 70 HG23 THR 70 103.915 -4.997 -4.428 447 H SER 71 HN SER 71 99.928 -6.386 -3.187 448 HA SER 71 HA SER 71 97.991 -6.412 -1.932 449 HB2 SER 71 HB2 SER 71 99.292 -8.754 -1.432 450 HB3 SER 71 HB1 SER 71 99.130 -8.125 0.204 451 HG SER 71 HG SER 71 96.858 -7.717 -0.461 452 H ARG 72 HN ARG 72 100.171 -4.471 -1.363 453 HA ARG 72 HA ARG 72 99.722 -3.870 1.488 454 HB2 ARG 72 HB2 ARG 72 101.775 -2.940 -0.523 455 HB3 ARG 72 HB1 ARG 72 101.543 -2.133 1.023 456 HG2 ARG 72 HG2 ARG 72 101.978 -4.240 2.202 457 HG3 ARG 72 HG1 ARG 72 102.199 -5.066 0.662 458 HD2 ARG 72 HD2 ARG 72 104.102 -3.615 0.137 459 HD3 ARG 72 HD1 ARG 72 103.860 -2.727 1.639 460 HE ARG 72 HE ARG 72 105.052 -5.366 1.355 461 HH11 ARG 72 HH11 ARG 72 105.925 -6.225 3.272 462 HH12 ARG 72 HH12 ARG 72 105.546 -5.489 4.794 463 HH21 ARG 72 HH21 ARG 72 103.527 -3.035 3.407 464 HH22 ARG 72 HH22 ARG 72 104.191 -3.682 4.871 465 H PHE 73 HN PHE 73 98.771 -2.006 2.142 466 HA PHE 73 HA PHE 73 97.260 -0.507 0.108 467 HB2 PHE 73 HB2 PHE 73 97.171 -0.448 3.143 468 HB3 PHE 73 HB1 PHE 73 96.111 0.477 2.079 469 HD1 PHE 73 HD1 PHE 73 96.773 -2.755 3.587 470 HD2 PHE 73 HD2 PHE 73 94.565 -0.744 0.499 471 HE1 PHE 73 HE1 PHE 73 95.264 -4.713 3.392 472 HE2 PHE 73 HE2 PHE 73 93.055 -2.704 0.304 473 HZ PHE 73 HZ PHE 73 93.404 -4.687 1.751 474 H LEU 74 HN LEU 74 98.273 1.214 -0.747 475 HA LEU 74 HA LEU 74 100.537 2.443 0.499 476 HB2 LEU 74 HB2 LEU 74 100.517 2.452 -1.869 477 HB3 LEU 74 HB1 LEU 74 98.884 3.099 -1.939 478 HG LEU 74 HG LEU 74 99.626 5.261 -1.156 479 HD11 LEU 74 HD11 LEU 74 102.175 3.773 -0.541 480 HD12 LEU 74 HD12 LEU 74 101.253 4.870 0.487 481 HD13 LEU 74 HD13 LEU 74 102.215 5.510 -0.836 482 HD21 LEU 74 HD21 LEU 74 101.735 4.327 -3.113 483 HD22 LEU 74 HD22 LEU 74 100.994 5.923 -2.998 484 HD23 LEU 74 HD23 LEU 74 100.050 4.553 -3.577 485 H CYS 75 HN CYS 75 100.376 3.665 2.237 486 HA CYS 75 HA CYS 75 98.198 5.664 2.387 487 HB2 CYS 75 HB2 CYS 75 99.501 4.400 4.792 488 HB3 CYS 75 HB1 CYS 75 98.028 5.363 4.733 489 H GLN 76 HN GLN 76 98.740 7.695 3.216 490 HA GLN 76 HA GLN 76 101.633 8.290 3.155 491 HB2 GLN 76 HB2 GLN 76 100.281 9.516 1.525 492 HB3 GLN 76 HB1 GLN 76 99.229 10.100 2.812 493 HG2 GLN 76 HG2 GLN 76 101.043 11.347 3.818 494 HG3 GLN 76 HG1 GLN 76 102.207 10.642 2.703 495 HE21 GLN 76 HE21 GLN 76 102.694 11.978 0.964 496 HE22 GLN 76 HE22 GLN 76 101.651 13.150 0.315 497 H ARG 77 HN ARG 77 102.649 8.963 4.937 498 HA ARG 77 HA ARG 77 101.155 9.095 7.419 499 HB2 ARG 77 HB2 ARG 77 103.186 8.711 8.483 500 HB3 ARG 77 HB1 ARG 77 103.451 7.952 6.926 501 HG2 ARG 77 HG2 ARG 77 104.470 10.169 6.167 502 HG3 ARG 77 HG1 ARG 77 104.461 10.628 7.868 503 HD2 ARG 77 HD2 ARG 77 105.765 8.114 6.801 504 HD3 ARG 77 HD1 ARG 77 106.632 9.609 7.138 505 HE ARG 77 HE ARG 77 105.323 9.046 9.483 506 HH11 ARG 77 HH11 ARG 77 106.194 7.728 11.120 507 HH12 ARG 77 HH12 ARG 77 107.420 6.570 10.729 508 HH21 ARG 77 HH21 ARG 77 107.455 7.351 7.350 509 HH22 ARG 77 HH22 ARG 77 108.136 6.358 8.594 510 HA PRO 78 HA PRO 78 100.848 13.422 8.141 511 HB2 PRO 78 HB2 PRO 78 102.859 13.343 10.365 512 HB3 PRO 78 HB1 PRO 78 101.198 13.974 10.367 513 HG2 PRO 78 HG2 PRO 78 101.736 11.664 11.526 514 HG3 PRO 78 HG1 PRO 78 100.259 11.858 10.562 515 HD2 PRO 78 HD2 PRO 78 102.829 10.494 9.819 516 HD3 PRO 78 HD1 PRO 78 101.156 9.990 9.488 517 H ASP 79 HN ASP 79 104.194 12.310 8.265 518 HA ASP 79 HA ASP 79 105.406 14.794 7.622 519 HB2 ASP 79 HB2 ASP 79 106.341 11.933 7.346 520 HB3 ASP 79 HB1 ASP 79 107.354 13.319 6.960 521 H GLY 80 HN GLY 80 103.432 12.760 5.853 522 HA2 GLY 80 HA2 GLY 80 102.675 13.065 3.672 523 HA3 GLY 80 HA1 GLY 80 104.000 14.188 3.390 524 H ALA 81 HN ALA 81 105.022 11.258 4.823 525 HA ALA 81 HA ALA 81 106.390 10.522 2.365 526 HB1 ALA 81 HB1 ALA 81 107.146 10.325 4.947 527 HB2 ALA 81 HB2 ALA 81 107.789 9.269 3.689 528 HB3 ALA 81 HB3 ALA 81 106.485 8.707 4.727 529 H LEU 82 HN LEU 82 106.134 8.594 1.243 530 HA LEU 82 HA LEU 82 103.461 7.352 1.490 531 HB2 LEU 82 HB2 LEU 82 105.370 7.867 -0.763 532 HB3 LEU 82 HB1 LEU 82 104.317 6.466 -0.896 533 HG LEU 82 HG LEU 82 102.342 7.882 -0.600 534 HD11 LEU 82 HD11 LEU 82 103.181 9.584 0.882 535 HD12 LEU 82 HD12 LEU 82 102.677 10.386 -0.603 536 HD13 LEU 82 HD13 LEU 82 104.390 10.094 -0.296 537 HD21 LEU 82 HD21 LEU 82 102.981 7.651 -2.878 538 HD22 LEU 82 HD22 LEU 82 104.360 8.733 -2.686 539 HD23 LEU 82 HD23 LEU 82 102.723 9.381 -2.665 540 H TYR 83 HN TYR 83 103.233 5.260 2.050 541 HA TYR 83 HA TYR 83 105.404 3.365 1.632 542 HB2 TYR 83 HB2 TYR 83 105.772 2.783 3.908 543 HB3 TYR 83 HB1 TYR 83 105.876 4.542 3.841 544 HD1 TYR 83 HD1 TYR 83 104.124 1.701 5.233 545 HD2 TYR 83 HD2 TYR 83 103.841 5.922 4.496 546 HE1 TYR 83 HE1 TYR 83 102.290 1.865 6.893 547 HE2 TYR 83 HE2 TYR 83 102.007 6.088 6.159 548 HH TYR 83 HH TYR 83 100.262 4.503 7.133 549 H GLY 84 HN GLY 84 104.759 1.205 1.750 550 HA2 GLY 84 HA2 GLY 84 101.903 0.757 1.437 551 HA3 GLY 84 HA1 GLY 84 103.187 -0.425 1.195 552 H SER 85 HN SER 85 100.658 -0.636 2.765 553 HA SER 85 HA SER 85 101.870 -1.560 5.291 554 HB2 SER 85 HB2 SER 85 100.320 -0.450 6.645 555 HB3 SER 85 HB1 SER 85 100.737 0.769 5.448 556 HG SER 85 HG SER 85 98.359 -0.143 6.011 557 H LEU 86 HN LEU 86 100.603 -3.136 6.417 558 HA LEU 86 HA LEU 86 99.091 -4.859 4.610 559 HB2 LEU 86 HB2 LEU 86 100.572 -5.168 7.150 560 HB3 LEU 86 HB1 LEU 86 99.091 -6.116 7.090 561 HG LEU 86 HG LEU 86 101.051 -7.383 6.263 562 HD11 LEU 86 HD11 LEU 86 98.559 -7.420 5.221 563 HD12 LEU 86 HD12 LEU 86 99.852 -8.455 4.622 564 HD13 LEU 86 HD13 LEU 86 99.454 -6.968 3.767 565 HD21 LEU 86 HD21 LEU 86 101.138 -5.626 3.828 566 HD22 LEU 86 HD22 LEU 86 102.373 -6.708 4.463 567 HD23 LEU 86 HD23 LEU 86 102.061 -5.165 5.257 568 H HIS 87 HN HIS 87 98.453 -2.398 6.828 569 HA HIS 87 HA HIS 87 95.657 -3.332 7.208 570 HB2 HIS 87 HB2 HIS 87 95.738 -1.671 9.181 571 HB3 HIS 87 HB1 HIS 87 96.584 -3.207 9.365 572 HD2 HIS 87 HD2 HIS 87 99.477 -2.993 9.030 573 HE1 HIS 87 HE1 HIS 87 99.528 1.189 9.611 574 HE2 HIS 87 HE2 HIS 87 100.971 -0.896 9.479 575 H PHE 88 HN PHE 88 94.029 -1.688 7.233 576 HA PHE 88 HA PHE 88 94.629 0.510 5.355 577 HB2 PHE 88 HB2 PHE 88 92.917 -0.837 4.466 578 HB3 PHE 88 HB1 PHE 88 92.139 -1.044 6.032 579 HD1 PHE 88 HD1 PHE 88 93.325 2.013 4.178 580 HD2 PHE 88 HD2 PHE 88 90.013 -0.072 5.958 581 HE1 PHE 88 HE1 PHE 88 91.853 3.952 3.720 582 HE2 PHE 88 HE2 PHE 88 88.546 1.869 5.495 583 HZ PHE 88 HZ PHE 88 89.468 3.880 4.381 584 H ASP 89 HN ASP 89 94.561 2.549 5.989 585 HA ASP 89 HA ASP 89 93.242 3.265 8.548 586 HB2 ASP 89 HB2 ASP 89 95.792 3.110 8.629 587 HB3 ASP 89 HB1 ASP 89 95.805 4.511 7.560 588 HA PRO 90 HA PRO 90 91.270 5.838 5.262 589 HB2 PRO 90 HB2 PRO 90 89.841 6.878 7.681 590 HB3 PRO 90 HB1 PRO 90 89.178 6.332 6.128 591 HG2 PRO 90 HG2 PRO 90 89.020 4.845 8.357 592 HG3 PRO 90 HG1 PRO 90 89.194 4.122 6.751 593 HD2 PRO 90 HD2 PRO 90 91.213 4.367 8.932 594 HD3 PRO 90 HD1 PRO 90 91.086 3.146 7.647 595 H GLU 91 HN GLU 91 92.283 6.973 8.449 596 HA GLU 91 HA GLU 91 92.465 9.713 7.879 597 HB2 GLU 91 HB2 GLU 91 93.910 7.996 9.891 598 HB3 GLU 91 HB1 GLU 91 94.068 9.753 9.833 599 HG2 GLU 91 HG2 GLU 91 91.656 10.013 10.127 600 HG3 GLU 91 HG1 GLU 91 91.443 8.262 10.106 601 H ALA 92 HN ALA 92 94.506 7.173 6.762 602 HA ALA 92 HA ALA 92 96.486 9.201 5.857 603 HB1 ALA 92 HB1 ALA 92 98.200 7.323 6.104 604 HB2 ALA 92 HB2 ALA 92 96.990 6.497 7.087 605 HB3 ALA 92 HB3 ALA 92 97.617 8.065 7.593 606 H CYS 93 HN CYS 93 94.678 6.291 5.126 607 HA CYS 93 HA CYS 93 95.998 6.089 2.510 608 HB2 CYS 93 HB2 CYS 93 94.961 4.164 4.340 609 HB3 CYS 93 HB1 CYS 93 94.026 4.032 2.855 610 H SER 94 HN SER 94 93.320 7.609 3.788 611 HA SER 94 HA SER 94 91.594 7.225 1.482 612 HB2 SER 94 HB2 SER 94 90.119 8.802 2.562 613 HB3 SER 94 HB1 SER 94 90.718 7.703 3.801 614 HG SER 94 HG SER 94 91.343 9.469 4.751 615 H PHE 95 HN PHE 95 91.567 8.470 -0.309 616 HA PHE 95 HA PHE 95 93.156 10.974 -0.317 617 HB2 PHE 95 HB2 PHE 95 93.158 8.857 -2.479 618 HB3 PHE 95 HB1 PHE 95 94.047 10.378 -2.504 619 HD1 PHE 95 HD1 PHE 95 93.986 6.951 -1.279 620 HD2 PHE 95 HD2 PHE 95 95.860 10.789 -0.798 621 HE1 PHE 95 HE1 PHE 95 95.877 5.879 -0.092 622 HE2 PHE 95 HE2 PHE 95 97.747 9.715 0.398 623 HZ PHE 95 HZ PHE 95 97.764 7.259 0.744 624 H ARG 96 HN ARG 96 92.452 12.569 -1.691 625 HA ARG 96 HA ARG 96 89.673 12.298 -2.648 626 HB2 ARG 96 HB2 ARG 96 90.205 14.157 -1.084 627 HB3 ARG 96 HB1 ARG 96 91.359 14.787 -2.260 628 HG2 ARG 96 HG2 ARG 96 89.575 15.090 -3.902 629 HG3 ARG 96 HG1 ARG 96 88.405 14.363 -2.799 630 HD2 ARG 96 HD2 ARG 96 90.008 16.852 -2.161 631 HD3 ARG 96 HD1 ARG 96 88.367 16.878 -2.803 632 HE ARG 96 HE ARG 96 88.141 15.282 -0.610 633 HH11 ARG 96 HH11 ARG 96 87.701 16.069 1.475 634 HH12 ARG 96 HH12 ARG 96 88.155 17.687 1.898 635 HH21 ARG 96 HH21 ARG 96 89.526 18.398 -1.206 636 HH22 ARG 96 HH22 ARG 96 89.188 19.004 0.381 637 H GLU 97 HN GLU 97 89.142 12.614 -4.782 638 HA GLU 97 HA GLU 97 91.360 12.465 -6.689 639 HB2 GLU 97 HB2 GLU 97 88.370 12.337 -7.149 640 HB3 GLU 97 HB1 GLU 97 89.624 11.968 -8.333 641 HG2 GLU 97 HG2 GLU 97 88.991 9.853 -7.477 642 HG3 GLU 97 HG1 GLU 97 90.484 10.239 -6.624 643 H LEU 98 HN LEU 98 92.183 14.217 -7.595 644 HA LEU 98 HA LEU 98 90.518 16.665 -7.839 645 HB2 LEU 98 HB2 LEU 98 93.534 16.424 -7.891 646 HB3 LEU 98 HB1 LEU 98 92.589 17.909 -7.820 647 HG LEU 98 HG LEU 98 92.639 15.749 -5.690 648 HD11 LEU 98 HD11 LEU 98 94.714 16.922 -5.617 649 HD12 LEU 98 HD12 LEU 98 93.710 17.652 -4.364 650 HD13 LEU 98 HD13 LEU 98 93.930 18.474 -5.908 651 HD21 LEU 98 HD21 LEU 98 90.507 16.736 -5.515 652 HD22 LEU 98 HD22 LEU 98 91.094 18.323 -6.013 653 HD23 LEU 98 HD23 LEU 98 91.470 17.706 -4.404 654 H LEU 99 HN LEU 99 89.817 17.053 -9.842 655 HA LEU 99 HA LEU 99 91.425 16.090 -12.142 656 HB2 LEU 99 HB2 LEU 99 88.569 15.918 -11.511 657 HB3 LEU 99 HB1 LEU 99 88.830 16.655 -13.086 658 HG LEU 99 HG LEU 99 88.588 14.163 -13.169 659 HD11 LEU 99 HD11 LEU 99 91.415 14.722 -14.006 660 HD12 LEU 99 HD12 LEU 99 90.125 15.675 -14.736 661 HD13 LEU 99 HD13 LEU 99 90.119 13.920 -14.887 662 HD21 LEU 99 HD21 LEU 99 89.967 12.704 -12.045 663 HD22 LEU 99 HD22 LEU 99 90.038 14.043 -10.904 664 HD23 LEU 99 HD23 LEU 99 91.343 13.802 -12.063 665 H LEU 100 HN LEU 100 92.117 17.458 -13.591 666 HA LEU 100 HA LEU 100 91.446 20.326 -13.292 667 HB2 LEU 100 HB2 LEU 100 93.846 18.927 -14.497 668 HB3 LEU 100 HB1 LEU 100 93.597 20.672 -14.515 669 HG LEU 100 HG LEU 100 93.664 19.012 -11.977 670 HD11 LEU 100 HD11 LEU 100 95.853 18.789 -12.812 671 HD12 LEU 100 HD12 LEU 100 95.969 20.192 -11.754 672 HD13 LEU 100 HD13 LEU 100 95.861 20.413 -13.500 673 HD21 LEU 100 HD21 LEU 100 94.278 21.423 -11.107 674 HD22 LEU 100 HD22 LEU 100 92.595 21.030 -11.430 675 HD23 LEU 100 HD23 LEU 100 93.522 21.962 -12.605 676 H GLU 101 HN GLU 101 90.705 21.470 -15.048 677 HA GLU 101 HA GLU 101 89.272 20.166 -17.052 678 HB2 GLU 101 HB2 GLU 101 88.944 22.541 -16.432 679 HB3 GLU 101 HB1 GLU 101 90.496 22.936 -17.173 680 HG2 GLU 101 HG2 GLU 101 89.695 22.165 -19.346 681 HG3 GLU 101 HG1 GLU 101 88.163 21.667 -18.631 682 H ASP 102 HN ASP 102 92.623 20.850 -16.779 683 HA ASP 102 HA ASP 102 93.330 20.720 -19.532 684 HB2 ASP 102 HB2 ASP 102 94.900 20.376 -16.982 685 HB3 ASP 102 HB1 ASP 102 95.640 20.318 -18.580 686 H GLY 103 HN GLY 103 92.352 18.331 -17.294 687 HA2 GLY 103 HA2 GLY 103 91.883 16.101 -17.911 688 HA3 GLY 103 HA1 GLY 103 93.050 16.226 -19.220 689 H TYR 104 HN TYR 104 94.151 17.422 -16.178 690 HA TYR 104 HA TYR 104 95.832 14.999 -15.848 691 HB2 TYR 104 HB2 TYR 104 96.213 17.852 -14.918 692 HB3 TYR 104 HB1 TYR 104 97.244 16.513 -14.413 693 HD1 TYR 104 HD1 TYR 104 96.783 19.034 -16.864 694 HD2 TYR 104 HD2 TYR 104 98.184 15.006 -16.370 695 HE1 TYR 104 HE1 TYR 104 98.079 19.230 -18.968 696 HE2 TYR 104 HE2 TYR 104 99.485 15.204 -18.473 697 HH TYR 104 HH TYR 104 100.449 16.936 -19.881 698 H ASN 105 HN ASN 105 95.714 13.798 -14.022 699 HA ASN 105 HA ASN 105 93.718 14.624 -11.988 700 HB2 ASN 105 HB2 ASN 105 94.660 11.793 -12.388 701 HB3 ASN 105 HB1 ASN 105 93.137 12.376 -11.718 702 HD21 ASN 105 HD21 ASN 105 91.531 11.710 -13.163 703 HD22 ASN 105 HD22 ASN 105 91.608 11.906 -14.847 704 H VAL 106 HN VAL 106 94.239 14.621 -9.861 705 HA VAL 106 HA VAL 106 96.891 13.626 -9.032 706 HB VAL 106 HB VAL 106 95.865 16.279 -8.027 707 HG11 VAL 106 HG11 VAL 106 97.656 15.130 -6.779 708 HG12 VAL 106 HG12 VAL 106 98.266 16.600 -7.540 709 HG13 VAL 106 HG13 VAL 106 98.620 15.025 -8.253 710 HG21 VAL 106 HG21 VAL 106 97.531 17.256 -9.720 711 HG22 VAL 106 HG22 VAL 106 95.997 16.682 -10.374 712 HG23 VAL 106 HG23 VAL 106 97.449 15.696 -10.537 713 H TYR 107 HN TYR 107 97.039 13.221 -6.743 714 HA TYR 107 HA TYR 107 94.396 12.842 -5.434 715 HB2 TYR 107 HB2 TYR 107 96.863 11.095 -5.320 716 HB3 TYR 107 HB1 TYR 107 95.407 10.850 -4.353 717 HD1 TYR 107 HD1 TYR 107 96.831 10.775 -7.758 718 HD2 TYR 107 HD2 TYR 107 93.339 10.061 -5.360 719 HE1 TYR 107 HE1 TYR 107 95.776 9.573 -9.654 720 HE2 TYR 107 HE2 TYR 107 92.286 8.857 -7.256 721 HH TYR 107 HH TYR 107 92.826 9.096 -10.111 722 H GLN 108 HN GLN 108 94.181 13.453 -3.355 723 HA GLN 108 HA GLN 108 96.546 14.394 -1.853 724 HB2 GLN 108 HB2 GLN 108 95.611 16.377 -2.906 725 HB3 GLN 108 HB1 GLN 108 93.995 15.953 -2.347 726 HG2 GLN 108 HG2 GLN 108 94.657 16.257 -0.031 727 HG3 GLN 108 HG1 GLN 108 96.336 16.508 -0.506 728 HE21 GLN 108 HE21 GLN 108 94.346 18.388 0.860 729 HE22 GLN 108 HE22 GLN 108 94.357 19.782 -0.107 730 H SER 109 HN SER 109 96.476 13.907 0.290 731 HA SER 109 HA SER 109 94.536 12.058 1.238 732 HB2 SER 109 HB2 SER 109 96.346 13.698 3.005 733 HB3 SER 109 HB1 SER 109 95.742 12.064 3.273 734 HG SER 109 HG SER 109 97.709 11.690 2.489 735 H GLU 110 HN GLU 110 92.545 12.459 1.918 736 HA GLU 110 HA GLU 110 91.569 15.113 2.293 737 HB2 GLU 110 HB2 GLU 110 89.456 14.142 2.367 738 HB3 GLU 110 HB1 GLU 110 90.363 12.956 1.439 739 HG2 GLU 110 HG2 GLU 110 89.249 11.616 3.007 740 HG3 GLU 110 HG1 GLU 110 90.828 11.841 3.751 741 H ALA 111 HN ALA 111 92.707 12.616 4.451 742 HA ALA 111 HA ALA 111 91.529 13.349 6.842 743 HB1 ALA 111 HB1 ALA 111 93.071 11.374 6.340 744 HB2 ALA 111 HB2 ALA 111 93.224 12.124 7.929 745 HB3 ALA 111 HB3 ALA 111 94.404 12.482 6.665 746 H HIS 112 HN HIS 112 94.677 14.554 5.607 747 HA HIS 112 HA HIS 112 94.388 16.870 7.457 748 HB2 HIS 112 HB2 HIS 112 96.212 15.225 8.046 749 HB3 HIS 112 HB1 HIS 112 97.005 15.676 6.538 750 HD2 HIS 112 HD2 HIS 112 98.393 18.121 6.647 751 HE1 HIS 112 HE1 HIS 112 97.095 19.287 10.488 752 HE2 HIS 112 HE2 HIS 112 98.651 19.866 8.567 753 H GLY 113 HN GLY 113 94.551 15.933 4.222 754 HA2 GLY 113 HA2 GLY 113 94.369 17.365 2.369 755 HA3 GLY 113 HA1 GLY 113 94.834 18.715 3.393 756 H LEU 114 HN LEU 114 96.805 15.894 3.588 757 HA LEU 114 HA LEU 114 99.110 17.310 2.688 758 HB2 LEU 114 HB2 LEU 114 98.637 14.403 3.354 759 HB3 LEU 114 HB1 LEU 114 100.218 15.037 2.903 760 HG LEU 114 HG LEU 114 98.695 16.415 5.103 761 HD11 LEU 114 HD11 LEU 114 99.637 14.887 6.770 762 HD12 LEU 114 HD12 LEU 114 100.338 13.897 5.490 763 HD13 LEU 114 HD13 LEU 114 98.586 14.003 5.664 764 HD21 LEU 114 HD21 LEU 114 100.884 17.278 4.188 765 HD22 LEU 114 HD22 LEU 114 101.646 15.794 4.760 766 HD23 LEU 114 HD23 LEU 114 100.928 16.917 5.913 767 HA PRO 115 HA PRO 115 98.594 16.233 -1.645 768 HB2 PRO 115 HB2 PRO 115 100.994 17.028 -2.622 769 HB3 PRO 115 HB1 PRO 115 99.779 18.198 -2.061 770 HG2 PRO 115 HG2 PRO 115 102.177 17.135 -0.617 771 HG3 PRO 115 HG1 PRO 115 101.605 18.809 -0.758 772 HD2 PRO 115 HD2 PRO 115 101.089 17.275 1.443 773 HD3 PRO 115 HD1 PRO 115 99.965 18.531 0.873 774 H LEU 116 HN LEU 116 99.274 14.598 -3.134 775 HA LEU 116 HA LEU 116 100.957 12.496 -1.907 776 HB2 LEU 116 HB2 LEU 116 98.556 12.009 -2.584 777 HB3 LEU 116 HB1 LEU 116 99.066 12.212 -4.255 778 HG LEU 116 HG LEU 116 100.615 10.321 -2.481 779 HD11 LEU 116 HD11 LEU 116 98.419 9.544 -2.042 780 HD12 LEU 116 HD12 LEU 116 99.046 8.493 -3.309 781 HD13 LEU 116 HD13 LEU 116 97.914 9.783 -3.712 782 HD21 LEU 116 HD21 LEU 116 101.561 10.585 -4.663 783 HD22 LEU 116 HD22 LEU 116 99.984 10.500 -5.445 784 HD23 LEU 116 HD23 LEU 116 100.689 9.059 -4.720 785 H HIS 117 HN HIS 117 102.929 12.231 -2.656 786 HA HIS 117 HA HIS 117 103.531 12.487 -5.491 787 HB2 HIS 117 HB2 HIS 117 105.428 14.065 -5.037 788 HB3 HIS 117 HB1 HIS 117 103.835 14.790 -4.809 789 HD2 HIS 117 HD2 HIS 117 103.133 15.284 -2.069 790 HE1 HIS 117 HE1 HIS 117 106.952 14.392 -0.511 791 HE2 HIS 117 HE2 HIS 117 104.674 15.370 0.037 792 H LEU 118 HN LEU 118 105.713 11.699 -5.984 793 HA LEU 118 HA LEU 118 106.342 9.359 -4.570 794 HB2 LEU 118 HB2 LEU 118 107.943 10.971 -6.556 795 HB3 LEU 118 HB1 LEU 118 108.451 9.395 -5.960 796 HG LEU 118 HG LEU 118 105.788 9.916 -7.316 797 HD11 LEU 118 HD11 LEU 118 106.723 9.026 -9.330 798 HD12 LEU 118 HD12 LEU 118 108.212 8.555 -8.510 799 HD13 LEU 118 HD13 LEU 118 107.849 10.262 -8.772 800 HD21 LEU 118 HD21 LEU 118 105.451 7.929 -6.149 801 HD22 LEU 118 HD22 LEU 118 107.157 7.487 -6.181 802 HD23 LEU 118 HD23 LEU 118 106.166 7.284 -7.623 803 HA PRO 119 HA PRO 119 108.864 10.745 -1.187 804 HB2 PRO 119 HB2 PRO 119 111.029 8.841 -1.975 805 HB3 PRO 119 HB1 PRO 119 110.145 8.970 -0.441 806 HG2 PRO 119 HG2 PRO 119 109.693 6.984 -2.193 807 HG3 PRO 119 HG1 PRO 119 108.409 7.665 -1.179 808 HD2 PRO 119 HD2 PRO 119 108.911 8.064 -4.103 809 HD3 PRO 119 HD1 PRO 119 107.381 8.046 -3.199 810 H GLY 120 HN GLY 120 110.452 12.280 -0.816 811 HA2 GLY 120 HA2 GLY 120 112.623 12.694 -2.689 812 HA3 GLY 120 HA1 GLY 120 111.393 13.954 -2.724 813 H ASN 121 HN ASN 121 113.894 12.422 -0.833 814 HA ASN 121 HA ASN 121 113.677 14.488 1.275 815 HB2 ASN 121 HB2 ASN 121 115.186 11.865 1.185 816 HB3 ASN 121 HB1 ASN 121 115.209 12.998 2.536 817 HD21 ASN 121 HD21 ASN 121 113.030 10.885 0.641 818 HD22 ASN 121 HD22 ASN 121 111.856 10.744 1.859 819 H LYS 122 HN LYS 122 115.018 14.342 -1.600 820 HA LYS 122 HA LYS 122 116.770 15.440 -2.593 821 HB2 LYS 122 HB2 LYS 122 116.252 17.060 -0.569 822 HB3 LYS 122 HB1 LYS 122 117.762 16.424 0.078 823 HG2 LYS 122 HG2 LYS 122 118.962 17.124 -1.935 824 HG3 LYS 122 HG1 LYS 122 117.456 17.663 -2.679 825 HD2 LYS 122 HD2 LYS 122 117.151 19.319 -0.875 826 HD3 LYS 122 HD1 LYS 122 118.662 18.789 -0.136 827 HE2 LYS 122 HE2 LYS 122 119.890 19.436 -2.178 828 HE3 LYS 122 HE1 LYS 122 118.380 19.967 -2.917 829 HZ1 LYS 122 HZ1 LYS 122 119.448 21.051 -0.369 830 HZ2 LYS 122 HZ2 LYS 122 118.121 21.635 -1.257 831 HZ3 LYS 122 HZ3 LYS 122 119.696 21.776 -1.882 832 H SER 123 HN SER 123 116.931 12.929 -0.567 833 HA SER 123 HA SER 123 119.761 12.648 -0.194 834 HB2 SER 123 HB2 SER 123 117.874 10.313 -0.112 835 HB3 SER 123 HB1 SER 123 119.278 10.649 0.893 836 HG SER 123 HG SER 123 117.743 11.299 2.210 837 HA PRO 124 HA PRO 124 119.115 9.631 -3.984 838 HB2 PRO 124 HB2 PRO 124 117.217 11.249 -5.608 839 HB3 PRO 124 HB1 PRO 124 117.217 9.504 -5.290 840 HG2 PRO 124 HG2 PRO 124 115.417 11.153 -4.173 841 HG3 PRO 124 HG1 PRO 124 116.042 9.728 -3.322 842 HD2 PRO 124 HD2 PRO 124 116.774 12.617 -2.949 843 HD3 PRO 124 HD1 PRO 124 116.587 11.334 -1.734 844 H HIS 125 HN HIS 125 120.312 9.849 -5.959 845 HA HIS 125 HA HIS 125 122.233 11.789 -6.081 846 HB2 HIS 125 HB2 HIS 125 122.412 11.224 -8.542 847 HB3 HIS 125 HB1 HIS 125 122.450 9.839 -7.452 848 HD2 HIS 125 HD2 HIS 125 120.267 11.227 -10.337 849 HE1 HIS 125 HE1 HIS 125 118.249 7.872 -8.760 850 HE2 HIS 125 HE2 HIS 125 118.288 9.554 -10.660 851 H ARG 126 HN ARG 126 122.583 13.568 -7.595 852 HA ARG 126 HA ARG 126 120.870 15.658 -7.364 853 HB2 ARG 126 HB2 ARG 126 123.175 15.748 -8.329 854 HB3 ARG 126 HB1 ARG 126 122.518 15.134 -9.844 855 HG2 ARG 126 HG2 ARG 126 120.963 17.086 -9.920 856 HG3 ARG 126 HG1 ARG 126 121.735 17.718 -8.465 857 HD2 ARG 126 HD2 ARG 126 123.204 17.100 -11.041 858 HD3 ARG 126 HD1 ARG 126 122.647 18.705 -10.581 859 HE ARG 126 HE ARG 126 124.171 17.752 -8.451 860 HH11 ARG 126 HH11 ARG 126 126.367 18.311 -8.264 861 HH12 ARG 126 HH12 ARG 126 127.246 18.824 -9.665 862 HH21 ARG 126 HH21 ARG 126 124.545 18.484 -11.812 863 HH22 ARG 126 HH22 ARG 126 126.218 18.909 -11.676 864 H ASP 127 HN ASP 127 118.827 15.929 -7.886 865 HA ASP 127 HA ASP 127 117.842 15.079 -10.528 866 HB2 ASP 127 HB2 ASP 127 116.849 14.179 -7.841 867 HB3 ASP 127 HB1 ASP 127 115.667 14.423 -9.121 868 HA PRO 128 HA PRO 128 115.971 19.074 -10.508 869 HB2 PRO 128 HB2 PRO 128 113.528 18.576 -11.734 870 HB3 PRO 128 HB1 PRO 128 115.068 18.729 -12.601 871 HG2 PRO 128 HG2 PRO 128 113.614 16.260 -11.760 872 HG3 PRO 128 HG1 PRO 128 114.473 16.601 -13.273 873 HD2 PRO 128 HD2 PRO 128 115.590 15.087 -11.333 874 HD3 PRO 128 HD1 PRO 128 116.571 16.176 -12.337 875 H ALA 129 HN ALA 129 114.649 20.344 -9.229 876 HA ALA 129 HA ALA 129 113.666 19.277 -6.846 877 HB1 ALA 129 HB1 ALA 129 112.507 21.543 -6.636 878 HB2 ALA 129 HB2 ALA 129 113.181 21.913 -8.224 879 HB3 ALA 129 HB3 ALA 129 114.255 21.576 -6.868 880 HA PRO 130 HA PRO 130 109.695 17.775 -8.308 881 HB2 PRO 130 HB2 PRO 130 108.462 17.322 -5.903 882 HB3 PRO 130 HB1 PRO 130 109.734 16.265 -6.549 883 HG2 PRO 130 HG2 PRO 130 109.931 18.418 -4.489 884 HG3 PRO 130 HG1 PRO 130 110.694 16.817 -4.521 885 HD2 PRO 130 HD2 PRO 130 112.025 19.115 -5.211 886 HD3 PRO 130 HD1 PRO 130 112.426 17.524 -5.899 887 H ARG 131 HN ARG 131 110.139 20.531 -6.287 888 HA ARG 131 HA ARG 131 108.761 22.297 -5.675 889 HB2 ARG 131 HB2 ARG 131 109.677 22.716 -7.997 890 HB3 ARG 131 HB1 ARG 131 108.113 22.206 -8.625 891 HG2 ARG 131 HG2 ARG 131 107.023 23.961 -7.207 892 HG3 ARG 131 HG1 ARG 131 108.624 24.497 -6.703 893 HD2 ARG 131 HD2 ARG 131 107.675 24.401 -9.577 894 HD3 ARG 131 HD1 ARG 131 107.694 25.852 -8.579 895 HE ARG 131 HE ARG 131 109.985 24.566 -9.801 896 HH11 ARG 131 HH11 ARG 131 111.946 25.692 -9.565 897 HH12 ARG 131 HH12 ARG 131 112.075 26.960 -8.393 898 HH21 ARG 131 HH21 ARG 131 108.813 26.619 -7.274 899 HH22 ARG 131 HH22 ARG 131 110.306 27.476 -7.088 900 H GLY 132 HN GLY 132 106.468 22.238 -8.123 901 HA2 GLY 132 HA2 GLY 132 104.278 21.983 -6.387 902 HA3 GLY 132 HA1 GLY 132 104.203 21.879 -8.144 903 HA PRO 133 HA PRO 133 103.372 17.682 -6.159 904 HB2 PRO 133 HB2 PRO 133 100.763 17.407 -6.908 905 HB3 PRO 133 HB1 PRO 133 101.242 18.245 -5.416 906 HG2 PRO 133 HG2 PRO 133 100.520 19.405 -8.079 907 HG3 PRO 133 HG1 PRO 133 100.003 19.910 -6.458 908 HD2 PRO 133 HD2 PRO 133 102.002 21.188 -7.795 909 HD3 PRO 133 HD1 PRO 133 102.003 21.036 -6.024 910 H ALA 134 HN ALA 134 103.257 15.703 -7.316 911 HA ALA 134 HA ALA 134 103.895 15.937 -10.143 912 HB1 ALA 134 HB1 ALA 134 104.284 13.480 -9.963 913 HB2 ALA 134 HB2 ALA 134 103.775 13.557 -8.276 914 HB3 ALA 134 HB3 ALA 134 105.222 14.418 -8.801 915 H ARG 135 HN ARG 135 102.353 15.973 -11.630 916 HA ARG 135 HA ARG 135 99.654 15.200 -11.133 917 HB2 ARG 135 HB2 ARG 135 99.386 15.559 -13.599 918 HB3 ARG 135 HB1 ARG 135 100.117 16.927 -12.759 919 HG2 ARG 135 HG2 ARG 135 102.365 16.112 -13.426 920 HG3 ARG 135 HG1 ARG 135 101.605 14.789 -14.311 921 HD2 ARG 135 HD2 ARG 135 100.418 16.402 -15.730 922 HD3 ARG 135 HD1 ARG 135 101.144 17.736 -14.841 923 HE ARG 135 HE ARG 135 102.478 15.998 -16.782 924 HH11 ARG 135 HH11 ARG 135 104.516 16.739 -17.448 925 HH12 ARG 135 HH12 ARG 135 105.288 18.029 -16.587 926 HH21 ARG 135 HH21 ARG 135 102.709 18.408 -14.302 927 HH22 ARG 135 HH22 ARG 135 104.264 18.974 -14.811 928 H PHE 136 HN PHE 136 98.624 13.328 -11.487 929 HA PHE 136 HA PHE 136 100.178 11.081 -12.661 930 HB2 PHE 136 HB2 PHE 136 98.458 11.292 -10.218 931 HB3 PHE 136 HB1 PHE 136 98.386 9.779 -11.124 932 HD1 PHE 136 HD1 PHE 136 100.377 11.840 -8.875 933 HD2 PHE 136 HD2 PHE 136 100.505 8.508 -11.587 934 HE1 PHE 136 HE1 PHE 136 102.531 11.105 -7.882 935 HE2 PHE 136 HE2 PHE 136 102.648 7.776 -10.590 936 HZ PHE 136 HZ PHE 136 103.662 9.069 -8.741 937 H LEU 137 HN LEU 137 99.027 9.523 -13.825 938 HA LEU 137 HA LEU 137 96.357 10.285 -14.833 939 HB2 LEU 137 HB2 LEU 137 98.859 9.729 -16.422 940 HB3 LEU 137 HB1 LEU 137 97.254 9.551 -17.127 941 HG LEU 137 HG LEU 137 97.904 12.115 -15.683 942 HD11 LEU 137 HD11 LEU 137 98.729 11.518 -18.541 943 HD12 LEU 137 HD12 LEU 137 99.838 11.721 -17.185 944 HD13 LEU 137 HD13 LEU 137 98.851 13.077 -17.728 945 HD21 LEU 137 HD21 LEU 137 96.379 11.658 -18.259 946 HD22 LEU 137 HD22 LEU 137 96.281 13.040 -17.170 947 HD23 LEU 137 HD23 LEU 137 95.619 11.483 -16.679 948 HA PRO 138 HA PRO 138 96.397 5.846 -13.545 949 HB2 PRO 138 HB2 PRO 138 93.454 6.274 -13.869 950 HB3 PRO 138 HB1 PRO 138 94.344 5.539 -12.520 951 HG2 PRO 138 HG2 PRO 138 93.299 7.986 -12.323 952 HG3 PRO 138 HG1 PRO 138 94.855 7.581 -11.572 953 HD2 PRO 138 HD2 PRO 138 94.323 9.149 -14.076 954 HD3 PRO 138 HD1 PRO 138 95.582 9.385 -12.841 955 H LEU 139 HN LEU 139 96.486 4.118 -14.936 956 HA LEU 139 HA LEU 139 95.314 4.448 -17.638 957 HB2 LEU 139 HB2 LEU 139 97.439 2.407 -17.075 958 HB3 LEU 139 HB1 LEU 139 97.092 3.276 -18.562 959 HG LEU 139 HG LEU 139 98.285 4.534 -16.072 960 HD11 LEU 139 HD11 LEU 139 99.784 2.901 -17.252 961 HD12 LEU 139 HD12 LEU 139 100.379 4.561 -17.286 962 HD13 LEU 139 HD13 LEU 139 99.608 3.871 -18.714 963 HD21 LEU 139 HD21 LEU 139 97.033 6.143 -17.389 964 HD22 LEU 139 HD22 LEU 139 97.772 5.556 -18.876 965 HD23 LEU 139 HD23 LEU 139 98.750 6.402 -17.679 966 HA PRO 140 HA PRO 140 92.403 1.226 -16.387 967 HB2 PRO 140 HB2 PRO 140 92.636 0.347 -19.244 968 HB3 PRO 140 HB1 PRO 140 91.181 0.664 -18.277 969 HG2 PRO 140 HG2 PRO 140 92.076 2.393 -20.136 970 HG3 PRO 140 HG1 PRO 140 91.257 2.924 -18.657 971 HD2 PRO 140 HD2 PRO 140 94.137 3.144 -19.378 972 HD3 PRO 140 HD1 PRO 140 93.171 4.118 -18.246 973 H GLY 141 HN GLY 141 92.888 -0.655 -15.403 974 HA2 GLY 141 HA2 GLY 141 95.134 -2.300 -16.446 975 HA3 GLY 141 HA1 GLY 141 94.742 -2.127 -14.735
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