NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
553911 | 2ls0 | 18404 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 -18.082 25.512 -7.749 2 H2 MET 1 HT2 MET 1 -18.754 24.663 -9.080 3 H3 MET 1 HT3 MET 1 -19.558 24.663 -7.566 4 HA MET 1 HA MET 1 -20.391 26.170 -9.412 5 HB2 MET 1 HB2 MET 1 -19.814 27.111 -6.594 6 HB3 MET 1 HB1 MET 1 -20.955 27.888 -7.679 7 HG2 MET 1 HG2 MET 1 -22.405 26.028 -7.644 8 HG3 MET 1 HG1 MET 1 -21.193 25.004 -6.878 9 HE1 MET 1 HE1 MET 1 -24.254 25.367 -5.913 10 HE2 MET 1 HE2 MET 1 -24.040 25.431 -4.163 11 HE3 MET 1 HE3 MET 1 -23.125 24.267 -5.122 12 H ARG 2 HN ARG 2 -18.105 27.814 -7.247 13 HA ARG 2 HA ARG 2 -17.425 29.674 -9.375 14 HB2 ARG 2 HB2 ARG 2 -16.097 30.794 -7.525 15 HB3 ARG 2 HB1 ARG 2 -17.840 30.737 -7.304 16 HG2 ARG 2 HG2 ARG 2 -17.590 29.719 -5.357 17 HG3 ARG 2 HG1 ARG 2 -16.694 28.408 -6.126 18 HD2 ARG 2 HD2 ARG 2 -15.413 29.501 -4.328 19 HD3 ARG 2 HD1 ARG 2 -14.627 29.631 -5.898 20 HE ARG 2 HE ARG 2 -15.206 31.925 -5.971 21 HH11 ARG 2 HH11 ARG 2 -16.059 30.405 -2.936 22 HH12 ARG 2 HH12 ARG 2 -16.168 31.905 -2.081 23 HH21 ARG 2 HH21 ARG 2 -15.357 33.887 -4.839 24 HH22 ARG 2 HH22 ARG 2 -15.773 33.878 -3.158 25 H GLY 3 HN GLY 3 -15.868 29.111 -10.746 26 HA2 GLY 3 HA2 GLY 3 -13.909 28.258 -11.585 27 HA3 GLY 3 HA1 GLY 3 -13.213 28.773 -10.058 28 H SER 4 HN SER 4 -15.704 26.310 -10.387 29 HA SER 4 HA SER 4 -13.834 24.377 -9.225 30 HB2 SER 4 HB2 SER 4 -15.918 24.692 -7.997 31 HB3 SER 4 HB1 SER 4 -16.852 24.305 -9.442 32 HG SER 4 HG SER 4 -15.212 22.600 -7.896 33 H HIS 5 HN HIS 5 -14.706 25.247 -12.227 34 HA HIS 5 HA HIS 5 -14.920 22.512 -13.268 35 HB2 HIS 5 HB2 HIS 5 -16.549 24.388 -13.937 36 HB3 HIS 5 HB1 HIS 5 -15.214 25.041 -14.880 37 HD1 HIS 5 HD1 HIS 5 -16.071 21.369 -14.595 38 HD2 HIS 5 HD2 HIS 5 -16.164 24.450 -17.382 39 HE1 HIS 5 HE1 HIS 5 -16.663 20.279 -16.783 40 HE2 HIS 5 HE2 HIS 5 -16.685 22.158 -18.462 41 H HIS 6 HN HIS 6 -13.030 21.593 -13.742 42 HA HIS 6 HA HIS 6 -11.231 22.778 -15.598 43 HB2 HIS 6 HB2 HIS 6 -9.267 22.988 -14.181 44 HB3 HIS 6 HB1 HIS 6 -10.559 24.012 -13.563 45 HD1 HIS 6 HD1 HIS 6 -8.319 21.259 -12.625 46 HD2 HIS 6 HD2 HIS 6 -11.809 22.982 -11.172 47 HE1 HIS 6 HE1 HIS 6 -8.544 20.430 -10.262 48 HE2 HIS 6 HE2 HIS 6 -10.709 21.416 -9.432 49 H HIS 7 HN HIS 7 -10.798 21.068 -16.811 50 HA HIS 7 HA HIS 7 -10.358 18.467 -15.507 51 HB2 HIS 7 HB2 HIS 7 -11.535 19.275 -18.122 52 HB3 HIS 7 HB1 HIS 7 -10.664 17.746 -18.054 53 HD1 HIS 7 HD1 HIS 7 -13.951 18.990 -17.746 54 HD2 HIS 7 HD2 HIS 7 -11.730 16.165 -15.658 55 HE1 HIS 7 HE1 HIS 7 -15.638 17.554 -16.556 56 HE2 HIS 7 HE2 HIS 7 -14.268 15.900 -15.238 57 H HIS 8 HN HIS 8 -8.529 17.267 -15.939 58 HA HIS 8 HA HIS 8 -6.591 18.243 -17.873 59 HB2 HIS 8 HB2 HIS 8 -6.397 18.983 -15.159 60 HB3 HIS 8 HB1 HIS 8 -5.176 17.740 -15.411 61 HD1 HIS 8 HD1 HIS 8 -3.647 19.976 -14.885 62 HD2 HIS 8 HD2 HIS 8 -5.498 19.733 -18.598 63 HE1 HIS 8 HE1 HIS 8 -2.411 21.595 -16.360 64 HE2 HIS 8 HE2 HIS 8 -3.502 21.378 -18.620 65 H HIS 9 HN HIS 9 -4.986 16.714 -18.427 66 HA HIS 9 HA HIS 9 -5.566 13.979 -17.489 67 HB2 HIS 9 HB2 HIS 9 -4.327 14.669 -20.149 68 HB3 HIS 9 HB1 HIS 9 -5.033 13.138 -19.644 69 HD1 HIS 9 HD1 HIS 9 -5.811 16.203 -21.416 70 HD2 HIS 9 HD2 HIS 9 -7.953 13.317 -19.330 71 HE1 HIS 9 HE1 HIS 9 -8.205 16.500 -22.125 72 HE2 HIS 9 HE2 HIS 9 -9.482 14.730 -20.865 73 H HIS 10 HN HIS 10 -3.758 12.474 -17.496 74 HA HIS 10 HA HIS 10 -1.380 13.692 -16.364 75 HB2 HIS 10 HB2 HIS 10 -2.560 10.967 -16.505 76 HB3 HIS 10 HB1 HIS 10 -0.809 11.064 -16.348 77 HD1 HIS 10 HD1 HIS 10 -3.894 12.442 -14.608 78 HD2 HIS 10 HD2 HIS 10 0.036 11.369 -13.791 79 HE1 HIS 10 HE1 HIS 10 -3.621 12.730 -12.124 80 HE2 HIS 10 HE2 HIS 10 -1.234 12.075 -11.651 81 H GLY 11 HN GLY 11 0.674 12.085 -17.026 82 HA2 GLY 11 HA2 GLY 11 1.004 12.587 -19.916 83 HA3 GLY 11 HA1 GLY 11 2.310 12.601 -18.740 84 H SER 12 HN SER 12 1.657 11.002 -21.281 85 HA SER 12 HA SER 12 1.703 8.289 -20.194 86 HB2 SER 12 HB2 SER 12 0.677 9.472 -22.582 87 HB3 SER 12 HB1 SER 12 1.879 8.264 -23.034 88 HG SER 12 HG SER 12 -0.270 7.809 -21.237 89 H GLU 13 HN GLU 13 3.997 10.467 -20.472 90 HA GLU 13 HA GLU 13 5.990 8.509 -21.395 91 HB2 GLU 13 HB2 GLU 13 5.590 11.322 -22.235 92 HB3 GLU 13 HB1 GLU 13 7.253 10.822 -21.959 93 HG2 GLU 13 HG2 GLU 13 7.047 9.058 -23.576 94 HG3 GLU 13 HG1 GLU 13 5.328 9.393 -23.777 95 HA PRO 14 HA PRO 14 6.968 10.062 -17.110 96 HB2 PRO 14 HB2 PRO 14 7.136 7.655 -15.905 97 HB3 PRO 14 HB1 PRO 14 5.595 8.496 -16.117 98 HG2 PRO 14 HG2 PRO 14 6.774 6.265 -17.728 99 HG3 PRO 14 HG1 PRO 14 5.105 6.480 -17.167 100 HD2 PRO 14 HD2 PRO 14 5.918 7.068 -19.702 101 HD3 PRO 14 HD1 PRO 14 4.578 7.902 -18.892 102 H THR 15 HN THR 15 9.036 10.501 -16.688 103 HA THR 15 HA THR 15 11.156 9.266 -18.127 104 HB THR 15 HB THR 15 12.374 10.638 -16.066 105 HG1 THR 15 HG1 THR 15 10.089 12.151 -16.733 106 HG21 THR 15 HG21 THR 15 11.700 12.581 -17.984 107 HG22 THR 15 HG22 THR 15 11.901 11.052 -18.840 108 HG23 THR 15 HG23 THR 15 13.204 11.675 -17.826 109 H THR 16 HN THR 16 13.221 8.939 -16.362 110 HA THR 16 HA THR 16 12.393 6.501 -14.976 111 HB THR 16 HB THR 16 15.224 7.429 -15.432 112 HG1 THR 16 HG1 THR 16 15.087 6.836 -17.433 113 HG21 THR 16 HG21 THR 16 15.266 4.755 -15.665 114 HG22 THR 16 HG22 THR 16 13.962 4.949 -14.493 115 HG23 THR 16 HG23 THR 16 15.559 5.617 -14.155 116 HA PRO 17 HA PRO 17 12.780 9.105 -11.280 117 HB2 PRO 17 HB2 PRO 17 11.285 7.554 -9.668 118 HB3 PRO 17 HB1 PRO 17 10.559 8.626 -10.871 119 HG2 PRO 17 HG2 PRO 17 11.057 5.677 -11.018 120 HG3 PRO 17 HG1 PRO 17 9.622 6.593 -11.512 121 HD2 PRO 17 HD2 PRO 17 11.532 5.747 -13.265 122 HD3 PRO 17 HD1 PRO 17 10.551 7.204 -13.521 123 H THR 18 HN THR 18 13.604 8.712 -9.099 124 HA THR 18 HA THR 18 15.497 6.457 -9.060 125 HB THR 18 HB THR 18 16.541 8.680 -9.095 126 HG1 THR 18 HG1 THR 18 16.790 7.375 -6.590 127 HG21 THR 18 HG21 THR 18 15.145 10.201 -8.080 128 HG22 THR 18 HG22 THR 18 16.385 9.952 -6.851 129 HG23 THR 18 HG23 THR 18 14.822 9.147 -6.704 130 H THR 19 HN THR 19 12.612 7.387 -7.743 131 HA THR 19 HA THR 19 13.163 6.038 -5.175 132 HB THR 19 HB THR 19 12.424 8.272 -4.767 133 HG1 THR 19 HG1 THR 19 10.934 7.721 -3.380 134 HG21 THR 19 HG21 THR 19 10.563 7.768 -6.981 135 HG22 THR 19 HG22 THR 19 11.331 9.265 -6.452 136 HG23 THR 19 HG23 THR 19 9.901 8.664 -5.614 137 H ASN 20 HN ASN 20 12.887 4.196 -6.989 138 HA ASN 20 HA ASN 20 10.241 3.513 -7.737 139 HB2 ASN 20 HB2 ASN 20 12.698 1.764 -7.487 140 HB3 ASN 20 HB1 ASN 20 11.196 1.291 -8.276 141 HD21 ASN 20 HD21 ASN 20 10.499 3.418 -9.726 142 HD22 ASN 20 HD22 ASN 20 11.706 3.790 -10.904 143 H LEU 21 HN LEU 21 8.675 2.587 -6.630 144 HA LEU 21 HA LEU 21 8.847 2.085 -3.867 145 HB2 LEU 21 HB2 LEU 21 6.644 0.985 -5.565 146 HB3 LEU 21 HB1 LEU 21 6.565 1.647 -3.945 147 HG LEU 21 HG LEU 21 7.346 3.567 -6.049 148 HD11 LEU 21 HD11 LEU 21 5.737 2.557 -7.391 149 HD12 LEU 21 HD12 LEU 21 4.860 3.856 -6.585 150 HD13 LEU 21 HD13 LEU 21 4.685 2.194 -6.022 151 HD21 LEU 21 HD21 LEU 21 6.651 3.750 -3.455 152 HD22 LEU 21 HD22 LEU 21 5.094 4.052 -4.227 153 HD23 LEU 21 HD23 LEU 21 6.485 5.063 -4.620 154 H LYS 22 HN LYS 22 10.325 0.534 -3.416 155 HA LYS 22 HA LYS 22 10.722 -1.879 -4.689 156 HB2 LYS 22 HB2 LYS 22 11.454 -0.694 -2.150 157 HB3 LYS 22 HB1 LYS 22 11.215 -2.425 -2.028 158 HG2 LYS 22 HG2 LYS 22 12.694 -2.357 -4.253 159 HG3 LYS 22 HG1 LYS 22 13.291 -0.902 -3.454 160 HD2 LYS 22 HD2 LYS 22 14.649 -2.249 -2.303 161 HD3 LYS 22 HD1 LYS 22 13.214 -2.783 -1.426 162 HE2 LYS 22 HE2 LYS 22 13.888 -4.818 -2.144 163 HE3 LYS 22 HE1 LYS 22 13.019 -4.341 -3.602 164 HZ1 LYS 22 HZ1 LYS 22 15.102 -5.113 -4.311 165 HZ2 LYS 22 HZ2 LYS 22 15.938 -4.259 -3.114 166 HZ3 LYS 22 HZ3 LYS 22 15.214 -3.427 -4.397 167 H ILE 23 HN ILE 23 10.293 -4.072 -3.685 168 HA ILE 23 HA ILE 23 7.524 -4.535 -3.753 169 HB ILE 23 HB ILE 23 9.942 -5.997 -3.997 170 HG12 ILE 23 HG12 ILE 23 7.481 -7.421 -4.587 171 HG13 ILE 23 HG11 ILE 23 7.468 -5.760 -5.158 172 HG21 ILE 23 HG21 ILE 23 9.598 -6.913 -1.794 173 HG22 ILE 23 HG22 ILE 23 9.267 -8.149 -3.008 174 HG23 ILE 23 HG23 ILE 23 7.937 -7.332 -2.196 175 HD11 ILE 23 HD11 ILE 23 9.194 -6.076 -6.625 176 HD12 ILE 23 HD12 ILE 23 8.380 -7.643 -6.688 177 HD13 ILE 23 HD13 ILE 23 9.842 -7.449 -5.722 178 H TYR 24 HN TYR 24 6.207 -5.657 -2.371 179 HA TYR 24 HA TYR 24 6.645 -5.303 0.521 180 HB2 TYR 24 HB2 TYR 24 4.331 -5.133 -1.271 181 HB3 TYR 24 HB1 TYR 24 4.055 -5.982 0.212 182 HD1 TYR 24 HD2 TYR 24 5.282 -2.703 -1.071 183 HD2 TYR 24 HD1 TYR 24 3.396 -4.832 2.073 184 HE1 TYR 24 HE2 TYR 24 4.760 -0.586 0.051 185 HE2 TYR 24 HE1 TYR 24 2.857 -2.729 3.200 186 HH TYR 24 HH TYR 24 2.545 -0.380 2.617 187 H LYS 25 HN LYS 25 5.501 -7.238 1.725 188 HA LYS 25 HA LYS 25 5.884 -9.670 0.100 189 HB2 LYS 25 HB2 LYS 25 6.649 -9.052 2.897 190 HB3 LYS 25 HB1 LYS 25 6.166 -10.697 2.490 191 HG2 LYS 25 HG2 LYS 25 8.512 -10.646 2.296 192 HG3 LYS 25 HG1 LYS 25 7.887 -10.617 0.647 193 HD2 LYS 25 HD2 LYS 25 8.103 -8.083 0.780 194 HD3 LYS 25 HD1 LYS 25 9.048 -8.347 2.244 195 HE2 LYS 25 HE2 LYS 25 9.678 -9.513 -0.464 196 HE3 LYS 25 HE1 LYS 25 10.449 -8.087 0.229 197 HZ1 LYS 25 HZ1 LYS 25 10.706 -10.907 1.026 198 HZ2 LYS 25 HZ2 LYS 25 10.967 -9.692 2.174 199 HZ3 LYS 25 HZ3 LYS 25 11.915 -9.750 0.775 200 H VAL 26 HN VAL 26 3.914 -10.491 -0.400 201 HA VAL 26 HA VAL 26 1.711 -10.005 1.346 202 HB VAL 26 HB VAL 26 1.176 -11.949 -0.746 203 HG11 VAL 26 HG11 VAL 26 0.154 -9.264 0.048 204 HG12 VAL 26 HG12 VAL 26 -0.461 -10.825 0.582 205 HG13 VAL 26 HG13 VAL 26 -0.629 -10.339 -1.110 206 HG21 VAL 26 HG21 VAL 26 2.253 -10.982 -2.435 207 HG22 VAL 26 HG22 VAL 26 2.834 -9.694 -1.383 208 HG23 VAL 26 HG23 VAL 26 1.266 -9.547 -2.166 209 H ASP 27 HN ASP 27 2.472 -10.952 3.096 210 HA ASP 27 HA ASP 27 2.968 -13.780 3.239 211 HB2 ASP 27 HB2 ASP 27 3.137 -11.538 5.179 212 HB3 ASP 27 HB1 ASP 27 3.053 -13.164 5.823 213 H ASP 28 HN ASP 28 0.280 -11.691 3.775 214 HA ASP 28 HA ASP 28 -1.502 -13.876 3.916 215 HB2 ASP 28 HB2 ASP 28 -0.326 -13.780 6.249 216 HB3 ASP 28 HB1 ASP 28 -1.423 -12.434 6.533 217 H LEU 29 HN LEU 29 -3.163 -13.068 2.835 218 HA LEU 29 HA LEU 29 -4.233 -10.517 3.691 219 HB2 LEU 29 HB2 LEU 29 -3.620 -9.595 1.800 220 HB3 LEU 29 HB1 LEU 29 -3.233 -11.134 1.108 221 HG LEU 29 HG LEU 29 -6.086 -10.602 1.374 222 HD11 LEU 29 HD11 LEU 29 -5.890 -9.271 -0.837 223 HD12 LEU 29 HD12 LEU 29 -4.297 -8.856 -0.208 224 HD13 LEU 29 HD13 LEU 29 -5.745 -8.467 0.731 225 HD21 LEU 29 HD21 LEU 29 -6.224 -11.868 -0.528 226 HD22 LEU 29 HD22 LEU 29 -4.815 -12.518 0.309 227 HD23 LEU 29 HD23 LEU 29 -4.598 -11.427 -1.060 228 H GLN 30 HN GLN 30 -6.322 -10.423 3.934 229 HA GLN 30 HA GLN 30 -7.981 -12.724 3.192 230 HB2 GLN 30 HB2 GLN 30 -7.394 -11.562 5.819 231 HB3 GLN 30 HB1 GLN 30 -9.107 -11.676 5.484 232 HG2 GLN 30 HG2 GLN 30 -8.314 -13.630 6.666 233 HG3 GLN 30 HG1 GLN 30 -8.883 -14.056 5.052 234 HE21 GLN 30 HE21 GLN 30 -7.147 -13.914 3.368 235 HE22 GLN 30 HE22 GLN 30 -5.604 -14.562 3.780 236 H LYS 31 HN LYS 31 -10.295 -12.337 3.142 237 HA LYS 31 HA LYS 31 -10.862 -9.799 1.955 238 HB2 LYS 31 HB2 LYS 31 -12.060 -12.167 1.610 239 HB3 LYS 31 HB1 LYS 31 -13.051 -11.593 2.940 240 HG2 LYS 31 HG2 LYS 31 -13.591 -11.180 0.327 241 HG3 LYS 31 HG1 LYS 31 -14.183 -10.169 1.643 242 HD2 LYS 31 HD2 LYS 31 -12.608 -8.496 1.216 243 HD3 LYS 31 HD1 LYS 31 -11.578 -9.582 0.285 244 HE2 LYS 31 HE2 LYS 31 -12.888 -7.896 -1.055 245 HE3 LYS 31 HE1 LYS 31 -13.062 -9.580 -1.550 246 HZ1 LYS 31 HZ1 LYS 31 -15.148 -8.103 -1.318 247 HZ2 LYS 31 HZ2 LYS 31 -14.988 -8.402 0.339 248 HZ3 LYS 31 HZ3 LYS 31 -15.198 -9.691 -0.735 249 H ILE 32 HN ILE 32 -10.635 -8.173 3.340 250 HA ILE 32 HA ILE 32 -11.706 -8.455 6.065 251 HB ILE 32 HB ILE 32 -9.278 -6.974 5.072 252 HG12 ILE 32 HG12 ILE 32 -9.774 -9.763 5.572 253 HG13 ILE 32 HG11 ILE 32 -8.389 -8.985 4.832 254 HG21 ILE 32 HG21 ILE 32 -10.188 -7.534 7.866 255 HG22 ILE 32 HG22 ILE 32 -9.849 -5.968 7.118 256 HG23 ILE 32 HG23 ILE 32 -8.517 -7.107 7.436 257 HD11 ILE 32 HD11 ILE 32 -8.472 -10.321 7.215 258 HD12 ILE 32 HD12 ILE 32 -8.401 -8.619 7.671 259 HD13 ILE 32 HD13 ILE 32 -7.177 -9.306 6.613 260 H ASN 33 HN ASN 33 -13.330 -7.139 6.535 261 HA ASN 33 HA ASN 33 -14.732 -5.355 6.612 262 HB2 ASN 33 HB2 ASN 33 -12.216 -3.939 5.723 263 HB3 ASN 33 HB1 ASN 33 -13.710 -3.105 6.124 264 HD21 ASN 33 HD21 ASN 33 -11.925 -2.192 7.601 265 HD22 ASN 33 HD22 ASN 33 -11.843 -2.902 9.173 266 H GLY 34 HN GLY 34 -14.697 -6.999 4.297 267 HA2 GLY 34 HA2 GLY 34 -15.826 -7.051 2.305 268 HA3 GLY 34 HA1 GLY 34 -16.152 -5.343 2.512 269 H ILE 35 HN ILE 35 -12.898 -5.750 2.882 270 HA ILE 35 HA ILE 35 -12.307 -5.486 0.030 271 HB ILE 35 HB ILE 35 -10.487 -3.864 1.473 272 HG12 ILE 35 HG12 ILE 35 -13.104 -2.563 1.878 273 HG13 ILE 35 HG11 ILE 35 -12.758 -3.894 2.967 274 HG21 ILE 35 HG21 ILE 35 -11.029 -3.552 -0.850 275 HG22 ILE 35 HG22 ILE 35 -11.406 -2.074 0.035 276 HG23 ILE 35 HG23 ILE 35 -12.702 -3.169 -0.445 277 HD11 ILE 35 HD11 ILE 35 -12.107 -1.540 3.688 278 HD12 ILE 35 HD12 ILE 35 -10.771 -1.713 2.549 279 HD13 ILE 35 HD13 ILE 35 -10.934 -2.840 3.897 280 H TRP 36 HN TRP 36 -10.431 -6.502 -0.586 281 HA TRP 36 HA TRP 36 -9.348 -8.474 1.086 282 HB2 TRP 36 HB2 TRP 36 -8.262 -7.209 -1.446 283 HB3 TRP 36 HB1 TRP 36 -7.565 -8.634 -0.682 284 HD1 TRP 36 HD1 TRP 36 -10.054 -7.692 -3.225 285 HE1 TRP 36 HE1 TRP 36 -11.546 -9.697 -3.841 286 HE3 TRP 36 HE3 TRP 36 -8.795 -10.846 0.596 287 HZ2 TRP 36 HZ2 TRP 36 -12.116 -12.276 -2.837 288 HZ3 TRP 36 HZ3 TRP 36 -9.862 -13.060 0.701 289 HH2 TRP 36 HH2 TRP 36 -11.489 -13.759 -0.981 290 H GLN 37 HN GLN 37 -7.720 -8.409 2.594 291 HA GLN 37 HA GLN 37 -6.240 -5.875 2.815 292 HB2 GLN 37 HB2 GLN 37 -7.712 -6.127 4.662 293 HB3 GLN 37 HB1 GLN 37 -7.172 -7.769 4.945 294 HG2 GLN 37 HG2 GLN 37 -4.881 -6.252 5.130 295 HG3 GLN 37 HG1 GLN 37 -6.129 -5.276 5.881 296 HE21 GLN 37 HE21 GLN 37 -5.523 -8.784 5.858 297 HE22 GLN 37 HE22 GLN 37 -5.438 -8.936 7.597 298 H VAL 38 HN VAL 38 -4.075 -5.912 3.316 299 HA VAL 38 HA VAL 38 -2.823 -8.540 2.844 300 HB VAL 38 HB VAL 38 -1.662 -5.797 2.252 301 HG11 VAL 38 HG11 VAL 38 0.137 -7.273 2.381 302 HG12 VAL 38 HG12 VAL 38 -0.288 -7.377 0.671 303 HG13 VAL 38 HG13 VAL 38 -0.798 -8.644 1.785 304 HG21 VAL 38 HG21 VAL 38 -3.593 -7.456 0.798 305 HG22 VAL 38 HG22 VAL 38 -2.178 -7.020 -0.163 306 HG23 VAL 38 HG23 VAL 38 -3.159 -5.759 0.586 307 H ARG 39 HN ARG 39 -0.917 -9.139 3.777 308 HA ARG 39 HA ARG 39 0.159 -7.551 5.971 309 HB2 ARG 39 HB2 ARG 39 -0.790 -10.407 6.311 310 HB3 ARG 39 HB1 ARG 39 0.144 -9.503 7.478 311 HG2 ARG 39 HG2 ARG 39 -1.591 -8.264 8.137 312 HG3 ARG 39 HG1 ARG 39 -2.363 -8.271 6.560 313 HD2 ARG 39 HD2 ARG 39 -3.653 -9.542 8.221 314 HD3 ARG 39 HD1 ARG 39 -3.094 -10.559 6.895 315 HE ARG 39 HE ARG 39 -1.183 -10.759 8.877 316 HH11 ARG 39 HH11 ARG 39 -4.585 -11.456 8.541 317 HH12 ARG 39 HH12 ARG 39 -4.559 -12.760 9.680 318 HH21 ARG 39 HH21 ARG 39 -1.146 -12.479 10.374 319 HH22 ARG 39 HH22 ARG 39 -2.608 -13.341 10.720 320 H ASN 40 HN ASN 40 2.378 -7.947 6.349 321 HA ASN 40 HA ASN 40 3.575 -10.167 4.924 322 HB2 ASN 40 HB2 ASN 40 5.486 -8.019 5.086 323 HB3 ASN 40 HB1 ASN 40 5.064 -9.046 3.750 324 HD21 ASN 40 HD21 ASN 40 5.713 -6.215 3.903 325 HD22 ASN 40 HD22 ASN 40 4.450 -5.467 3.007 326 H ASN 41 HN ASN 41 5.368 -10.919 5.861 327 HA ASN 41 HA ASN 41 5.359 -11.011 8.613 328 HB2 ASN 41 HB2 ASN 41 7.719 -12.072 8.240 329 HB3 ASN 41 HB1 ASN 41 6.302 -12.880 7.583 330 HD21 ASN 41 HD21 ASN 41 7.026 -10.048 5.930 331 HD22 ASN 41 HD22 ASN 41 7.779 -10.722 4.564 332 H ILE 42 HN ILE 42 6.859 -8.640 6.575 333 HA ILE 42 HA ILE 42 8.902 -7.901 8.372 334 HB ILE 42 HB ILE 42 7.840 -6.352 6.053 335 HG12 ILE 42 HG12 ILE 42 10.094 -7.533 5.158 336 HG13 ILE 42 HG11 ILE 42 9.458 -8.800 6.195 337 HG21 ILE 42 HG21 ILE 42 9.209 -4.930 7.129 338 HG22 ILE 42 HG22 ILE 42 10.384 -5.766 6.116 339 HG23 ILE 42 HG23 ILE 42 10.196 -6.218 7.808 340 HD11 ILE 42 HD11 ILE 42 8.550 -9.211 4.085 341 HD12 ILE 42 HD12 ILE 42 8.152 -7.510 3.839 342 HD13 ILE 42 HD13 ILE 42 7.262 -8.460 5.031 343 H LEU 43 HN LEU 43 5.928 -6.487 7.142 344 HA LEU 43 HA LEU 43 5.925 -4.572 9.316 345 HB2 LEU 43 HB2 LEU 43 4.093 -4.677 6.944 346 HB3 LEU 43 HB1 LEU 43 4.240 -3.371 8.098 347 HG LEU 43 HG LEU 43 5.436 -2.500 6.402 348 HD11 LEU 43 HD11 LEU 43 6.967 -2.631 8.287 349 HD12 LEU 43 HD12 LEU 43 7.834 -2.742 6.756 350 HD13 LEU 43 HD13 LEU 43 7.545 -4.193 7.713 351 HD21 LEU 43 HD21 LEU 43 7.080 -4.234 5.143 352 HD22 LEU 43 HD22 LEU 43 5.449 -3.815 4.612 353 HD23 LEU 43 HD23 LEU 43 5.721 -5.277 5.565 354 H VAL 44 HN VAL 44 4.632 -7.578 8.462 355 HA VAL 44 HA VAL 44 2.727 -7.339 10.628 356 HB VAL 44 HB VAL 44 1.678 -8.503 8.148 357 HG11 VAL 44 HG11 VAL 44 -0.027 -7.077 10.059 358 HG12 VAL 44 HG12 VAL 44 0.778 -8.512 10.688 359 HG13 VAL 44 HG13 VAL 44 -0.266 -8.639 9.276 360 HG21 VAL 44 HG21 VAL 44 2.470 -6.056 7.878 361 HG22 VAL 44 HG22 VAL 44 1.076 -5.680 8.884 362 HG23 VAL 44 HG23 VAL 44 0.854 -6.496 7.338 363 HA PRO 45 HA PRO 45 5.193 -11.269 10.617 364 HB2 PRO 45 HB2 PRO 45 4.523 -10.506 13.419 365 HB3 PRO 45 HB1 PRO 45 5.995 -11.287 12.831 366 HG2 PRO 45 HG2 PRO 45 6.051 -8.760 13.415 367 HG3 PRO 45 HG1 PRO 45 6.734 -9.265 11.851 368 HD2 PRO 45 HD2 PRO 45 4.077 -8.016 12.448 369 HD3 PRO 45 HD1 PRO 45 5.200 -7.689 11.142 370 H THR 46 HN THR 46 2.377 -10.008 12.133 371 HA THR 46 HA THR 46 0.514 -11.805 11.279 372 HB THR 46 HB THR 46 1.876 -13.465 12.592 373 HG1 THR 46 HG1 THR 46 0.041 -14.445 12.655 374 HG21 THR 46 HG21 THR 46 2.405 -13.180 14.711 375 HG22 THR 46 HG22 THR 46 0.716 -12.914 15.142 376 HG23 THR 46 HG23 THR 46 1.720 -11.557 14.629 377 H ASP 47 HN ASP 47 -1.576 -11.522 12.251 378 HA ASP 47 HA ASP 47 -3.209 -10.443 13.455 379 HB2 ASP 47 HB2 ASP 47 -1.263 -9.015 15.099 380 HB3 ASP 47 HB1 ASP 47 -2.813 -9.683 15.568 381 H PHE 48 HN PHE 48 -2.820 -9.133 11.172 382 HA PHE 48 HA PHE 48 -2.203 -6.390 11.647 383 HB2 PHE 48 HB2 PHE 48 -2.101 -8.004 9.453 384 HB3 PHE 48 HB1 PHE 48 -3.598 -7.140 9.169 385 HD1 PHE 48 HD2 PHE 48 -1.470 -4.947 10.964 386 HD2 PHE 48 HD1 PHE 48 -2.055 -6.681 7.125 387 HE1 PHE 48 HE2 PHE 48 -0.192 -3.123 9.911 388 HE2 PHE 48 HE1 PHE 48 -0.756 -4.892 6.100 389 HZ PHE 48 HZ PHE 48 0.168 -3.101 7.484 390 H THR 49 HN THR 49 -3.744 -5.293 12.707 391 HA THR 49 HA THR 49 -6.293 -6.047 13.260 392 HB THR 49 HB THR 49 -6.021 -3.177 12.669 393 HG1 THR 49 HG1 THR 49 -4.498 -4.382 14.740 394 HG21 THR 49 HG21 THR 49 -6.887 -4.755 15.050 395 HG22 THR 49 HG22 THR 49 -7.878 -3.820 13.919 396 HG23 THR 49 HG23 THR 49 -6.767 -2.993 15.017 397 H TRP 50 HN TRP 50 -7.286 -7.005 11.587 398 HA TRP 50 HA TRP 50 -7.661 -6.300 8.977 399 HB2 TRP 50 HB2 TRP 50 -9.574 -7.437 10.994 400 HB3 TRP 50 HB1 TRP 50 -10.012 -7.268 9.353 401 HD1 TRP 50 HD1 TRP 50 -6.469 -8.409 9.923 402 HE1 TRP 50 HE1 TRP 50 -6.267 -10.923 9.426 403 HE3 TRP 50 HE3 TRP 50 -11.429 -9.539 9.476 404 HZ2 TRP 50 HZ2 TRP 50 -7.988 -13.103 8.908 405 HZ3 TRP 50 HZ3 TRP 50 -12.069 -11.860 8.976 406 HH2 TRP 50 HH2 TRP 50 -10.384 -13.605 8.698 407 H VAL 51 HN VAL 51 -8.994 -4.839 11.814 408 HA VAL 51 HA VAL 51 -11.181 -3.472 10.908 409 HB VAL 51 HB VAL 51 -10.333 -3.598 13.293 410 HG11 VAL 51 HG11 VAL 51 -8.842 -2.018 14.147 411 HG12 VAL 51 HG12 VAL 51 -8.900 -1.045 12.678 412 HG13 VAL 51 HG13 VAL 51 -8.072 -2.601 12.671 413 HG21 VAL 51 HG21 VAL 51 -12.076 -1.882 12.071 414 HG22 VAL 51 HG22 VAL 51 -11.018 -0.787 12.965 415 HG23 VAL 51 HG23 VAL 51 -11.881 -2.070 13.815 416 H ASP 52 HN ASP 52 -7.949 -2.270 11.186 417 HA ASP 52 HA ASP 52 -8.311 -0.635 8.837 418 HB2 ASP 52 HB2 ASP 52 -9.207 0.680 10.691 419 HB3 ASP 52 HB1 ASP 52 -7.664 0.545 11.509 420 H ASN 53 HN ASN 53 -6.304 -2.284 10.967 421 HA ASN 53 HA ASN 53 -3.915 -0.984 10.024 422 HB2 ASN 53 HB2 ASN 53 -4.179 -3.365 11.843 423 HB3 ASN 53 HB1 ASN 53 -2.693 -2.513 11.489 424 HD21 ASN 53 HD21 ASN 53 -5.183 -0.261 11.678 425 HD22 ASN 53 HD22 ASN 53 -5.019 0.181 13.330 426 H GLY 54 HN GLY 54 -5.879 -3.385 9.030 427 HA2 GLY 54 HA2 GLY 54 -3.895 -4.869 7.652 428 HA3 GLY 54 HA1 GLY 54 -5.646 -5.023 7.550 429 H ILE 55 HN ILE 55 -3.456 -4.604 5.545 430 HA ILE 55 HA ILE 55 -4.106 -2.063 4.406 431 HB ILE 55 HB ILE 55 -2.031 -2.377 3.641 432 HG12 ILE 55 HG12 ILE 55 -2.013 -3.990 1.553 433 HG13 ILE 55 HG11 ILE 55 -3.739 -3.763 1.729 434 HG21 ILE 55 HG21 ILE 55 -0.896 -4.454 3.367 435 HG22 ILE 55 HG22 ILE 55 -2.380 -5.274 3.841 436 HG23 ILE 55 HG23 ILE 55 -1.562 -4.219 4.979 437 HD11 ILE 55 HD11 ILE 55 -1.671 -1.685 1.304 438 HD12 ILE 55 HD12 ILE 55 -3.315 -1.319 1.822 439 HD13 ILE 55 HD13 ILE 55 -3.038 -2.108 0.272 440 H ALA 56 HN ALA 56 -5.862 -1.691 3.161 441 HA ALA 56 HA ALA 56 -7.318 -3.877 2.097 442 HB1 ALA 56 HB1 ALA 56 -7.684 -0.970 2.226 443 HB2 ALA 56 HB2 ALA 56 -8.882 -2.260 2.335 444 HB3 ALA 56 HB3 ALA 56 -8.314 -1.715 0.757 445 H ALA 57 HN ALA 57 -5.899 -4.991 0.941 446 HA ALA 57 HA ALA 57 -4.027 -4.341 -0.725 447 HB1 ALA 57 HB1 ALA 57 -5.203 -6.639 -0.265 448 HB2 ALA 57 HB2 ALA 57 -4.112 -6.411 -1.634 449 HB3 ALA 57 HB3 ALA 57 -5.860 -6.347 -1.876 450 H ASP 58 HN ASP 58 -7.388 -3.925 -1.568 451 HA ASP 58 HA ASP 58 -7.188 -3.495 -4.288 452 HB2 ASP 58 HB2 ASP 58 -9.295 -3.609 -2.923 453 HB3 ASP 58 HB1 ASP 58 -8.977 -1.941 -2.503 454 H ASP 59 HN ASP 59 -6.497 -1.371 -1.628 455 HA ASP 59 HA ASP 59 -6.164 1.023 -3.045 456 HB2 ASP 59 HB2 ASP 59 -4.681 0.274 -0.536 457 HB3 ASP 59 HB1 ASP 59 -5.285 1.835 -1.025 458 H VAL 60 HN VAL 60 -4.028 -1.725 -2.483 459 HA VAL 60 HA VAL 60 -1.794 -0.219 -3.537 460 HB VAL 60 HB VAL 60 -0.425 -2.014 -2.804 461 HG11 VAL 60 HG11 VAL 60 -2.397 -0.986 -0.825 462 HG12 VAL 60 HG12 VAL 60 -0.835 -0.302 -1.253 463 HG13 VAL 60 HG13 VAL 60 -0.912 -1.830 -0.378 464 HG21 VAL 60 HG21 VAL 60 -2.383 -3.472 -1.303 465 HG22 VAL 60 HG22 VAL 60 -1.158 -4.063 -2.431 466 HG23 VAL 60 HG23 VAL 60 -2.714 -3.500 -3.029 467 H ILE 61 HN ILE 61 -0.236 -1.968 -4.699 468 HA ILE 61 HA ILE 61 -1.761 -3.277 -6.761 469 HB ILE 61 HB ILE 61 0.168 -2.114 -8.203 470 HG12 ILE 61 HG12 ILE 61 -0.827 0.139 -6.674 471 HG13 ILE 61 HG11 ILE 61 0.348 -0.814 -5.841 472 HG21 ILE 61 HG21 ILE 61 -1.613 -0.895 -9.100 473 HG22 ILE 61 HG22 ILE 61 -2.316 -0.669 -7.487 474 HG23 ILE 61 HG23 ILE 61 -2.425 -2.250 -8.293 475 HD11 ILE 61 HD11 ILE 61 2.027 -0.177 -7.149 476 HD12 ILE 61 HD12 ILE 61 0.976 1.223 -7.383 477 HD13 ILE 61 HD13 ILE 61 1.006 -0.073 -8.581 478 H GLU 62 HN GLU 62 -1.079 -5.272 -6.725 479 HA GLU 62 HA GLU 62 1.311 -6.190 -5.621 480 HB2 GLU 62 HB2 GLU 62 0.647 -8.299 -6.948 481 HB3 GLU 62 HB1 GLU 62 -0.397 -7.753 -5.656 482 HG2 GLU 62 HG2 GLU 62 -2.098 -7.403 -7.051 483 HG3 GLU 62 HG1 GLU 62 -1.072 -6.593 -8.233 484 H VAL 63 HN VAL 63 3.279 -6.168 -6.312 485 HA VAL 63 HA VAL 63 3.781 -5.923 -9.191 486 HB VAL 63 HB VAL 63 6.162 -5.405 -8.317 487 HG11 VAL 63 HG11 VAL 63 5.198 -3.581 -9.293 488 HG12 VAL 63 HG12 VAL 63 5.339 -3.008 -7.636 489 HG13 VAL 63 HG13 VAL 63 3.795 -3.618 -8.227 490 HG21 VAL 63 HG21 VAL 63 4.646 -4.712 -5.825 491 HG22 VAL 63 HG22 VAL 63 6.380 -4.582 -6.105 492 HG23 VAL 63 HG23 VAL 63 5.621 -6.170 -5.999 493 H THR 64 HN THR 64 5.471 -7.258 -10.132 494 HA THR 64 HA THR 64 5.556 -9.892 -8.913 495 HB THR 64 HB THR 64 6.262 -10.739 -10.952 496 HG1 THR 64 HG1 THR 64 7.627 -8.349 -11.186 497 HG21 THR 64 HG21 THR 64 4.291 -10.145 -11.811 498 HG22 THR 64 HG22 THR 64 5.263 -9.032 -12.773 499 HG23 THR 64 HG23 THR 64 4.454 -8.462 -11.315 500 H SER 65 HN SER 65 7.649 -11.049 -8.732 501 HA SER 65 HA SER 65 9.335 -10.072 -6.906 502 HB2 SER 65 HB2 SER 65 9.362 -12.392 -7.842 503 HB3 SER 65 HB1 SER 65 10.309 -11.787 -9.202 504 HG SER 65 HG SER 65 11.856 -11.061 -7.598 505 H ASN 66 HN ASN 66 9.608 -9.383 -10.362 506 HA ASN 66 HA ASN 66 12.106 -8.065 -10.125 507 HB2 ASN 66 HB2 ASN 66 10.708 -9.093 -12.201 508 HB3 ASN 66 HB1 ASN 66 10.426 -7.371 -12.374 509 HD21 ASN 66 HD21 ASN 66 13.122 -9.545 -11.638 510 HD22 ASN 66 HD22 ASN 66 14.262 -8.761 -12.672 511 H GLY 67 HN GLY 67 9.043 -7.249 -9.246 512 HA2 GLY 67 HA2 GLY 67 8.398 -5.285 -8.157 513 HA3 GLY 67 HA1 GLY 67 9.722 -4.438 -8.936 514 H THR 68 HN THR 68 7.671 -6.494 -10.813 515 HA THR 68 HA THR 68 6.927 -4.344 -12.495 516 HB THR 68 HB THR 68 6.706 -7.247 -12.504 517 HG1 THR 68 HG1 THR 68 6.675 -5.483 -14.705 518 HG21 THR 68 HG21 THR 68 4.904 -7.286 -14.199 519 HG22 THR 68 HG22 THR 68 4.517 -5.626 -13.739 520 HG23 THR 68 HG23 THR 68 4.364 -6.926 -12.560 521 H ARG 69 HN ARG 69 5.384 -2.919 -12.074 522 HA ARG 69 HA ARG 69 3.460 -3.345 -10.022 523 HB2 ARG 69 HB2 ARG 69 4.333 -1.125 -11.676 524 HB3 ARG 69 HB1 ARG 69 2.591 -1.122 -11.422 525 HG2 ARG 69 HG2 ARG 69 2.812 -0.950 -9.101 526 HG3 ARG 69 HG1 ARG 69 4.507 -1.438 -9.140 527 HD2 ARG 69 HD2 ARG 69 4.317 0.848 -10.754 528 HD3 ARG 69 HD1 ARG 69 3.360 1.188 -9.315 529 HE ARG 69 HE ARG 69 5.354 0.647 -8.000 530 HH11 ARG 69 HH11 ARG 69 5.816 1.406 -11.387 531 HH12 ARG 69 HH12 ARG 69 7.460 1.897 -11.170 532 HH21 ARG 69 HH21 ARG 69 7.510 1.289 -7.733 533 HH22 ARG 69 HH22 ARG 69 8.420 1.831 -9.103 534 H THR 70 HN THR 70 1.374 -3.803 -10.048 535 HA THR 70 HA THR 70 -0.474 -4.929 -10.770 536 HB THR 70 HB THR 70 -1.231 -2.730 -11.173 537 HG1 THR 70 HG1 THR 70 -2.688 -3.128 -12.706 538 HG21 THR 70 HG21 THR 70 0.652 -1.770 -12.329 539 HG22 THR 70 HG22 THR 70 -0.824 -1.505 -13.256 540 HG23 THR 70 HG23 THR 70 0.315 -2.756 -13.752 541 H SER 71 HN SER 71 0.862 -6.793 -11.417 542 HA SER 71 HA SER 71 1.307 -7.148 -14.262 543 HB2 SER 71 HB2 SER 71 2.805 -8.031 -12.339 544 HB3 SER 71 HB1 SER 71 1.599 -9.308 -12.187 545 HG SER 71 HG SER 71 1.958 -9.673 -14.489 546 H ASP 72 HN ASP 72 -0.664 -8.649 -11.712 547 HA ASP 72 HA ASP 72 -2.244 -10.039 -13.752 548 HB2 ASP 72 HB2 ASP 72 -2.121 -10.289 -10.743 549 HB3 ASP 72 HB1 ASP 72 -3.302 -11.141 -11.732 550 H GLN 73 HN GLN 73 -2.414 -7.426 -11.472 551 HA GLN 73 HA GLN 73 -3.896 -5.672 -11.428 552 HB2 GLN 73 HB2 GLN 73 -4.614 -6.522 -13.778 553 HB3 GLN 73 HB1 GLN 73 -5.972 -7.238 -12.920 554 HG2 GLN 73 HG2 GLN 73 -6.325 -4.872 -11.961 555 HG3 GLN 73 HG1 GLN 73 -5.284 -4.352 -13.286 556 HE21 GLN 73 HE21 GLN 73 -8.377 -4.620 -12.412 557 HE22 GLN 73 HE22 GLN 73 -9.126 -4.848 -13.952 558 H VAL 74 HN VAL 74 -4.692 -8.913 -10.710 559 HA VAL 74 HA VAL 74 -6.618 -8.067 -8.651 560 HB VAL 74 HB VAL 74 -6.202 -10.865 -9.710 561 HG11 VAL 74 HG11 VAL 74 -7.179 -10.860 -7.525 562 HG12 VAL 74 HG12 VAL 74 -8.448 -11.226 -8.693 563 HG13 VAL 74 HG13 VAL 74 -8.335 -9.613 -7.989 564 HG21 VAL 74 HG21 VAL 74 -7.066 -9.897 -11.593 565 HG22 VAL 74 HG22 VAL 74 -7.899 -8.629 -10.695 566 HG23 VAL 74 HG23 VAL 74 -8.561 -10.263 -10.734 567 H LEU 75 HN LEU 75 -5.494 -7.722 -6.805 568 HA LEU 75 HA LEU 75 -3.048 -8.858 -6.137 569 HB2 LEU 75 HB2 LEU 75 -4.795 -7.042 -4.980 570 HB3 LEU 75 HB1 LEU 75 -4.614 -8.294 -3.777 571 HG LEU 75 HG LEU 75 -2.148 -7.218 -5.043 572 HD11 LEU 75 HD11 LEU 75 -2.655 -5.661 -2.748 573 HD12 LEU 75 HD12 LEU 75 -4.071 -5.527 -3.790 574 HD13 LEU 75 HD13 LEU 75 -2.472 -5.121 -4.416 575 HD21 LEU 75 HD21 LEU 75 -2.654 -7.785 -2.147 576 HD22 LEU 75 HD22 LEU 75 -1.140 -7.848 -3.048 577 HD23 LEU 75 HD23 LEU 75 -2.362 -9.096 -3.289 578 H GLN 76 HN GLN 76 -2.416 -10.440 -4.773 579 HA GLN 76 HA GLN 76 -4.278 -12.292 -3.600 580 HB2 GLN 76 HB2 GLN 76 -2.290 -13.385 -5.589 581 HB3 GLN 76 HB1 GLN 76 -3.594 -14.242 -4.785 582 HG2 GLN 76 HG2 GLN 76 -5.201 -13.401 -6.193 583 HG3 GLN 76 HG1 GLN 76 -4.251 -11.977 -6.603 584 HE21 GLN 76 HE21 GLN 76 -3.522 -15.442 -6.710 585 HE22 GLN 76 HE22 GLN 76 -3.102 -15.475 -8.385 586 H LYS 77 HN LYS 77 -3.417 -13.120 -1.797 587 HA LYS 77 HA LYS 77 -0.828 -12.266 -0.977 588 HB2 LYS 77 HB2 LYS 77 -1.255 -13.067 1.119 589 HB3 LYS 77 HB1 LYS 77 -2.837 -12.564 0.534 590 HG2 LYS 77 HG2 LYS 77 -1.842 -15.398 0.462 591 HG3 LYS 77 HG1 LYS 77 -2.818 -14.732 1.768 592 HD2 LYS 77 HD2 LYS 77 -4.505 -14.112 -0.049 593 HD3 LYS 77 HD1 LYS 77 -3.584 -15.179 -1.105 594 HE2 LYS 77 HE2 LYS 77 -4.330 -17.047 -0.080 595 HE3 LYS 77 HE1 LYS 77 -4.315 -16.301 1.517 596 HZ1 LYS 77 HZ1 LYS 77 -6.542 -16.895 0.199 597 HZ2 LYS 77 HZ2 LYS 77 -6.322 -15.305 -0.334 598 HZ3 LYS 77 HZ3 LYS 77 -6.443 -15.632 1.321 599 H GLY 78 HN GLY 78 0.928 -13.453 -0.279 600 HA2 GLY 78 HA2 GLY 78 1.959 -15.648 -0.009 601 HA3 GLY 78 HA1 GLY 78 1.078 -16.161 -1.443 602 H GLY 79 HN GLY 79 2.317 -12.946 -1.497 603 HA2 GLY 79 HA2 GLY 79 4.796 -13.854 -2.761 604 HA3 GLY 79 HA1 GLY 79 3.642 -13.054 -3.809 605 H TYR 80 HN TYR 80 3.744 -10.969 -3.998 606 HA TYR 80 HA TYR 80 4.840 -9.261 -1.949 607 HB2 TYR 80 HB2 TYR 80 6.068 -8.807 -4.605 608 HB3 TYR 80 HB1 TYR 80 6.763 -8.612 -3.007 609 HD1 TYR 80 HD1 TYR 80 5.879 -11.154 -5.560 610 HD2 TYR 80 HD2 TYR 80 8.216 -10.236 -2.125 611 HE1 TYR 80 HE1 TYR 80 7.153 -13.235 -5.879 612 HE2 TYR 80 HE2 TYR 80 9.496 -12.313 -2.432 613 HH TYR 80 HH TYR 80 8.710 -14.602 -5.027 614 H PHE 81 HN PHE 81 4.553 -6.968 -2.501 615 HA PHE 81 HA PHE 81 2.980 -6.378 -4.839 616 HB2 PHE 81 HB2 PHE 81 1.132 -5.264 -3.589 617 HB3 PHE 81 HB1 PHE 81 1.131 -7.015 -3.479 618 HD1 PHE 81 HD2 PHE 81 2.655 -7.876 -1.436 619 HD2 PHE 81 HD1 PHE 81 0.653 -4.114 -1.681 620 HE1 PHE 81 HE2 PHE 81 2.581 -7.740 1.030 621 HE2 PHE 81 HE1 PHE 81 0.576 -3.973 0.744 622 HZ PHE 81 HZ PHE 81 1.544 -5.784 2.125 623 H VAL 82 HN VAL 82 2.246 -4.050 -4.752 624 HA VAL 82 HA VAL 82 4.207 -2.448 -3.288 625 HB VAL 82 HB VAL 82 4.067 -2.843 -6.190 626 HG11 VAL 82 HG11 VAL 82 3.097 -0.420 -5.615 627 HG12 VAL 82 HG12 VAL 82 4.173 -0.699 -6.979 628 HG13 VAL 82 HG13 VAL 82 4.813 -0.054 -5.468 629 HG21 VAL 82 HG21 VAL 82 5.976 -3.109 -4.396 630 HG22 VAL 82 HG22 VAL 82 6.266 -1.416 -4.789 631 HG23 VAL 82 HG23 VAL 82 6.339 -2.639 -6.055 632 H ILE 83 HN ILE 83 3.229 -0.829 -2.299 633 HA ILE 83 HA ILE 83 0.437 -0.395 -2.675 634 HB ILE 83 HB ILE 83 2.480 1.077 -1.089 635 HG12 ILE 83 HG12 ILE 83 1.919 -0.176 0.745 636 HG13 ILE 83 HG11 ILE 83 0.255 -0.365 0.219 637 HG21 ILE 83 HG21 ILE 83 -0.450 1.572 -1.326 638 HG22 ILE 83 HG22 ILE 83 0.882 2.713 -1.493 639 HG23 ILE 83 HG23 ILE 83 0.465 2.073 0.096 640 HD11 ILE 83 HD11 ILE 83 1.522 -2.465 0.311 641 HD12 ILE 83 HD12 ILE 83 2.592 -1.847 -0.938 642 HD13 ILE 83 HD13 ILE 83 0.889 -2.113 -1.295 643 H ASN 84 HN ASN 84 -0.298 0.670 -4.386 644 HA ASN 84 HA ASN 84 1.166 2.367 -5.987 645 HB2 ASN 84 HB2 ASN 84 -1.445 1.429 -5.913 646 HB3 ASN 84 HB1 ASN 84 -1.608 3.168 -5.779 647 HD21 ASN 84 HD21 ASN 84 -2.000 1.059 -7.978 648 HD22 ASN 84 HD22 ASN 84 -1.297 1.806 -9.363 649 HA PRO 85 HA PRO 85 1.627 5.773 -3.022 650 HB2 PRO 85 HB2 PRO 85 3.138 7.343 -4.580 651 HB3 PRO 85 HB1 PRO 85 3.808 5.862 -3.870 652 HG2 PRO 85 HG2 PRO 85 2.550 6.213 -6.587 653 HG3 PRO 85 HG1 PRO 85 4.153 5.598 -6.207 654 HD2 PRO 85 HD2 PRO 85 2.213 3.882 -6.627 655 HD3 PRO 85 HD1 PRO 85 3.308 3.620 -5.247 656 H ASN 86 HN ASN 86 0.629 5.902 -6.278 657 HA ASN 86 HA ASN 86 -0.392 8.523 -6.164 658 HB2 ASN 86 HB2 ASN 86 -0.185 6.418 -8.171 659 HB3 ASN 86 HB1 ASN 86 -1.685 7.323 -8.284 660 HD21 ASN 86 HD21 ASN 86 1.794 7.827 -7.906 661 HD22 ASN 86 HD22 ASN 86 1.877 9.230 -8.911 662 H ASN 87 HN ASN 87 -1.597 5.377 -5.467 663 HA ASN 87 HA ASN 87 -4.357 6.169 -5.229 664 HB2 ASN 87 HB2 ASN 87 -2.806 3.818 -5.255 665 HB3 ASN 87 HB1 ASN 87 -3.694 3.908 -3.747 666 HD21 ASN 87 HD21 ASN 87 -4.096 1.947 -5.478 667 HD22 ASN 87 HD22 ASN 87 -5.670 2.063 -6.187 668 H VAL 88 HN VAL 88 -1.555 6.685 -3.621 669 HA VAL 88 HA VAL 88 -2.556 6.487 -0.995 670 HB VAL 88 HB VAL 88 0.122 6.992 -2.215 671 HG11 VAL 88 HG11 VAL 88 0.625 6.831 0.419 672 HG12 VAL 88 HG12 VAL 88 -0.972 7.598 0.467 673 HG13 VAL 88 HG13 VAL 88 0.353 8.363 -0.416 674 HG21 VAL 88 HG21 VAL 88 -1.378 4.774 -1.416 675 HG22 VAL 88 HG22 VAL 88 -0.117 4.974 -0.186 676 HG23 VAL 88 HG23 VAL 88 0.324 4.804 -1.904 677 H LYS 89 HN LYS 89 -3.044 7.995 0.122 678 HA LYS 89 HA LYS 89 -3.214 10.690 -0.841 679 HB2 LYS 89 HB2 LYS 89 -4.023 9.541 1.789 680 HB3 LYS 89 HB1 LYS 89 -4.435 11.137 1.210 681 HG2 LYS 89 HG2 LYS 89 -6.230 9.393 1.111 682 HG3 LYS 89 HG1 LYS 89 -5.933 10.289 -0.373 683 HD2 LYS 89 HD2 LYS 89 -4.646 7.640 0.131 684 HD3 LYS 89 HD1 LYS 89 -6.299 7.748 -0.469 685 HE2 LYS 89 HE2 LYS 89 -4.371 9.417 -1.896 686 HE3 LYS 89 HE1 LYS 89 -4.058 7.684 -1.991 687 HZ1 LYS 89 HZ1 LYS 89 -5.732 9.008 -3.608 688 HZ2 LYS 89 HZ2 LYS 89 -6.815 8.471 -2.426 689 HZ3 LYS 89 HZ3 LYS 89 -5.862 7.356 -3.267 690 H SER 90 HN SER 90 -1.805 8.813 1.680 691 HA SER 90 HA SER 90 0.637 10.171 1.826 692 HB2 SER 90 HB2 SER 90 0.452 11.935 3.234 693 HB3 SER 90 HB1 SER 90 -1.233 11.913 2.722 694 HG SER 90 HG SER 90 -1.554 10.454 4.577 695 H VAL 91 HN VAL 91 1.778 9.891 4.021 696 HA VAL 91 HA VAL 91 1.020 7.336 5.191 697 HB VAL 91 HB VAL 91 3.572 7.791 6.045 698 HG11 VAL 91 HG11 VAL 91 3.964 6.268 3.814 699 HG12 VAL 91 HG12 VAL 91 2.222 6.120 4.071 700 HG13 VAL 91 HG13 VAL 91 3.345 5.672 5.357 701 HG21 VAL 91 HG21 VAL 91 3.301 8.949 3.292 702 HG22 VAL 91 HG22 VAL 91 4.814 8.247 3.858 703 HG23 VAL 91 HG23 VAL 91 4.117 9.630 4.700 704 H GLY 92 HN GLY 92 0.121 7.547 7.110 705 HA2 GLY 92 HA2 GLY 92 0.269 10.001 8.565 706 HA3 GLY 92 HA1 GLY 92 -0.824 8.661 8.861 707 H THR 93 HN THR 93 -0.069 9.655 10.913 708 HA THR 93 HA THR 93 2.385 9.081 12.155 709 HB THR 93 HB THR 93 -0.146 9.196 13.707 710 HG1 THR 93 HG1 THR 93 -0.327 11.438 13.242 711 HG21 THR 93 HG21 THR 93 2.458 10.663 13.827 712 HG22 THR 93 HG22 THR 93 1.874 9.424 14.938 713 HG23 THR 93 HG23 THR 93 1.087 11.001 14.879 714 HA PRO 94 HA PRO 94 2.113 4.843 12.983 715 HB2 PRO 94 HB2 PRO 94 4.330 4.659 14.352 716 HB3 PRO 94 HB1 PRO 94 4.370 5.262 12.686 717 HG2 PRO 94 HG2 PRO 94 4.261 6.884 15.197 718 HG3 PRO 94 HG1 PRO 94 5.467 6.963 13.903 719 HD2 PRO 94 HD2 PRO 94 3.373 8.605 13.969 720 HD3 PRO 94 HD1 PRO 94 4.018 7.971 12.441 721 H MET 95 HN MET 95 1.880 3.374 14.638 722 HA MET 95 HA MET 95 1.462 4.280 17.365 723 HB2 MET 95 HB2 MET 95 -0.743 3.071 15.694 724 HB3 MET 95 HB1 MET 95 -0.787 3.140 17.450 725 HG2 MET 95 HG2 MET 95 -0.581 5.611 17.293 726 HG3 MET 95 HG1 MET 95 -0.732 5.461 15.542 727 HE1 MET 95 HE1 MET 95 -3.845 6.978 17.500 728 HE2 MET 95 HE2 MET 95 -2.126 6.934 17.893 729 HE3 MET 95 HE3 MET 95 -3.263 5.932 18.795 730 H LYS 96 HN LYS 96 1.966 2.712 18.834 731 HA LYS 96 HA LYS 96 2.918 0.184 17.763 732 HB2 LYS 96 HB2 LYS 96 3.009 1.348 20.554 733 HB3 LYS 96 HB1 LYS 96 3.681 -0.217 20.120 734 HG2 LYS 96 HG2 LYS 96 4.808 1.518 18.284 735 HG3 LYS 96 HG1 LYS 96 4.788 2.438 19.790 736 HD2 LYS 96 HD2 LYS 96 5.692 0.123 20.748 737 HD3 LYS 96 HD1 LYS 96 6.268 -0.038 19.087 738 HE2 LYS 96 HE2 LYS 96 7.757 1.671 19.293 739 HE3 LYS 96 HE1 LYS 96 6.755 2.550 20.446 740 HZ1 LYS 96 HZ1 LYS 96 8.588 0.288 20.952 741 HZ2 LYS 96 HZ2 LYS 96 7.359 0.678 22.047 742 HZ3 LYS 96 HZ3 LYS 96 8.561 1.812 21.686 743 H GLY 97 HN GLY 97 1.725 -1.646 17.726 744 HA2 GLY 97 HA2 GLY 97 -0.012 -2.341 19.871 745 HA3 GLY 97 HA1 GLY 97 -0.940 -1.720 18.519 746 H SER 98 HN SER 98 0.206 -2.789 16.330 747 HA SER 98 HA SER 98 -0.718 -5.453 16.399 748 HB2 SER 98 HB2 SER 98 0.573 -3.695 14.391 749 HB3 SER 98 HB1 SER 98 0.743 -5.410 14.114 750 HG SER 98 HG SER 98 -1.232 -5.396 13.433 751 H GLY 99 HN GLY 99 0.687 -6.009 18.351 752 HA2 GLY 99 HA2 GLY 99 2.204 -7.866 18.687 753 HA3 GLY 99 HA1 GLY 99 3.184 -7.238 17.373 754 H GLY 100 HN GLY 100 3.547 -4.615 18.041 755 HA2 GLY 100 HA2 GLY 100 4.028 -3.730 20.521 756 HA3 GLY 100 HA1 GLY 100 5.336 -4.864 20.268 757 H LEU 101 HN LEU 101 5.128 -4.012 17.302 758 HA LEU 101 HA LEU 101 7.227 -2.127 17.315 759 HB2 LEU 101 HB2 LEU 101 5.648 -2.715 14.923 760 HB3 LEU 101 HB1 LEU 101 7.363 -2.552 15.133 761 HG LEU 101 HG LEU 101 7.194 -4.827 16.364 762 HD11 LEU 101 HD11 LEU 101 5.444 -6.257 15.685 763 HD12 LEU 101 HD12 LEU 101 4.889 -5.099 14.481 764 HD13 LEU 101 HD13 LEU 101 4.614 -4.784 16.185 765 HD21 LEU 101 HD21 LEU 101 6.679 -4.861 13.469 766 HD22 LEU 101 HD22 LEU 101 7.893 -5.743 14.410 767 HD23 LEU 101 HD23 LEU 101 8.085 -4.009 14.111 768 H SER 102 HN SER 102 6.464 -0.873 14.962 769 HA SER 102 HA SER 102 4.505 1.087 15.885 770 HB2 SER 102 HB2 SER 102 7.182 1.333 14.680 771 HB3 SER 102 HB1 SER 102 5.949 2.488 14.139 772 HG SER 102 HG SER 102 6.246 2.049 16.885 773 H TRP 103 HN TRP 103 2.766 1.041 14.737 774 HA TRP 103 HA TRP 103 2.803 0.249 11.933 775 HB2 TRP 103 HB2 TRP 103 0.681 -0.182 14.012 776 HB3 TRP 103 HB1 TRP 103 0.616 -0.694 12.354 777 HD1 TRP 103 HD1 TRP 103 3.309 -1.063 15.062 778 HE1 TRP 103 HE1 TRP 103 4.206 -3.416 15.001 779 HE3 TRP 103 HE3 TRP 103 0.268 -3.090 11.489 780 HZ2 TRP 103 HZ2 TRP 103 3.722 -5.865 13.698 781 HZ3 TRP 103 HZ3 TRP 103 0.573 -5.446 10.898 782 HH2 TRP 103 HH2 TRP 103 2.254 -6.806 11.999 783 H ALA 104 HN ALA 104 2.372 1.930 10.747 784 HA ALA 104 HA ALA 104 1.002 4.221 11.880 785 HB1 ALA 104 HB1 ALA 104 2.807 4.113 9.501 786 HB2 ALA 104 HB2 ALA 104 3.219 4.694 11.117 787 HB3 ALA 104 HB3 ALA 104 2.040 5.567 10.137 788 H GLN 105 HN GLN 105 -0.462 5.415 10.982 789 HA GLN 105 HA GLN 105 -2.355 4.068 9.380 790 HB2 GLN 105 HB2 GLN 105 -2.667 5.741 11.364 791 HB3 GLN 105 HB1 GLN 105 -2.540 6.946 10.099 792 HG2 GLN 105 HG2 GLN 105 -4.383 6.111 8.969 793 HG3 GLN 105 HG1 GLN 105 -4.394 4.644 9.936 794 HE21 GLN 105 HE21 GLN 105 -6.654 5.145 10.290 795 HE22 GLN 105 HE22 GLN 105 -7.096 6.283 11.512 796 H VAL 106 HN VAL 106 -1.821 3.969 7.163 797 HA VAL 106 HA VAL 106 -0.905 6.471 5.990 798 HB VAL 106 HB VAL 106 -0.693 3.604 5.100 799 HG11 VAL 106 HG11 VAL 106 -0.880 4.339 3.001 800 HG12 VAL 106 HG12 VAL 106 0.699 5.070 3.260 801 HG13 VAL 106 HG13 VAL 106 -0.775 6.017 3.488 802 HG21 VAL 106 HG21 VAL 106 1.735 4.318 4.986 803 HG22 VAL 106 HG22 VAL 106 1.024 4.213 6.601 804 HG23 VAL 106 HG23 VAL 106 1.237 5.793 5.823 805 H ASN 107 HN ASN 107 -2.130 7.504 4.543 806 HA ASN 107 HA ASN 107 -4.895 6.724 4.404 807 HB2 ASN 107 HB2 ASN 107 -3.347 9.202 4.163 808 HB3 ASN 107 HB1 ASN 107 -4.679 9.082 3.025 809 HD21 ASN 107 HD21 ASN 107 -6.743 8.199 4.089 810 HD22 ASN 107 HD22 ASN 107 -7.177 8.945 5.584 811 H PHE 108 HN PHE 108 -5.226 5.213 2.860 812 HA PHE 108 HA PHE 108 -4.078 5.590 0.284 813 HB2 PHE 108 HB2 PHE 108 -5.636 3.274 1.430 814 HB3 PHE 108 HB1 PHE 108 -5.029 3.364 -0.197 815 HD1 PHE 108 HD2 PHE 108 -3.549 3.919 3.176 816 HD2 PHE 108 HD1 PHE 108 -3.314 1.905 -0.560 817 HE1 PHE 108 HE2 PHE 108 -1.516 2.757 3.923 818 HE2 PHE 108 HE1 PHE 108 -1.290 0.743 0.198 819 HZ PHE 108 HZ PHE 108 -0.381 1.171 2.436 820 H THR 109 HN THR 109 -5.396 4.922 -1.460 821 HA THR 109 HA THR 109 -7.387 6.616 -2.139 822 HB THR 109 HB THR 109 -6.091 5.490 -3.728 823 HG1 THR 109 HG1 THR 109 -7.903 5.794 -4.817 824 HG21 THR 109 HG21 THR 109 -7.229 2.895 -3.661 825 HG22 THR 109 HG22 THR 109 -6.566 3.317 -2.079 826 HG23 THR 109 HG23 THR 109 -5.547 3.387 -3.503 827 H THR 110 HN THR 110 -8.031 3.193 -1.791 828 HA THR 110 HA THR 110 -10.861 3.616 -1.665 829 HB THR 110 HB THR 110 -9.864 0.919 -1.243 830 HG1 THR 110 HG1 THR 110 -8.767 0.716 -3.068 831 HG21 THR 110 HG21 THR 110 -11.974 2.253 -2.742 832 HG22 THR 110 HG22 THR 110 -11.937 0.648 -2.011 833 HG23 THR 110 HG23 THR 110 -11.213 0.911 -3.597 834 H GLY 111 HN GLY 111 -8.555 1.895 0.390 835 HA2 GLY 111 HA2 GLY 111 -10.421 1.521 2.465 836 HA3 GLY 111 HA1 GLY 111 -8.698 1.226 2.565 837 H GLY 112 HN GLY 112 -8.752 4.304 1.545 838 HA2 GLY 112 HA2 GLY 112 -8.425 6.306 2.584 839 HA3 GLY 112 HA1 GLY 112 -9.622 5.760 3.747 840 H ASN 113 HN ASN 113 -8.940 4.730 5.647 841 HA ASN 113 HA ASN 113 -6.175 5.251 6.297 842 HB2 ASN 113 HB2 ASN 113 -7.004 4.244 8.550 843 HB3 ASN 113 HB1 ASN 113 -7.560 5.843 8.102 844 HD21 ASN 113 HD21 ASN 113 -8.500 2.555 7.220 845 HD22 ASN 113 HD22 ASN 113 -10.174 2.729 7.625 846 H VAL 114 HN VAL 114 -4.633 3.761 6.367 847 HA VAL 114 HA VAL 114 -5.297 0.931 6.481 848 HB VAL 114 HB VAL 114 -3.380 1.864 4.393 849 HG11 VAL 114 HG11 VAL 114 -3.704 -0.336 3.463 850 HG12 VAL 114 HG12 VAL 114 -4.972 -0.661 4.647 851 HG13 VAL 114 HG13 VAL 114 -3.300 -0.455 5.179 852 HG21 VAL 114 HG21 VAL 114 -6.349 1.574 4.122 853 HG22 VAL 114 HG22 VAL 114 -5.272 1.366 2.740 854 HG23 VAL 114 HG23 VAL 114 -5.322 2.908 3.597 855 H TRP 115 HN TRP 115 -4.027 0.228 8.085 856 HA TRP 115 HA TRP 115 -1.659 1.785 8.651 857 HB2 TRP 115 HB2 TRP 115 -3.022 -0.326 10.263 858 HB3 TRP 115 HB1 TRP 115 -1.560 0.493 10.764 859 HD1 TRP 115 HD1 TRP 115 -5.142 1.381 9.701 860 HE1 TRP 115 HE1 TRP 115 -5.834 3.374 11.097 861 HE3 TRP 115 HE3 TRP 115 -0.775 2.227 12.130 862 HZ2 TRP 115 HZ2 TRP 115 -4.703 5.127 12.899 863 HZ3 TRP 115 HZ3 TRP 115 -0.650 4.133 13.707 864 HH2 TRP 115 HH2 TRP 115 -2.599 5.564 14.088 865 H LEU 116 HN LEU 116 0.329 0.898 9.168 866 HA LEU 116 HA LEU 116 0.952 -1.766 8.223 867 HB2 LEU 116 HB2 LEU 116 1.107 0.377 6.475 868 HB3 LEU 116 HB1 LEU 116 2.747 0.244 7.102 869 HG LEU 116 HG LEU 116 2.143 -2.369 6.481 870 HD11 LEU 116 HD11 LEU 116 1.239 -1.001 4.031 871 HD12 LEU 116 HD12 LEU 116 0.073 -1.093 5.353 872 HD13 LEU 116 HD13 LEU 116 0.780 -2.570 4.695 873 HD21 LEU 116 HD21 LEU 116 4.161 -0.917 5.965 874 HD22 LEU 116 HD22 LEU 116 3.321 -0.456 4.490 875 HD23 LEU 116 HD23 LEU 116 3.742 -2.146 4.778 876 H ASN 117 HN ASN 117 2.894 -2.492 9.166 877 HA ASN 117 HA ASN 117 3.686 -0.955 11.392 878 HB2 ASN 117 HB2 ASN 117 4.157 -2.950 11.943 879 HB3 ASN 117 HB1 ASN 117 4.530 -3.504 10.328 880 HD21 ASN 117 HD21 ASN 117 5.698 -2.510 13.328 881 HD22 ASN 117 HD22 ASN 117 7.389 -2.555 12.979 882 H THR 118 HN THR 118 4.273 0.667 11.131 883 HA THR 118 HA THR 118 5.727 1.793 8.978 884 HB THR 118 HB THR 118 3.834 2.724 10.314 885 HG1 THR 118 HG1 THR 118 4.761 4.166 8.975 886 HG21 THR 118 HG21 THR 118 5.628 4.073 12.157 887 HG22 THR 118 HG22 THR 118 5.445 2.346 12.461 888 HG23 THR 118 HG23 THR 118 4.022 3.386 12.414 889 H THR 119 HN THR 119 7.019 -0.089 11.095 890 HA THR 119 HA THR 119 9.012 1.475 12.353 891 HB THR 119 HB THR 119 8.449 -0.935 12.871 892 HG1 THR 119 HG1 THR 119 11.150 -0.175 12.492 893 HG21 THR 119 HG21 THR 119 10.526 -1.819 10.969 894 HG22 THR 119 HG22 THR 119 8.912 -1.531 10.320 895 HG23 THR 119 HG23 THR 119 9.142 -2.689 11.630 896 H SER 120 HN SER 120 8.561 1.943 9.355 897 HA SER 120 HA SER 120 11.111 2.727 8.673 898 HB2 SER 120 HB2 SER 120 10.229 0.057 7.675 899 HB3 SER 120 HB1 SER 120 11.008 1.135 6.517 900 HG SER 120 HG SER 120 12.598 1.315 8.453 901 H LYS 121 HN LYS 121 10.687 4.445 7.410 902 HA LYS 121 HA LYS 121 8.025 4.940 6.519 903 HB2 LYS 121 HB2 LYS 121 9.522 6.656 7.409 904 HB3 LYS 121 HB1 LYS 121 10.572 6.471 6.010 905 HG2 LYS 121 HG2 LYS 121 8.898 7.322 4.539 906 HG3 LYS 121 HG1 LYS 121 7.680 7.278 5.815 907 HD2 LYS 121 HD2 LYS 121 9.967 8.831 6.636 908 HD3 LYS 121 HD1 LYS 121 9.325 9.428 5.106 909 HE2 LYS 121 HE2 LYS 121 7.088 8.927 6.706 910 HE3 LYS 121 HE1 LYS 121 8.263 9.693 7.773 911 HZ1 LYS 121 HZ1 LYS 121 8.142 11.633 6.662 912 HZ2 LYS 121 HZ2 LYS 121 6.616 11.058 6.213 913 HZ3 LYS 121 HZ3 LYS 121 7.924 10.903 5.151 914 H ASP 122 HN ASP 122 11.109 4.117 5.045 915 HA ASP 122 HA ASP 122 10.160 4.138 2.376 916 HB2 ASP 122 HB2 ASP 122 12.520 2.914 3.754 917 HB3 ASP 122 HB1 ASP 122 12.168 2.557 2.066 918 H ASN 123 HN ASN 123 9.281 2.352 5.027 919 HA ASN 123 HA ASN 123 9.129 -0.258 4.052 920 HB2 ASN 123 HB2 ASN 123 8.796 -0.014 6.414 921 HB3 ASN 123 HB1 ASN 123 7.660 1.299 6.155 922 HD21 ASN 123 HD21 ASN 123 7.629 -1.544 4.242 923 HD22 ASN 123 HD22 ASN 123 6.099 -2.051 4.748 924 H LEU 124 HN LEU 124 6.593 2.119 4.263 925 HA LEU 124 HA LEU 124 4.827 0.641 2.651 926 HB2 LEU 124 HB2 LEU 124 4.503 3.534 2.518 927 HB3 LEU 124 HB1 LEU 124 3.343 2.303 2.970 928 HG LEU 124 HG LEU 124 3.695 3.771 4.801 929 HD11 LEU 124 HD11 LEU 124 4.863 1.010 5.047 930 HD12 LEU 124 HD12 LEU 124 3.318 1.624 5.637 931 HD13 LEU 124 HD13 LEU 124 4.813 2.085 6.447 932 HD21 LEU 124 HD21 LEU 124 6.448 3.609 3.904 933 HD22 LEU 124 HD22 LEU 124 6.302 3.399 5.655 934 HD23 LEU 124 HD23 LEU 124 5.649 4.847 4.885 935 H LEU 125 HN LEU 125 6.742 3.504 2.003 936 HA LEU 125 HA LEU 125 6.227 3.675 -0.712 937 HB2 LEU 125 HB2 LEU 125 8.601 4.504 0.939 938 HB3 LEU 125 HB1 LEU 125 8.410 4.919 -0.736 939 HG LEU 125 HG LEU 125 6.184 6.005 -0.023 940 HD11 LEU 125 HD11 LEU 125 7.043 6.720 2.556 941 HD12 LEU 125 HD12 LEU 125 7.180 4.961 2.444 942 HD13 LEU 125 HD13 LEU 125 5.635 5.751 2.111 943 HD21 LEU 125 HD21 LEU 125 8.717 7.261 1.024 944 HD22 LEU 125 HD22 LEU 125 7.274 8.077 0.419 945 HD23 LEU 125 HD23 LEU 125 8.312 7.180 -0.690 946 H TYR 126 HN TYR 126 8.884 2.044 1.011 947 HA TYR 126 HA TYR 126 9.648 0.833 -1.570 948 HB2 TYR 126 HB2 TYR 126 11.156 2.025 0.607 949 HB3 TYR 126 HB1 TYR 126 11.742 0.424 0.196 950 HD1 TYR 126 HD2 TYR 126 10.685 3.580 -1.451 951 HD2 TYR 126 HD1 TYR 126 13.352 0.271 -1.466 952 HE1 TYR 126 HE2 TYR 126 11.895 4.570 -3.358 953 HE2 TYR 126 HE1 TYR 126 14.570 1.244 -3.368 954 HH TYR 126 HH TYR 126 13.400 4.080 -5.044 955 H GLY 127 HN GLY 127 8.884 0.183 1.805 956 HA2 GLY 127 HA2 GLY 127 7.911 -1.973 2.394 957 HA3 GLY 127 HA1 GLY 127 8.794 -2.694 1.059 958 H LYS 128 HN LYS 128 10.346 -0.399 3.113 959 HA LYS 128 HA LYS 128 12.339 -2.260 3.859 960 HB2 LYS 128 HB2 LYS 128 11.778 0.556 4.764 961 HB3 LYS 128 HB1 LYS 128 13.239 -0.338 5.095 962 HG2 LYS 128 HG2 LYS 128 13.440 -0.548 2.542 963 HG3 LYS 128 HG1 LYS 128 12.272 0.780 2.514 964 HD2 LYS 128 HD2 LYS 128 13.783 2.120 3.926 965 HD3 LYS 128 HD1 LYS 128 14.941 0.787 3.939 966 HE2 LYS 128 HE2 LYS 128 15.194 0.960 1.519 967 HE3 LYS 128 HE1 LYS 128 14.018 2.272 1.480 968 HZ1 LYS 128 HZ1 LYS 128 16.530 2.411 3.046 969 HZ2 LYS 128 HZ2 LYS 128 15.479 3.678 2.661 970 HZ3 LYS 128 HZ3 LYS 128 16.413 2.958 1.449 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 8.699 43.751 -13.452 2 H2 MET 1 HT2 MET 1 7.074 44.177 -13.803 3 H3 MET 1 HT3 MET 1 8.125 43.689 -15.065 4 HA MET 1 HA MET 1 7.423 41.965 -12.796 5 HB2 MET 1 HB2 MET 1 5.790 42.864 -14.990 6 HB3 MET 1 HB1 MET 1 6.082 41.136 -15.137 7 HG2 MET 1 HG2 MET 1 5.336 42.076 -12.453 8 HG3 MET 1 HG1 MET 1 4.089 42.215 -13.691 9 HE1 MET 1 HE1 MET 1 6.182 39.581 -11.466 10 HE2 MET 1 HE2 MET 1 4.656 38.748 -11.170 11 HE3 MET 1 HE3 MET 1 4.772 40.489 -10.917 12 H ARG 2 HN ARG 2 8.685 42.386 -16.079 13 HA ARG 2 HA ARG 2 10.224 41.223 -17.272 14 HB2 ARG 2 HB2 ARG 2 10.775 39.962 -14.582 15 HB3 ARG 2 HB1 ARG 2 11.719 39.624 -16.025 16 HG2 ARG 2 HG2 ARG 2 11.405 42.472 -15.375 17 HG3 ARG 2 HG1 ARG 2 12.334 41.522 -14.214 18 HD2 ARG 2 HD2 ARG 2 13.998 41.060 -15.713 19 HD3 ARG 2 HD1 ARG 2 12.924 41.173 -17.106 20 HE ARG 2 HE ARG 2 13.449 43.386 -17.275 21 HH11 ARG 2 HH11 ARG 2 14.309 42.287 -14.075 22 HH12 ARG 2 HH12 ARG 2 15.091 43.771 -13.642 23 HH21 ARG 2 HH21 ARG 2 14.481 45.336 -16.705 24 HH22 ARG 2 HH22 ARG 2 15.187 45.500 -15.132 25 H GLY 3 HN GLY 3 8.875 40.170 -18.654 26 HA2 GLY 3 HA2 GLY 3 8.685 37.812 -19.447 27 HA3 GLY 3 HA1 GLY 3 8.044 37.448 -17.852 28 H SER 4 HN SER 4 6.814 37.046 -20.480 29 HA SER 4 HA SER 4 4.212 37.990 -19.853 30 HB2 SER 4 HB2 SER 4 3.916 39.371 -21.942 31 HB3 SER 4 HB1 SER 4 4.951 40.103 -20.715 32 HG SER 4 HG SER 4 5.918 38.600 -22.918 33 H HIS 5 HN HIS 5 2.825 37.753 -22.079 34 HA HIS 5 HA HIS 5 2.037 36.369 -23.705 35 HB2 HIS 5 HB2 HIS 5 4.669 36.370 -24.256 36 HB3 HIS 5 HB1 HIS 5 4.474 34.674 -23.832 37 HD1 HIS 5 HD1 HIS 5 4.871 36.262 -26.738 38 HD2 HIS 5 HD2 HIS 5 1.624 34.090 -25.323 39 HE1 HIS 5 HE1 HIS 5 3.612 35.525 -28.787 40 HE2 HIS 5 HE2 HIS 5 1.710 34.127 -27.908 41 H HIS 6 HN HIS 6 4.258 34.082 -22.113 42 HA HIS 6 HA HIS 6 1.892 32.635 -21.115 43 HB2 HIS 6 HB2 HIS 6 4.348 31.621 -22.506 44 HB3 HIS 6 HB1 HIS 6 3.520 30.587 -21.348 45 HD1 HIS 6 HD1 HIS 6 1.687 32.868 -23.729 46 HD2 HIS 6 HD2 HIS 6 2.507 28.828 -23.222 47 HE1 HIS 6 HE1 HIS 6 0.232 31.676 -25.394 48 HE2 HIS 6 HE2 HIS 6 0.760 29.233 -25.087 49 H HIS 7 HN HIS 7 1.894 32.111 -18.996 50 HA HIS 7 HA HIS 7 4.425 32.172 -17.521 51 HB2 HIS 7 HB2 HIS 7 3.348 33.488 -15.701 52 HB3 HIS 7 HB1 HIS 7 3.536 34.393 -17.199 53 HD1 HIS 7 HD1 HIS 7 1.045 33.350 -14.738 54 HD2 HIS 7 HD2 HIS 7 1.043 34.676 -18.675 55 HE1 HIS 7 HE1 HIS 7 -1.323 34.050 -15.210 56 HE2 HIS 7 HE2 HIS 7 -1.279 34.937 -17.567 57 H HIS 8 HN HIS 8 4.627 30.500 -16.189 58 HA HIS 8 HA HIS 8 2.343 28.745 -15.778 59 HB2 HIS 8 HB2 HIS 8 5.308 28.471 -15.421 60 HB3 HIS 8 HB1 HIS 8 4.220 27.336 -14.629 61 HD1 HIS 8 HD1 HIS 8 2.173 26.847 -16.825 62 HD2 HIS 8 HD2 HIS 8 6.268 27.032 -17.509 63 HE1 HIS 8 HE1 HIS 8 2.557 25.574 -18.960 64 HE2 HIS 8 HE2 HIS 8 5.051 25.628 -19.308 65 H HIS 9 HN HIS 9 2.224 27.657 -13.564 66 HA HIS 9 HA HIS 9 2.582 29.673 -11.446 67 HB2 HIS 9 HB2 HIS 9 0.157 28.705 -12.421 68 HB3 HIS 9 HB1 HIS 9 0.412 27.807 -10.928 69 HD1 HIS 9 HD1 HIS 9 1.242 31.445 -11.636 70 HD2 HIS 9 HD2 HIS 9 -1.180 29.135 -9.175 71 HE1 HIS 9 HE1 HIS 9 0.169 33.064 -10.040 72 HE2 HIS 9 HE2 HIS 9 -1.366 31.656 -8.624 73 H HIS 10 HN HIS 10 2.230 26.221 -12.153 74 HA HIS 10 HA HIS 10 3.908 25.606 -9.781 75 HB2 HIS 10 HB2 HIS 10 1.461 24.250 -10.875 76 HB3 HIS 10 HB1 HIS 10 2.677 23.296 -10.034 77 HD1 HIS 10 HD1 HIS 10 -0.323 23.972 -9.076 78 HD2 HIS 10 HD2 HIS 10 3.203 25.657 -7.665 79 HE1 HIS 10 HE1 HIS 10 -0.858 24.820 -6.772 80 HE2 HIS 10 HE2 HIS 10 1.265 25.916 -5.974 81 H GLY 11 HN GLY 11 4.608 26.154 -12.643 82 HA2 GLY 11 HA2 GLY 11 6.183 25.359 -14.114 83 HA3 GLY 11 HA1 GLY 11 6.547 24.108 -12.933 84 H SER 12 HN SER 12 6.828 22.686 -14.763 85 HA SER 12 HA SER 12 4.288 21.837 -15.985 86 HB2 SER 12 HB2 SER 12 6.089 20.595 -17.531 87 HB3 SER 12 HB1 SER 12 5.569 22.252 -17.836 88 HG SER 12 HG SER 12 8.013 21.374 -17.303 89 H GLU 13 HN GLU 13 6.966 20.852 -14.019 90 HA GLU 13 HA GLU 13 5.888 18.111 -13.927 91 HB2 GLU 13 HB2 GLU 13 8.503 18.984 -14.446 92 HB3 GLU 13 HB1 GLU 13 8.542 18.358 -12.804 93 HG2 GLU 13 HG2 GLU 13 8.786 16.349 -13.700 94 HG3 GLU 13 HG1 GLU 13 7.099 16.460 -14.199 95 HA PRO 14 HA PRO 14 4.790 19.300 -9.737 96 HB2 PRO 14 HB2 PRO 14 3.782 16.898 -8.979 97 HB3 PRO 14 HB1 PRO 14 2.887 18.038 -9.992 98 HG2 PRO 14 HG2 PRO 14 4.455 15.616 -10.797 99 HG3 PRO 14 HG1 PRO 14 2.868 16.164 -11.371 100 HD2 PRO 14 HD2 PRO 14 5.137 16.576 -12.779 101 HD3 PRO 14 HD1 PRO 14 3.785 17.726 -12.801 102 H THR 15 HN THR 15 4.940 17.716 -7.576 103 HA THR 15 HA THR 15 7.807 17.360 -7.267 104 HB THR 15 HB THR 15 6.931 16.792 -4.832 105 HG1 THR 15 HG1 THR 15 4.809 18.338 -5.902 106 HG21 THR 15 HG21 THR 15 7.539 18.860 -4.226 107 HG22 THR 15 HG22 THR 15 6.459 19.632 -5.387 108 HG23 THR 15 HG23 THR 15 8.021 19.006 -5.916 109 H THR 16 HN THR 16 8.411 15.472 -8.217 110 HA THR 16 HA THR 16 7.105 13.016 -7.249 111 HB THR 16 HB THR 16 8.521 12.246 -9.478 112 HG1 THR 16 HG1 THR 16 7.299 14.729 -10.082 113 HG21 THR 16 HG21 THR 16 6.531 11.668 -10.365 114 HG22 THR 16 HG22 THR 16 5.783 13.221 -9.988 115 HG23 THR 16 HG23 THR 16 5.985 12.007 -8.724 116 HA PRO 17 HA PRO 17 11.091 12.254 -5.383 117 HB2 PRO 17 HB2 PRO 17 10.554 9.845 -4.309 118 HB3 PRO 17 HB1 PRO 17 9.878 11.338 -3.645 119 HG2 PRO 17 HG2 PRO 17 8.597 9.305 -5.425 120 HG3 PRO 17 HG1 PRO 17 7.916 10.163 -4.032 121 HD2 PRO 17 HD2 PRO 17 7.452 10.870 -6.640 122 HD3 PRO 17 HD1 PRO 17 7.380 12.006 -5.279 123 H THR 18 HN THR 18 12.925 10.960 -5.738 124 HA THR 18 HA THR 18 12.880 9.527 -8.267 125 HB THR 18 HB THR 18 14.648 11.174 -7.888 126 HG1 THR 18 HG1 THR 18 15.603 8.505 -7.956 127 HG21 THR 18 HG21 THR 18 15.891 11.334 -6.065 128 HG22 THR 18 HG22 THR 18 16.290 9.617 -6.101 129 HG23 THR 18 HG23 THR 18 14.807 10.163 -5.317 130 H THR 19 HN THR 19 12.326 8.697 -5.137 131 HA THR 19 HA THR 19 13.833 6.260 -4.982 132 HB THR 19 HB THR 19 12.603 5.879 -2.922 133 HG1 THR 19 HG1 THR 19 10.946 7.938 -3.904 134 HG21 THR 19 HG21 THR 19 12.895 8.172 -1.819 135 HG22 THR 19 HG22 THR 19 13.563 8.662 -3.377 136 HG23 THR 19 HG23 THR 19 14.316 7.352 -2.468 137 H ASN 20 HN ASN 20 13.228 4.236 -5.546 138 HA ASN 20 HA ASN 20 10.756 3.939 -7.065 139 HB2 ASN 20 HB2 ASN 20 12.868 1.819 -6.742 140 HB3 ASN 20 HB1 ASN 20 11.728 2.044 -8.066 141 HD21 ASN 20 HD21 ASN 20 14.570 3.399 -6.502 142 HD22 ASN 20 HD22 ASN 20 15.173 4.230 -7.889 143 H LEU 21 HN LEU 21 9.023 2.904 -6.332 144 HA LEU 21 HA LEU 21 8.783 2.069 -3.674 145 HB2 LEU 21 HB2 LEU 21 6.932 1.089 -5.811 146 HB3 LEU 21 HB1 LEU 21 6.566 1.536 -4.159 147 HG LEU 21 HG LEU 21 7.501 3.671 -6.021 148 HD11 LEU 21 HD11 LEU 21 5.143 4.022 -6.721 149 HD12 LEU 21 HD12 LEU 21 4.751 2.447 -6.032 150 HD13 LEU 21 HD13 LEU 21 5.877 2.564 -7.383 151 HD21 LEU 21 HD21 LEU 21 6.723 5.036 -4.435 152 HD22 LEU 21 HD22 LEU 21 6.660 3.606 -3.406 153 HD23 LEU 21 HD23 LEU 21 5.218 4.132 -4.273 154 H LYS 22 HN LYS 22 10.337 0.555 -3.222 155 HA LYS 22 HA LYS 22 10.833 -1.792 -4.639 156 HB2 LYS 22 HB2 LYS 22 11.497 -0.693 -2.031 157 HB3 LYS 22 HB1 LYS 22 11.316 -2.436 -2.003 158 HG2 LYS 22 HG2 LYS 22 12.844 -2.358 -4.109 159 HG3 LYS 22 HG1 LYS 22 13.282 -0.765 -3.489 160 HD2 LYS 22 HD2 LYS 22 13.868 -1.829 -1.322 161 HD3 LYS 22 HD1 LYS 22 13.546 -3.404 -2.050 162 HE2 LYS 22 HE2 LYS 22 15.374 -1.677 -3.573 163 HE3 LYS 22 HE1 LYS 22 15.978 -2.195 -2.000 164 HZ1 LYS 22 HZ1 LYS 22 15.297 -3.818 -4.354 165 HZ2 LYS 22 HZ2 LYS 22 15.182 -4.511 -2.815 166 HZ3 LYS 22 HZ3 LYS 22 16.661 -3.895 -3.358 167 H ILE 23 HN ILE 23 10.387 -4.028 -3.729 168 HA ILE 23 HA ILE 23 7.611 -4.460 -3.796 169 HB ILE 23 HB ILE 23 10.006 -5.962 -4.084 170 HG12 ILE 23 HG12 ILE 23 7.516 -7.317 -4.711 171 HG13 ILE 23 HG11 ILE 23 7.535 -5.638 -5.248 172 HG21 ILE 23 HG21 ILE 23 9.545 -6.877 -1.857 173 HG22 ILE 23 HG22 ILE 23 9.368 -8.095 -3.120 174 HG23 ILE 23 HG23 ILE 23 7.940 -7.357 -2.400 175 HD11 ILE 23 HD11 ILE 23 9.102 -5.992 -6.810 176 HD12 ILE 23 HD12 ILE 23 8.506 -7.652 -6.709 177 HD13 ILE 23 HD13 ILE 23 9.960 -7.182 -5.832 178 H TYR 24 HN TYR 24 6.332 -5.663 -2.434 179 HA TYR 24 HA TYR 24 6.761 -5.330 0.454 180 HB2 TYR 24 HB2 TYR 24 4.440 -5.256 -1.353 181 HB3 TYR 24 HB1 TYR 24 4.199 -5.972 0.203 182 HD1 TYR 24 HD1 TYR 24 5.492 -2.842 -1.349 183 HD2 TYR 24 HD2 TYR 24 3.520 -4.663 1.936 184 HE1 TYR 24 HE1 TYR 24 5.032 -0.622 -0.403 185 HE2 TYR 24 HE2 TYR 24 3.054 -2.459 2.897 186 HH TYR 24 HH TYR 24 3.519 -0.272 2.769 187 H LYS 25 HN LYS 25 5.622 -7.239 1.651 188 HA LYS 25 HA LYS 25 5.994 -9.677 0.047 189 HB2 LYS 25 HB2 LYS 25 6.601 -9.116 2.913 190 HB3 LYS 25 HB1 LYS 25 6.334 -10.759 2.327 191 HG2 LYS 25 HG2 LYS 25 8.321 -8.975 0.984 192 HG3 LYS 25 HG1 LYS 25 8.749 -9.844 2.457 193 HD2 LYS 25 HD2 LYS 25 7.557 -11.789 0.925 194 HD3 LYS 25 HD1 LYS 25 8.429 -10.825 -0.268 195 HE2 LYS 25 HE2 LYS 25 10.240 -11.051 1.781 196 HE3 LYS 25 HE1 LYS 25 9.439 -12.621 1.795 197 HZ1 LYS 25 HZ1 LYS 25 10.496 -13.216 -0.050 198 HZ2 LYS 25 HZ2 LYS 25 11.461 -11.839 0.123 199 HZ3 LYS 25 HZ3 LYS 25 10.084 -11.786 -0.855 200 H VAL 26 HN VAL 26 4.008 -10.431 -0.495 201 HA VAL 26 HA VAL 26 1.807 -9.940 1.249 202 HB VAL 26 HB VAL 26 1.227 -11.843 -0.861 203 HG11 VAL 26 HG11 VAL 26 0.257 -9.086 -0.290 204 HG12 VAL 26 HG12 VAL 26 -0.264 -10.513 0.602 205 HG13 VAL 26 HG13 VAL 26 -0.604 -10.375 -1.128 206 HG21 VAL 26 HG21 VAL 26 2.375 -10.907 -2.523 207 HG22 VAL 26 HG22 VAL 26 2.930 -9.602 -1.478 208 HG23 VAL 26 HG23 VAL 26 1.378 -9.474 -2.298 209 H ASP 27 HN ASP 27 2.589 -10.907 2.977 210 HA ASP 27 HA ASP 27 3.075 -13.724 3.112 211 HB2 ASP 27 HB2 ASP 27 3.129 -11.507 5.110 212 HB3 ASP 27 HB1 ASP 27 3.219 -13.166 5.671 213 H ASP 28 HN ASP 28 0.367 -11.655 3.661 214 HA ASP 28 HA ASP 28 -1.407 -13.839 3.725 215 HB2 ASP 28 HB2 ASP 28 -0.247 -13.876 6.049 216 HB3 ASP 28 HB1 ASP 28 -1.300 -12.512 6.410 217 H LEU 29 HN LEU 29 -3.061 -13.026 2.694 218 HA LEU 29 HA LEU 29 -4.185 -10.525 3.633 219 HB2 LEU 29 HB2 LEU 29 -3.716 -9.463 1.791 220 HB3 LEU 29 HB1 LEU 29 -3.085 -10.912 1.080 221 HG LEU 29 HG LEU 29 -6.009 -10.751 1.164 222 HD11 LEU 29 HD11 LEU 29 -5.928 -9.316 -0.935 223 HD12 LEU 29 HD12 LEU 29 -4.355 -8.785 -0.340 224 HD13 LEU 29 HD13 LEU 29 -5.803 -8.533 0.642 225 HD21 LEU 29 HD21 LEU 29 -5.846 -11.945 -0.789 226 HD22 LEU 29 HD22 LEU 29 -4.458 -12.472 0.165 227 HD23 LEU 29 HD23 LEU 29 -4.235 -11.319 -1.153 228 H GLN 30 HN GLN 30 -6.295 -10.439 3.789 229 HA GLN 30 HA GLN 30 -7.938 -12.705 2.973 230 HB2 GLN 30 HB2 GLN 30 -7.358 -11.656 5.661 231 HB3 GLN 30 HB1 GLN 30 -9.062 -11.833 5.318 232 HG2 GLN 30 HG2 GLN 30 -8.022 -13.786 6.429 233 HG3 GLN 30 HG1 GLN 30 -8.821 -14.161 4.901 234 HE21 GLN 30 HE21 GLN 30 -7.429 -14.088 2.990 235 HE22 GLN 30 HE22 GLN 30 -5.800 -14.627 3.134 236 H LYS 31 HN LYS 31 -10.265 -12.319 2.988 237 HA LYS 31 HA LYS 31 -10.885 -9.736 1.917 238 HB2 LYS 31 HB2 LYS 31 -12.059 -12.111 1.539 239 HB3 LYS 31 HB1 LYS 31 -13.014 -11.594 2.918 240 HG2 LYS 31 HG2 LYS 31 -13.636 -11.114 0.331 241 HG3 LYS 31 HG1 LYS 31 -14.217 -10.167 1.698 242 HD2 LYS 31 HD2 LYS 31 -12.700 -8.438 1.288 243 HD3 LYS 31 HD1 LYS 31 -11.672 -9.460 0.285 244 HE2 LYS 31 HE2 LYS 31 -13.046 -9.288 -1.546 245 HE3 LYS 31 HE1 LYS 31 -14.481 -8.980 -0.572 246 HZ1 LYS 31 HZ1 LYS 31 -14.169 -6.804 -0.747 247 HZ2 LYS 31 HZ2 LYS 31 -12.968 -7.116 -1.896 248 HZ3 LYS 31 HZ3 LYS 31 -12.550 -6.911 -0.271 249 H ILE 32 HN ILE 32 -10.595 -8.162 3.365 250 HA ILE 32 HA ILE 32 -11.579 -8.554 6.108 251 HB ILE 32 HB ILE 32 -9.182 -7.081 5.055 252 HG12 ILE 32 HG12 ILE 32 -9.716 -9.856 5.682 253 HG13 ILE 32 HG11 ILE 32 -8.383 -9.129 4.801 254 HG21 ILE 32 HG21 ILE 32 -8.377 -7.172 7.410 255 HG22 ILE 32 HG22 ILE 32 -10.049 -7.564 7.877 256 HG23 ILE 32 HG23 ILE 32 -9.692 -6.026 7.086 257 HD11 ILE 32 HD11 ILE 32 -7.045 -9.165 6.543 258 HD12 ILE 32 HD12 ILE 32 -8.133 -10.415 7.109 259 HD13 ILE 32 HD13 ILE 32 -8.313 -8.756 7.681 260 H ASN 33 HN ASN 33 -13.144 -7.247 6.742 261 HA ASN 33 HA ASN 33 -14.507 -5.451 6.992 262 HB2 ASN 33 HB2 ASN 33 -11.866 -4.217 6.328 263 HB3 ASN 33 HB1 ASN 33 -13.292 -3.193 6.374 264 HD21 ASN 33 HD21 ASN 33 -12.217 -5.945 8.332 265 HD22 ASN 33 HD22 ASN 33 -12.319 -5.124 9.849 266 H GLY 34 HN GLY 34 -14.567 -6.918 4.545 267 HA2 GLY 34 HA2 GLY 34 -15.782 -6.792 2.602 268 HA3 GLY 34 HA1 GLY 34 -16.050 -5.096 2.947 269 H ILE 35 HN ILE 35 -12.806 -5.671 3.179 270 HA ILE 35 HA ILE 35 -12.272 -5.164 0.348 271 HB ILE 35 HB ILE 35 -10.383 -3.720 1.898 272 HG12 ILE 35 HG12 ILE 35 -12.969 -2.407 2.447 273 HG13 ILE 35 HG11 ILE 35 -12.641 -3.833 3.412 274 HG21 ILE 35 HG21 ILE 35 -11.076 -1.859 0.564 275 HG22 ILE 35 HG22 ILE 35 -12.623 -2.628 0.209 276 HG23 ILE 35 HG23 ILE 35 -11.131 -3.307 -0.440 277 HD11 ILE 35 HD11 ILE 35 -11.027 -2.844 4.591 278 HD12 ILE 35 HD12 ILE 35 -11.878 -1.376 4.104 279 HD13 ILE 35 HD13 ILE 35 -10.444 -1.901 3.221 280 H TRP 36 HN TRP 36 -10.460 -6.230 -0.410 281 HA TRP 36 HA TRP 36 -9.364 -8.330 1.108 282 HB2 TRP 36 HB2 TRP 36 -8.330 -6.956 -1.391 283 HB3 TRP 36 HB1 TRP 36 -7.643 -8.437 -0.728 284 HD1 TRP 36 HD1 TRP 36 -10.232 -7.263 -3.093 285 HE1 TRP 36 HE1 TRP 36 -11.766 -9.205 -3.801 286 HE3 TRP 36 HE3 TRP 36 -8.825 -10.727 0.395 287 HZ2 TRP 36 HZ2 TRP 36 -12.313 -11.852 -2.987 288 HZ3 TRP 36 HZ3 TRP 36 -9.908 -12.937 0.366 289 HH2 TRP 36 HH2 TRP 36 -11.616 -13.487 -1.291 290 H GLN 37 HN GLN 37 -7.730 -8.328 2.625 291 HA GLN 37 HA GLN 37 -6.178 -5.837 2.849 292 HB2 GLN 37 HB2 GLN 37 -7.641 -6.049 4.694 293 HB3 GLN 37 HB1 GLN 37 -7.163 -7.712 4.971 294 HG2 GLN 37 HG2 GLN 37 -4.820 -6.259 5.154 295 HG3 GLN 37 HG1 GLN 37 -6.039 -5.269 5.935 296 HE21 GLN 37 HE21 GLN 37 -5.365 -8.763 5.841 297 HE22 GLN 37 HE22 GLN 37 -5.335 -8.966 7.572 298 H VAL 38 HN VAL 38 -4.030 -5.891 3.246 299 HA VAL 38 HA VAL 38 -2.784 -8.521 2.779 300 HB VAL 38 HB VAL 38 -1.657 -5.757 2.197 301 HG11 VAL 38 HG11 VAL 38 -0.736 -8.579 1.638 302 HG12 VAL 38 HG12 VAL 38 0.165 -7.232 2.333 303 HG13 VAL 38 HG13 VAL 38 -0.227 -7.238 0.613 304 HG21 VAL 38 HG21 VAL 38 -2.169 -7.011 -0.217 305 HG22 VAL 38 HG22 VAL 38 -3.136 -5.732 0.521 306 HG23 VAL 38 HG23 VAL 38 -3.579 -7.423 0.760 307 H ARG 39 HN ARG 39 -0.866 -9.125 3.709 308 HA ARG 39 HA ARG 39 0.199 -7.532 5.903 309 HB2 ARG 39 HB2 ARG 39 -0.706 -10.404 6.269 310 HB3 ARG 39 HB1 ARG 39 0.200 -9.459 7.425 311 HG2 ARG 39 HG2 ARG 39 -1.567 -8.296 8.090 312 HG3 ARG 39 HG1 ARG 39 -2.299 -8.256 6.495 313 HD2 ARG 39 HD2 ARG 39 -3.653 -9.561 8.040 314 HD3 ARG 39 HD1 ARG 39 -3.009 -10.577 6.754 315 HE ARG 39 HE ARG 39 -1.261 -10.705 8.930 316 HH11 ARG 39 HH11 ARG 39 -4.509 -11.646 8.071 317 HH12 ARG 39 HH12 ARG 39 -4.549 -12.986 9.169 318 HH21 ARG 39 HH21 ARG 39 -1.312 -12.473 10.379 319 HH22 ARG 39 HH22 ARG 39 -2.735 -13.454 10.477 320 H ASN 40 HN ASN 40 2.406 -7.934 6.308 321 HA ASN 40 HA ASN 40 3.617 -10.132 4.874 322 HB2 ASN 40 HB2 ASN 40 5.506 -7.964 5.044 323 HB3 ASN 40 HB1 ASN 40 5.115 -9.012 3.718 324 HD21 ASN 40 HD21 ASN 40 5.720 -6.164 3.901 325 HD22 ASN 40 HD22 ASN 40 4.478 -5.447 2.943 326 H ASN 41 HN ASN 41 5.466 -10.812 5.773 327 HA ASN 41 HA ASN 41 5.441 -10.951 8.528 328 HB2 ASN 41 HB2 ASN 41 7.892 -11.916 8.022 329 HB3 ASN 41 HB1 ASN 41 6.435 -12.811 7.629 330 HD21 ASN 41 HD21 ASN 41 7.361 -10.000 5.896 331 HD22 ASN 41 HD22 ASN 41 7.689 -10.746 4.401 332 H ILE 42 HN ILE 42 6.833 -8.506 6.537 333 HA ILE 42 HA ILE 42 8.908 -7.773 8.316 334 HB ILE 42 HB ILE 42 7.789 -6.240 6.010 335 HG12 ILE 42 HG12 ILE 42 10.077 -7.340 5.103 336 HG13 ILE 42 HG11 ILE 42 9.500 -8.624 6.151 337 HG21 ILE 42 HG21 ILE 42 10.408 -5.678 6.144 338 HG22 ILE 42 HG22 ILE 42 10.024 -5.920 7.845 339 HG23 ILE 42 HG23 ILE 42 9.134 -4.728 6.903 340 HD11 ILE 42 HD11 ILE 42 8.544 -9.133 4.120 341 HD12 ILE 42 HD12 ILE 42 8.191 -7.448 3.747 342 HD13 ILE 42 HD13 ILE 42 7.259 -8.294 4.987 343 H LEU 43 HN LEU 43 5.894 -6.393 7.126 344 HA LEU 43 HA LEU 43 5.865 -4.512 9.329 345 HB2 LEU 43 HB2 LEU 43 3.985 -4.622 6.995 346 HB3 LEU 43 HB1 LEU 43 4.136 -3.331 8.163 347 HG LEU 43 HG LEU 43 5.266 -2.395 6.473 348 HD11 LEU 43 HD11 LEU 43 6.884 -2.571 8.274 349 HD12 LEU 43 HD12 LEU 43 7.675 -2.623 6.700 350 HD13 LEU 43 HD13 LEU 43 7.449 -4.107 7.621 351 HD21 LEU 43 HD21 LEU 43 5.435 -5.108 5.492 352 HD22 LEU 43 HD22 LEU 43 6.873 -4.153 5.121 353 HD23 LEU 43 HD23 LEU 43 5.280 -3.583 4.614 354 H VAL 44 HN VAL 44 4.622 -7.536 8.436 355 HA VAL 44 HA VAL 44 2.716 -7.354 10.613 356 HB VAL 44 HB VAL 44 1.709 -8.541 8.131 357 HG11 VAL 44 HG11 VAL 44 -0.231 -8.716 9.250 358 HG12 VAL 44 HG12 VAL 44 -0.042 -7.129 10.009 359 HG13 VAL 44 HG13 VAL 44 0.794 -8.534 10.672 360 HG21 VAL 44 HG21 VAL 44 2.432 -6.177 7.691 361 HG22 VAL 44 HG22 VAL 44 1.241 -5.680 8.894 362 HG23 VAL 44 HG23 VAL 44 0.724 -6.508 7.426 363 HA PRO 45 HA PRO 45 5.251 -11.240 10.591 364 HB2 PRO 45 HB2 PRO 45 4.596 -10.484 13.397 365 HB3 PRO 45 HB1 PRO 45 6.080 -11.235 12.795 366 HG2 PRO 45 HG2 PRO 45 6.086 -8.703 13.382 367 HG3 PRO 45 HG1 PRO 45 6.771 -9.194 11.814 368 HD2 PRO 45 HD2 PRO 45 4.090 -8.003 12.425 369 HD3 PRO 45 HD1 PRO 45 5.196 -7.653 11.113 370 H THR 46 HN THR 46 2.435 -10.004 12.128 371 HA THR 46 HA THR 46 0.591 -11.836 11.303 372 HB THR 46 HB THR 46 1.959 -13.471 12.625 373 HG1 THR 46 HG1 THR 46 -0.081 -14.024 13.991 374 HG21 THR 46 HG21 THR 46 0.806 -12.627 15.172 375 HG22 THR 46 HG22 THR 46 2.088 -11.578 14.566 376 HG23 THR 46 HG23 THR 46 2.394 -13.298 14.805 377 H ASP 47 HN ASP 47 -1.492 -11.542 12.240 378 HA ASP 47 HA ASP 47 -3.147 -10.481 13.435 379 HB2 ASP 47 HB2 ASP 47 -1.228 -9.029 15.089 380 HB3 ASP 47 HB1 ASP 47 -2.773 -9.709 15.548 381 H PHE 48 HN PHE 48 -2.731 -9.173 11.151 382 HA PHE 48 HA PHE 48 -2.161 -6.421 11.630 383 HB2 PHE 48 HB2 PHE 48 -2.035 -8.040 9.435 384 HB3 PHE 48 HB1 PHE 48 -3.547 -7.203 9.148 385 HD1 PHE 48 HD2 PHE 48 -1.449 -4.973 10.934 386 HD2 PHE 48 HD1 PHE 48 -2.016 -6.720 7.100 387 HE1 PHE 48 HE2 PHE 48 -0.202 -3.129 9.874 388 HE2 PHE 48 HE1 PHE 48 -0.749 -4.914 6.068 389 HZ PHE 48 HZ PHE 48 0.152 -3.104 7.446 390 H THR 49 HN THR 49 -3.735 -5.335 12.674 391 HA THR 49 HA THR 49 -6.268 -6.155 13.223 392 HB THR 49 HB THR 49 -6.096 -3.279 12.645 393 HG1 THR 49 HG1 THR 49 -4.760 -3.095 14.628 394 HG21 THR 49 HG21 THR 49 -7.925 -4.019 13.892 395 HG22 THR 49 HG22 THR 49 -6.856 -3.142 14.992 396 HG23 THR 49 HG23 THR 49 -6.892 -4.906 15.019 397 H TRP 50 HN TRP 50 -7.237 -7.136 11.577 398 HA TRP 50 HA TRP 50 -7.618 -6.462 8.960 399 HB2 TRP 50 HB2 TRP 50 -9.460 -7.677 10.995 400 HB3 TRP 50 HB1 TRP 50 -9.957 -7.505 9.372 401 HD1 TRP 50 HD1 TRP 50 -6.357 -8.526 9.839 402 HE1 TRP 50 HE1 TRP 50 -6.076 -11.017 9.276 403 HE3 TRP 50 HE3 TRP 50 -11.285 -9.833 9.464 404 HZ2 TRP 50 HZ2 TRP 50 -7.723 -13.246 8.742 405 HZ3 TRP 50 HZ3 TRP 50 -11.846 -12.167 8.922 406 HH2 TRP 50 HH2 TRP 50 -10.100 -13.837 8.568 407 H VAL 51 HN VAL 51 -9.015 -5.025 11.780 408 HA VAL 51 HA VAL 51 -11.241 -3.754 10.819 409 HB VAL 51 HB VAL 51 -10.502 -3.833 13.217 410 HG11 VAL 51 HG11 VAL 51 -8.997 -2.319 14.127 411 HG12 VAL 51 HG12 VAL 51 -9.017 -1.298 12.689 412 HG13 VAL 51 HG13 VAL 51 -8.202 -2.861 12.648 413 HG21 VAL 51 HG21 VAL 51 -12.080 -2.313 13.638 414 HG22 VAL 51 HG22 VAL 51 -12.128 -2.040 11.897 415 HG23 VAL 51 HG23 VAL 51 -11.118 -1.019 12.923 416 H ASP 52 HN ASP 52 -8.078 -2.407 11.197 417 HA ASP 52 HA ASP 52 -8.449 -0.793 8.830 418 HB2 ASP 52 HB2 ASP 52 -9.442 0.459 10.677 419 HB3 ASP 52 HB1 ASP 52 -7.907 0.400 11.519 420 H ASN 53 HN ASN 53 -6.409 -2.383 10.968 421 HA ASN 53 HA ASN 53 -4.079 -0.946 10.077 422 HB2 ASN 53 HB2 ASN 53 -4.231 -3.325 11.904 423 HB3 ASN 53 HB1 ASN 53 -2.795 -2.383 11.572 424 HD21 ASN 53 HD21 ASN 53 -5.292 -0.195 11.656 425 HD22 ASN 53 HD22 ASN 53 -5.235 0.240 13.319 426 H GLY 54 HN GLY 54 -5.869 -3.488 9.062 427 HA2 GLY 54 HA2 GLY 54 -3.761 -4.819 7.720 428 HA3 GLY 54 HA1 GLY 54 -5.491 -5.082 7.568 429 H ILE 55 HN ILE 55 -3.366 -4.580 5.580 430 HA ILE 55 HA ILE 55 -4.020 -2.032 4.458 431 HB ILE 55 HB ILE 55 -1.939 -2.378 3.692 432 HG12 ILE 55 HG12 ILE 55 -1.979 -3.942 1.558 433 HG13 ILE 55 HG11 ILE 55 -3.698 -3.637 1.745 434 HG21 ILE 55 HG21 ILE 55 -1.501 -4.275 4.957 435 HG22 ILE 55 HG22 ILE 55 -0.859 -4.469 3.330 436 HG23 ILE 55 HG23 ILE 55 -2.357 -5.269 3.796 437 HD11 ILE 55 HD11 ILE 55 -3.005 -1.951 0.361 438 HD12 ILE 55 HD12 ILE 55 -1.520 -1.693 1.283 439 HD13 ILE 55 HD13 ILE 55 -3.071 -1.202 1.954 440 H ALA 56 HN ALA 56 -5.771 -1.640 3.196 441 HA ALA 56 HA ALA 56 -7.247 -3.807 2.122 442 HB1 ALA 56 HB1 ALA 56 -8.813 -2.206 2.311 443 HB2 ALA 56 HB2 ALA 56 -8.181 -1.594 0.784 444 HB3 ALA 56 HB3 ALA 56 -7.610 -0.919 2.310 445 H ALA 57 HN ALA 57 -5.851 -4.937 0.957 446 HA ALA 57 HA ALA 57 -3.959 -4.304 -0.700 447 HB1 ALA 57 HB1 ALA 57 -4.098 -6.357 -1.672 448 HB2 ALA 57 HB2 ALA 57 -5.857 -6.281 -1.813 449 HB3 ALA 57 HB3 ALA 57 -5.110 -6.584 -0.245 450 H ASP 58 HN ASP 58 -7.311 -3.814 -1.550 451 HA ASP 58 HA ASP 58 -7.093 -3.403 -4.272 452 HB2 ASP 58 HB2 ASP 58 -9.205 -3.465 -2.909 453 HB3 ASP 58 HB1 ASP 58 -8.853 -1.801 -2.504 454 H ASP 59 HN ASP 59 -6.391 -1.274 -1.619 455 HA ASP 59 HA ASP 59 -6.012 1.098 -3.061 456 HB2 ASP 59 HB2 ASP 59 -4.565 0.340 -0.531 457 HB3 ASP 59 HB1 ASP 59 -5.123 1.911 -1.044 458 H VAL 60 HN VAL 60 -3.915 -1.681 -2.470 459 HA VAL 60 HA VAL 60 -1.662 -0.216 -3.527 460 HB VAL 60 HB VAL 60 -0.319 -2.029 -2.811 461 HG11 VAL 60 HG11 VAL 60 -0.824 -1.883 -0.376 462 HG12 VAL 60 HG12 VAL 60 -2.265 -0.967 -0.834 463 HG13 VAL 60 HG13 VAL 60 -0.667 -0.353 -1.235 464 HG21 VAL 60 HG21 VAL 60 -2.327 -3.471 -1.342 465 HG22 VAL 60 HG22 VAL 60 -1.063 -4.073 -2.419 466 HG23 VAL 60 HG23 VAL 60 -2.593 -3.505 -3.079 467 H ILE 61 HN ILE 61 -0.121 -1.891 -4.723 468 HA ILE 61 HA ILE 61 -1.643 -3.213 -6.784 469 HB ILE 61 HB ILE 61 0.310 -2.048 -8.206 470 HG12 ILE 61 HG12 ILE 61 -0.733 0.169 -6.622 471 HG13 ILE 61 HG11 ILE 61 0.506 -0.766 -5.864 472 HG21 ILE 61 HG21 ILE 61 -2.200 -0.641 -7.504 473 HG22 ILE 61 HG22 ILE 61 -2.266 -2.210 -8.341 474 HG23 ILE 61 HG23 ILE 61 -1.470 -0.822 -9.107 475 HD11 ILE 61 HD11 ILE 61 2.076 0.185 -7.041 476 HD12 ILE 61 HD12 ILE 61 0.852 1.320 -7.594 477 HD13 ILE 61 HD13 ILE 61 1.218 -0.121 -8.545 478 H GLU 62 HN GLU 62 -0.994 -5.226 -6.595 479 HA GLU 62 HA GLU 62 1.486 -6.024 -5.583 480 HB2 GLU 62 HB2 GLU 62 0.725 -8.194 -5.886 481 HB3 GLU 62 HB1 GLU 62 -0.721 -7.271 -5.592 482 HG2 GLU 62 HG2 GLU 62 -1.607 -7.883 -7.521 483 HG3 GLU 62 HG1 GLU 62 -0.155 -7.452 -8.415 484 H VAL 63 HN VAL 63 3.388 -6.232 -6.409 485 HA VAL 63 HA VAL 63 3.616 -6.251 -9.335 486 HB VAL 63 HB VAL 63 5.979 -5.488 -8.875 487 HG11 VAL 63 HG11 VAL 63 4.982 -3.138 -7.988 488 HG12 VAL 63 HG12 VAL 63 3.519 -3.927 -8.577 489 HG13 VAL 63 HG13 VAL 63 4.890 -3.690 -9.659 490 HG21 VAL 63 HG21 VAL 63 6.642 -4.729 -6.782 491 HG22 VAL 63 HG22 VAL 63 5.769 -6.216 -6.419 492 HG23 VAL 63 HG23 VAL 63 4.986 -4.655 -6.182 493 H THR 64 HN THR 64 5.471 -7.496 -10.199 494 HA THR 64 HA THR 64 5.636 -10.062 -8.852 495 HB THR 64 HB THR 64 6.491 -10.954 -10.835 496 HG1 THR 64 HG1 THR 64 8.161 -9.840 -11.491 497 HG21 THR 64 HG21 THR 64 4.527 -8.808 -11.365 498 HG22 THR 64 HG22 THR 64 4.407 -10.548 -11.612 499 HG23 THR 64 HG23 THR 64 5.322 -9.558 -12.749 500 H SER 65 HN SER 65 7.779 -11.126 -8.620 501 HA SER 65 HA SER 65 9.385 -10.049 -6.789 502 HB2 SER 65 HB2 SER 65 11.279 -11.465 -8.063 503 HB3 SER 65 HB1 SER 65 9.974 -12.219 -7.148 504 HG SER 65 HG SER 65 9.816 -11.646 -9.919 505 H ASN 66 HN ASN 66 9.707 -9.392 -10.239 506 HA ASN 66 HA ASN 66 12.141 -7.967 -9.932 507 HB2 ASN 66 HB2 ASN 66 10.918 -9.148 -12.030 508 HB3 ASN 66 HB1 ASN 66 10.550 -7.454 -12.292 509 HD21 ASN 66 HD21 ASN 66 11.863 -6.711 -13.793 510 HD22 ASN 66 HD22 ASN 66 13.571 -6.960 -13.856 511 H GLY 67 HN GLY 67 8.993 -7.258 -9.267 512 HA2 GLY 67 HA2 GLY 67 8.242 -5.254 -8.286 513 HA3 GLY 67 HA1 GLY 67 9.536 -4.393 -9.105 514 H THR 68 HN THR 68 7.669 -6.699 -10.858 515 HA THR 68 HA THR 68 6.855 -4.701 -12.693 516 HB THR 68 HB THR 68 6.860 -7.610 -12.556 517 HG1 THR 68 HG1 THR 68 8.046 -7.133 -14.196 518 HG21 THR 68 HG21 THR 68 5.182 -7.878 -14.344 519 HG22 THR 68 HG22 THR 68 4.657 -6.223 -14.029 520 HG23 THR 68 HG23 THR 68 4.502 -7.451 -12.774 521 H ARG 69 HN ARG 69 5.171 -3.420 -12.480 522 HA ARG 69 HA ARG 69 3.145 -3.852 -10.522 523 HB2 ARG 69 HB2 ARG 69 3.869 -1.747 -12.429 524 HB3 ARG 69 HB1 ARG 69 2.135 -1.900 -12.181 525 HG2 ARG 69 HG2 ARG 69 2.231 -1.125 -10.071 526 HG3 ARG 69 HG1 ARG 69 3.781 -1.899 -9.743 527 HD2 ARG 69 HD2 ARG 69 3.828 0.607 -9.769 528 HD3 ARG 69 HD1 ARG 69 4.976 -0.177 -10.852 529 HE ARG 69 HE ARG 69 2.527 0.446 -12.170 530 HH11 ARG 69 HH11 ARG 69 5.537 1.820 -11.063 531 HH12 ARG 69 HH12 ARG 69 5.538 3.089 -12.243 532 HH21 ARG 69 HH21 ARG 69 2.526 2.114 -13.725 533 HH22 ARG 69 HH22 ARG 69 3.828 3.256 -13.754 534 H THR 70 HN THR 70 0.968 -4.361 -10.784 535 HA THR 70 HA THR 70 -0.120 -4.940 -13.380 536 HB THR 70 HB THR 70 1.127 -6.975 -13.137 537 HG1 THR 70 HG1 THR 70 -0.576 -8.467 -13.126 538 HG21 THR 70 HG21 THR 70 0.430 -8.516 -11.169 539 HG22 THR 70 HG22 THR 70 0.053 -6.996 -10.359 540 HG23 THR 70 HG23 THR 70 1.690 -7.305 -10.938 541 H SER 71 HN SER 71 -1.559 -3.325 -12.486 542 HA SER 71 HA SER 71 -3.224 -4.073 -10.236 543 HB2 SER 71 HB2 SER 71 -2.413 -1.681 -10.911 544 HB3 SER 71 HB1 SER 71 -3.788 -1.722 -12.014 545 HG SER 71 HG SER 71 -3.871 -1.055 -9.528 546 H ASP 72 HN ASP 72 -3.325 -4.322 -13.678 547 HA ASP 72 HA ASP 72 -6.054 -4.300 -14.194 548 HB2 ASP 72 HB2 ASP 72 -3.811 -4.790 -15.676 549 HB3 ASP 72 HB1 ASP 72 -4.548 -6.387 -15.628 550 H GLN 73 HN GLN 73 -3.999 -7.017 -13.195 551 HA GLN 73 HA GLN 73 -6.137 -8.904 -13.106 552 HB2 GLN 73 HB2 GLN 73 -3.264 -8.859 -12.411 553 HB3 GLN 73 HB1 GLN 73 -4.240 -10.000 -11.498 554 HG2 GLN 73 HG2 GLN 73 -5.108 -10.831 -13.722 555 HG3 GLN 73 HG1 GLN 73 -3.832 -9.871 -14.469 556 HE21 GLN 73 HE21 GLN 73 -3.618 -12.342 -15.106 557 HE22 GLN 73 HE22 GLN 73 -2.424 -13.191 -14.193 558 H VAL 74 HN VAL 74 -6.021 -10.196 -10.745 559 HA VAL 74 HA VAL 74 -7.045 -8.193 -8.835 560 HB VAL 74 HB VAL 74 -8.710 -9.846 -9.574 561 HG11 VAL 74 HG11 VAL 74 -8.491 -12.196 -8.992 562 HG12 VAL 74 HG12 VAL 74 -6.889 -11.895 -8.318 563 HG13 VAL 74 HG13 VAL 74 -7.171 -11.693 -10.048 564 HG21 VAL 74 HG21 VAL 74 -8.631 -8.882 -7.222 565 HG22 VAL 74 HG22 VAL 74 -7.989 -10.447 -6.719 566 HG23 VAL 74 HG23 VAL 74 -9.592 -10.345 -7.450 567 H LEU 75 HN LEU 75 -6.042 -7.946 -6.927 568 HA LEU 75 HA LEU 75 -3.531 -8.974 -6.407 569 HB2 LEU 75 HB2 LEU 75 -5.353 -7.256 -5.108 570 HB3 LEU 75 HB1 LEU 75 -4.797 -8.401 -3.914 571 HG LEU 75 HG LEU 75 -2.732 -7.104 -5.609 572 HD11 LEU 75 HD11 LEU 75 -2.983 -5.007 -4.881 573 HD12 LEU 75 HD12 LEU 75 -3.398 -5.527 -3.248 574 HD13 LEU 75 HD13 LEU 75 -4.640 -5.477 -4.499 575 HD21 LEU 75 HD21 LEU 75 -2.492 -8.836 -3.671 576 HD22 LEU 75 HD22 LEU 75 -2.684 -7.417 -2.642 577 HD23 LEU 75 HD23 LEU 75 -1.359 -7.493 -3.802 578 H GLN 76 HN GLN 76 -2.725 -10.455 -4.972 579 HA GLN 76 HA GLN 76 -4.421 -12.329 -3.613 580 HB2 GLN 76 HB2 GLN 76 -2.598 -13.330 -5.801 581 HB3 GLN 76 HB1 GLN 76 -3.594 -14.316 -4.743 582 HG2 GLN 76 HG2 GLN 76 -5.571 -13.007 -5.735 583 HG3 GLN 76 HG1 GLN 76 -4.433 -12.540 -6.998 584 HE21 GLN 76 HE21 GLN 76 -6.128 -15.192 -5.497 585 HE22 GLN 76 HE22 GLN 76 -5.917 -16.319 -6.789 586 H LYS 77 HN LYS 77 -3.435 -13.063 -1.863 587 HA LYS 77 HA LYS 77 -0.802 -12.123 -1.249 588 HB2 LYS 77 HB2 LYS 77 -1.118 -12.867 0.955 589 HB3 LYS 77 HB1 LYS 77 -2.618 -12.131 0.418 590 HG2 LYS 77 HG2 LYS 77 -3.676 -13.957 1.089 591 HG3 LYS 77 HG1 LYS 77 -2.876 -14.824 -0.224 592 HD2 LYS 77 HD2 LYS 77 -0.989 -14.616 1.847 593 HD3 LYS 77 HD1 LYS 77 -2.511 -15.067 2.616 594 HE2 LYS 77 HE2 LYS 77 -1.340 -16.478 0.229 595 HE3 LYS 77 HE1 LYS 77 -1.096 -16.991 1.897 596 HZ1 LYS 77 HZ1 LYS 77 -2.908 -18.226 1.472 597 HZ2 LYS 77 HZ2 LYS 77 -3.443 -17.234 0.210 598 HZ3 LYS 77 HZ3 LYS 77 -3.748 -16.797 1.815 599 H GLY 78 HN GLY 78 0.949 -13.285 -0.499 600 HA2 GLY 78 HA2 GLY 78 1.916 -15.508 -0.075 601 HA3 GLY 78 HA1 GLY 78 1.038 -16.063 -1.498 602 H GLY 79 HN GLY 79 2.359 -12.874 -1.618 603 HA2 GLY 79 HA2 GLY 79 4.810 -13.848 -2.871 604 HA3 GLY 79 HA1 GLY 79 3.673 -13.025 -3.920 605 H TYR 80 HN TYR 80 3.787 -10.921 -4.087 606 HA TYR 80 HA TYR 80 4.928 -9.255 -2.030 607 HB2 TYR 80 HB2 TYR 80 6.183 -8.529 -4.517 608 HB3 TYR 80 HB1 TYR 80 6.937 -8.902 -2.977 609 HD1 TYR 80 HD2 TYR 80 5.471 -10.577 -5.971 610 HD2 TYR 80 HD1 TYR 80 8.312 -10.752 -2.807 611 HE1 TYR 80 HE2 TYR 80 6.420 -12.628 -6.943 612 HE2 TYR 80 HE1 TYR 80 9.268 -12.801 -3.771 613 HH TYR 80 HH TYR 80 8.465 -13.900 -6.915 614 H PHE 81 HN PHE 81 4.667 -6.945 -2.565 615 HA PHE 81 HA PHE 81 3.071 -6.353 -4.879 616 HB2 PHE 81 HB2 PHE 81 1.271 -5.179 -3.596 617 HB3 PHE 81 HB1 PHE 81 1.223 -6.929 -3.501 618 HD1 PHE 81 HD1 PHE 81 2.795 -7.819 -1.469 619 HD2 PHE 81 HD2 PHE 81 0.772 -4.063 -1.669 620 HE1 PHE 81 HE1 PHE 81 2.726 -7.706 0.999 621 HE2 PHE 81 HE2 PHE 81 0.710 -3.943 0.755 622 HZ PHE 81 HZ PHE 81 1.687 -5.765 2.116 623 H VAL 82 HN VAL 82 2.400 -4.020 -4.815 624 HA VAL 82 HA VAL 82 4.413 -2.439 -3.408 625 HB VAL 82 HB VAL 82 4.213 -2.881 -6.291 626 HG11 VAL 82 HG11 VAL 82 4.386 -0.014 -5.338 627 HG12 VAL 82 HG12 VAL 82 3.039 -0.727 -6.221 628 HG13 VAL 82 HG13 VAL 82 4.613 -0.576 -6.995 629 HG21 VAL 82 HG21 VAL 82 6.435 -1.266 -5.518 630 HG22 VAL 82 HG22 VAL 82 6.409 -2.962 -5.996 631 HG23 VAL 82 HG23 VAL 82 6.192 -2.521 -4.304 632 H ILE 83 HN ILE 83 3.426 -0.827 -2.370 633 HA ILE 83 HA ILE 83 0.625 -0.440 -2.711 634 HB ILE 83 HB ILE 83 2.690 1.016 -1.148 635 HG12 ILE 83 HG12 ILE 83 2.067 -0.210 0.694 636 HG13 ILE 83 HG11 ILE 83 0.417 -0.383 0.141 637 HG21 ILE 83 HG21 ILE 83 0.722 2.087 0.032 638 HG22 ILE 83 HG22 ILE 83 -0.223 1.590 -1.374 639 HG23 ILE 83 HG23 ILE 83 1.136 2.692 -1.573 640 HD11 ILE 83 HD11 ILE 83 0.992 -2.180 -1.276 641 HD12 ILE 83 HD12 ILE 83 1.772 -2.479 0.274 642 HD13 ILE 83 HD13 ILE 83 2.713 -1.874 -1.078 643 H ASN 84 HN ASN 84 -0.202 0.658 -4.359 644 HA ASN 84 HA ASN 84 1.205 2.368 -6.009 645 HB2 ASN 84 HB2 ASN 84 -1.391 1.407 -5.892 646 HB3 ASN 84 HB1 ASN 84 -1.577 3.136 -5.683 647 HD21 ASN 84 HD21 ASN 84 -2.039 1.143 -7.960 648 HD22 ASN 84 HD22 ASN 84 -1.371 1.952 -9.329 649 HA PRO 85 HA PRO 85 1.665 5.755 -3.019 650 HB2 PRO 85 HB2 PRO 85 3.243 7.303 -4.505 651 HB3 PRO 85 HB1 PRO 85 3.865 5.780 -3.839 652 HG2 PRO 85 HG2 PRO 85 2.643 6.259 -6.553 653 HG3 PRO 85 HG1 PRO 85 4.226 5.590 -6.180 654 HD2 PRO 85 HD2 PRO 85 2.223 3.949 -6.675 655 HD3 PRO 85 HD1 PRO 85 3.332 3.592 -5.329 656 H ASN 86 HN ASN 86 0.712 5.901 -6.285 657 HA ASN 86 HA ASN 86 -0.261 8.544 -6.178 658 HB2 ASN 86 HB2 ASN 86 -0.046 6.454 -8.198 659 HB3 ASN 86 HB1 ASN 86 -1.523 7.391 -8.337 660 HD21 ASN 86 HD21 ASN 86 1.952 7.830 -7.854 661 HD22 ASN 86 HD22 ASN 86 2.091 9.236 -8.849 662 H ASN 87 HN ASN 87 -1.510 5.427 -5.488 663 HA ASN 87 HA ASN 87 -4.275 6.235 -5.300 664 HB2 ASN 87 HB2 ASN 87 -2.739 3.881 -5.330 665 HB3 ASN 87 HB1 ASN 87 -3.623 3.967 -3.818 666 HD21 ASN 87 HD21 ASN 87 -4.033 2.015 -5.556 667 HD22 ASN 87 HD22 ASN 87 -5.615 2.136 -6.246 668 H VAL 88 HN VAL 88 -1.492 6.732 -3.651 669 HA VAL 88 HA VAL 88 -2.529 6.530 -1.038 670 HB VAL 88 HB VAL 88 0.158 7.010 -2.240 671 HG11 VAL 88 HG11 VAL 88 0.423 8.411 -0.482 672 HG12 VAL 88 HG12 VAL 88 0.643 6.903 0.407 673 HG13 VAL 88 HG13 VAL 88 -0.932 7.717 0.413 674 HG21 VAL 88 HG21 VAL 88 -0.078 5.046 -0.171 675 HG22 VAL 88 HG22 VAL 88 0.346 4.835 -1.889 676 HG23 VAL 88 HG23 VAL 88 -1.352 4.820 -1.380 677 H LYS 89 HN LYS 89 -3.021 8.057 0.073 678 HA LYS 89 HA LYS 89 -3.160 10.731 -0.929 679 HB2 LYS 89 HB2 LYS 89 -3.951 9.650 1.742 680 HB3 LYS 89 HB1 LYS 89 -4.345 11.240 1.130 681 HG2 LYS 89 HG2 LYS 89 -6.177 9.529 1.080 682 HG3 LYS 89 HG1 LYS 89 -5.870 10.376 -0.430 683 HD2 LYS 89 HD2 LYS 89 -4.623 7.725 0.145 684 HD3 LYS 89 HD1 LYS 89 -6.277 7.839 -0.449 685 HE2 LYS 89 HE2 LYS 89 -4.343 9.436 -1.942 686 HE3 LYS 89 HE1 LYS 89 -4.035 7.698 -1.973 687 HZ1 LYS 89 HZ1 LYS 89 -5.815 7.342 -3.262 688 HZ2 LYS 89 HZ2 LYS 89 -5.729 8.993 -3.617 689 HZ3 LYS 89 HZ3 LYS 89 -6.793 8.438 -2.426 690 H SER 90 HN SER 90 -1.806 8.919 1.671 691 HA SER 90 HA SER 90 0.717 10.064 1.735 692 HB2 SER 90 HB2 SER 90 0.689 12.017 2.863 693 HB3 SER 90 HB1 SER 90 -1.027 12.043 2.481 694 HG SER 90 HG SER 90 0.214 11.158 4.861 695 H VAL 91 HN VAL 91 1.820 9.829 3.999 696 HA VAL 91 HA VAL 91 0.836 7.392 5.229 697 HB VAL 91 HB VAL 91 3.430 8.808 5.577 698 HG11 VAL 91 HG11 VAL 91 2.257 6.441 6.919 699 HG12 VAL 91 HG12 VAL 91 3.276 7.716 7.584 700 HG13 VAL 91 HG13 VAL 91 3.988 6.446 6.587 701 HG21 VAL 91 HG21 VAL 91 3.981 6.353 4.522 702 HG22 VAL 91 HG22 VAL 91 3.874 7.855 3.603 703 HG23 VAL 91 HG23 VAL 91 2.473 6.788 3.715 704 H GLY 92 HN GLY 92 0.950 7.380 7.756 705 HA2 GLY 92 HA2 GLY 92 0.306 10.021 8.804 706 HA3 GLY 92 HA1 GLY 92 -0.798 8.675 9.039 707 H THR 93 HN THR 93 -0.214 9.722 11.186 708 HA THR 93 HA THR 93 2.142 9.186 12.586 709 HB THR 93 HB THR 93 -0.491 9.161 13.961 710 HG1 THR 93 HG1 THR 93 0.382 11.229 12.279 711 HG21 THR 93 HG21 THR 93 1.634 9.411 15.187 712 HG22 THR 93 HG22 THR 93 0.518 10.757 15.415 713 HG23 THR 93 HG23 THR 93 1.895 10.926 14.325 714 HA PRO 94 HA PRO 94 1.929 4.892 13.158 715 HB2 PRO 94 HB2 PRO 94 4.160 4.675 14.495 716 HB3 PRO 94 HB1 PRO 94 4.183 5.358 12.861 717 HG2 PRO 94 HG2 PRO 94 4.045 6.867 15.446 718 HG3 PRO 94 HG1 PRO 94 5.268 7.012 14.173 719 HD2 PRO 94 HD2 PRO 94 3.170 8.635 14.269 720 HD3 PRO 94 HD1 PRO 94 3.810 8.039 12.721 721 H MET 95 HN MET 95 1.721 3.353 14.774 722 HA MET 95 HA MET 95 1.307 4.194 17.521 723 HB2 MET 95 HB2 MET 95 -0.901 2.971 15.863 724 HB3 MET 95 HB1 MET 95 -0.943 3.115 17.615 725 HG2 MET 95 HG2 MET 95 -0.748 5.568 17.372 726 HG3 MET 95 HG1 MET 95 -0.849 5.366 15.623 727 HE1 MET 95 HE1 MET 95 -4.284 6.719 17.578 728 HE2 MET 95 HE2 MET 95 -2.864 7.347 16.741 729 HE3 MET 95 HE3 MET 95 -2.701 6.646 18.351 730 H LYS 96 HN LYS 96 1.849 2.619 18.950 731 HA LYS 96 HA LYS 96 2.804 0.107 17.858 732 HB2 LYS 96 HB2 LYS 96 3.631 -0.308 20.155 733 HB3 LYS 96 HB1 LYS 96 4.191 1.230 19.511 734 HG2 LYS 96 HG2 LYS 96 2.523 2.415 20.806 735 HG3 LYS 96 HG1 LYS 96 1.869 0.889 21.399 736 HD2 LYS 96 HD2 LYS 96 3.634 0.526 22.817 737 HD3 LYS 96 HD1 LYS 96 4.762 1.445 21.819 738 HE2 LYS 96 HE2 LYS 96 4.317 3.367 22.886 739 HE3 LYS 96 HE1 LYS 96 2.583 3.056 22.913 740 HZ1 LYS 96 HZ1 LYS 96 3.933 1.298 24.679 741 HZ2 LYS 96 HZ2 LYS 96 2.716 2.423 25.018 742 HZ3 LYS 96 HZ3 LYS 96 4.338 2.900 25.037 743 H GLY 97 HN GLY 97 1.635 -1.733 17.799 744 HA2 GLY 97 HA2 GLY 97 -0.099 -2.492 19.919 745 HA3 GLY 97 HA1 GLY 97 -1.034 -1.855 18.578 746 H SER 98 HN SER 98 0.121 -2.852 16.370 747 HA SER 98 HA SER 98 -0.744 -5.536 16.363 748 HB2 SER 98 HB2 SER 98 0.520 -3.702 14.401 749 HB3 SER 98 HB1 SER 98 0.715 -5.406 14.082 750 HG SER 98 HG SER 98 -1.289 -4.130 13.339 751 H GLY 99 HN GLY 99 0.680 -6.135 18.298 752 HA2 GLY 99 HA2 GLY 99 2.250 -7.958 18.567 753 HA3 GLY 99 HA1 GLY 99 3.196 -7.271 17.259 754 H GLY 100 HN GLY 100 3.505 -4.659 17.996 755 HA2 GLY 100 HA2 GLY 100 3.989 -3.809 20.476 756 HA3 GLY 100 HA1 GLY 100 5.306 -4.934 20.217 757 H LEU 101 HN LEU 101 5.061 -4.003 17.250 758 HA LEU 101 HA LEU 101 7.160 -2.108 17.326 759 HB2 LEU 101 HB2 LEU 101 5.607 -2.648 14.906 760 HB3 LEU 101 HB1 LEU 101 7.321 -2.482 15.137 761 HG LEU 101 HG LEU 101 7.148 -4.797 16.301 762 HD11 LEU 101 HD11 LEU 101 4.601 -4.819 16.136 763 HD12 LEU 101 HD12 LEU 101 5.427 -6.219 15.461 764 HD13 LEU 101 HD13 LEU 101 4.838 -4.943 14.401 765 HD21 LEU 101 HD21 LEU 101 8.060 -3.898 14.087 766 HD22 LEU 101 HD22 LEU 101 6.668 -4.750 13.404 767 HD23 LEU 101 HD23 LEU 101 7.885 -5.638 14.332 768 H SER 102 HN SER 102 6.384 -0.806 14.993 769 HA SER 102 HA SER 102 4.378 1.082 15.960 770 HB2 SER 102 HB2 SER 102 7.062 1.434 14.813 771 HB3 SER 102 HB1 SER 102 5.808 2.561 14.259 772 HG SER 102 HG SER 102 7.046 2.359 16.711 773 H TRP 103 HN TRP 103 2.646 1.049 14.788 774 HA TRP 103 HA TRP 103 2.728 0.316 11.974 775 HB2 TRP 103 HB2 TRP 103 0.581 -0.155 14.019 776 HB3 TRP 103 HB1 TRP 103 0.536 -0.649 12.357 777 HD1 TRP 103 HD1 TRP 103 3.204 -1.025 15.087 778 HE1 TRP 103 HE1 TRP 103 4.125 -3.367 15.022 779 HE3 TRP 103 HE3 TRP 103 0.215 -3.072 11.468 780 HZ2 TRP 103 HZ2 TRP 103 3.673 -5.814 13.704 781 HZ3 TRP 103 HZ3 TRP 103 0.550 -5.420 10.879 782 HH2 TRP 103 HH2 TRP 103 2.232 -6.763 11.991 783 H ALA 104 HN ALA 104 2.304 2.007 10.800 784 HA ALA 104 HA ALA 104 0.928 4.289 11.942 785 HB1 ALA 104 HB1 ALA 104 1.980 5.642 10.208 786 HB2 ALA 104 HB2 ALA 104 2.768 4.193 9.590 787 HB3 ALA 104 HB3 ALA 104 3.145 4.782 11.214 788 H GLN 105 HN GLN 105 -0.493 5.534 10.978 789 HA GLN 105 HA GLN 105 -2.380 4.178 9.367 790 HB2 GLN 105 HB2 GLN 105 -2.708 5.846 11.359 791 HB3 GLN 105 HB1 GLN 105 -2.581 7.055 10.096 792 HG2 GLN 105 HG2 GLN 105 -4.423 6.211 8.961 793 HG3 GLN 105 HG1 GLN 105 -4.438 4.750 9.935 794 HE21 GLN 105 HE21 GLN 105 -6.780 5.683 9.910 795 HE22 GLN 105 HE22 GLN 105 -7.189 6.666 11.270 796 H VAL 106 HN VAL 106 -1.837 4.085 7.147 797 HA VAL 106 HA VAL 106 -0.922 6.583 5.969 798 HB VAL 106 HB VAL 106 -0.772 3.726 5.015 799 HG11 VAL 106 HG11 VAL 106 -0.253 6.290 3.588 800 HG12 VAL 106 HG12 VAL 106 -1.141 4.878 3.040 801 HG13 VAL 106 HG13 VAL 106 0.624 4.817 3.166 802 HG21 VAL 106 HG21 VAL 106 0.857 4.653 6.745 803 HG22 VAL 106 HG22 VAL 106 1.473 5.678 5.434 804 HG23 VAL 106 HG23 VAL 106 1.549 3.916 5.297 805 H ASN 107 HN ASN 107 -2.189 7.637 4.575 806 HA ASN 107 HA ASN 107 -4.942 6.836 4.371 807 HB2 ASN 107 HB2 ASN 107 -3.400 9.316 4.171 808 HB3 ASN 107 HB1 ASN 107 -4.677 9.195 2.969 809 HD21 ASN 107 HD21 ASN 107 -6.638 7.880 4.277 810 HD22 ASN 107 HD22 ASN 107 -7.194 8.806 5.625 811 H PHE 108 HN PHE 108 -5.243 5.328 2.814 812 HA PHE 108 HA PHE 108 -4.050 5.697 0.252 813 HB2 PHE 108 HB2 PHE 108 -5.532 3.376 1.478 814 HB3 PHE 108 HB1 PHE 108 -5.062 3.446 -0.194 815 HD1 PHE 108 HD2 PHE 108 -3.357 4.009 3.074 816 HD2 PHE 108 HD1 PHE 108 -3.317 2.066 -0.704 817 HE1 PHE 108 HE2 PHE 108 -1.261 2.868 3.672 818 HE2 PHE 108 HE1 PHE 108 -1.246 0.911 -0.091 819 HZ PHE 108 HZ PHE 108 -0.202 1.315 2.092 820 H THR 109 HN THR 109 -5.341 4.990 -1.511 821 HA THR 109 HA THR 109 -7.356 6.642 -2.226 822 HB THR 109 HB THR 109 -6.013 5.529 -3.787 823 HG1 THR 109 HG1 THR 109 -7.980 5.915 -4.713 824 HG21 THR 109 HG21 THR 109 -5.436 3.443 -3.540 825 HG22 THR 109 HG22 THR 109 -7.105 2.919 -3.733 826 HG23 THR 109 HG23 THR 109 -6.488 3.358 -2.138 827 H THR 110 HN THR 110 -7.939 3.214 -1.855 828 HA THR 110 HA THR 110 -10.775 3.590 -1.770 829 HB THR 110 HB THR 110 -9.841 0.898 -1.312 830 HG1 THR 110 HG1 THR 110 -9.089 1.948 -3.801 831 HG21 THR 110 HG21 THR 110 -11.666 2.295 -3.156 832 HG22 THR 110 HG22 THR 110 -11.903 0.814 -2.227 833 HG23 THR 110 HG23 THR 110 -10.961 0.781 -3.718 834 H GLY 111 HN GLY 111 -8.462 1.930 0.318 835 HA2 GLY 111 HA2 GLY 111 -10.335 1.517 2.376 836 HA3 GLY 111 HA1 GLY 111 -8.604 1.269 2.491 837 H GLY 112 HN GLY 112 -8.727 4.349 1.467 838 HA2 GLY 112 HA2 GLY 112 -8.477 6.359 2.522 839 HA3 GLY 112 HA1 GLY 112 -9.658 5.766 3.679 840 H ASN 113 HN ASN 113 -8.940 4.703 5.560 841 HA ASN 113 HA ASN 113 -6.190 5.305 6.239 842 HB2 ASN 113 HB2 ASN 113 -7.014 4.180 8.454 843 HB3 ASN 113 HB1 ASN 113 -7.556 5.803 8.073 844 HD21 ASN 113 HD21 ASN 113 -8.526 2.616 6.932 845 HD22 ASN 113 HD22 ASN 113 -10.194 2.758 7.373 846 H VAL 114 HN VAL 114 -4.613 3.843 6.331 847 HA VAL 114 HA VAL 114 -5.217 0.993 6.310 848 HB VAL 114 HB VAL 114 -3.274 2.120 4.340 849 HG11 VAL 114 HG11 VAL 114 -4.646 -0.484 4.033 850 HG12 VAL 114 HG12 VAL 114 -3.355 -0.337 5.228 851 HG13 VAL 114 HG13 VAL 114 -3.029 0.001 3.528 852 HG21 VAL 114 HG21 VAL 114 -5.197 3.014 3.421 853 HG22 VAL 114 HG22 VAL 114 -6.207 1.695 4.015 854 HG23 VAL 114 HG23 VAL 114 -5.132 1.432 2.643 855 H TRP 115 HN TRP 115 -4.052 0.323 7.990 856 HA TRP 115 HA TRP 115 -1.693 1.835 8.690 857 HB2 TRP 115 HB2 TRP 115 -3.171 -0.282 10.177 858 HB3 TRP 115 HB1 TRP 115 -1.704 0.466 10.769 859 HD1 TRP 115 HD1 TRP 115 -5.222 1.462 9.619 860 HE1 TRP 115 HE1 TRP 115 -5.902 3.467 11.007 861 HE3 TRP 115 HE3 TRP 115 -0.891 2.201 12.163 862 HZ2 TRP 115 HZ2 TRP 115 -4.774 5.188 12.847 863 HZ3 TRP 115 HZ3 TRP 115 -0.764 4.097 13.751 864 HH2 TRP 115 HH2 TRP 115 -2.691 5.570 14.090 865 H LEU 116 HN LEU 116 0.282 0.972 9.192 866 HA LEU 116 HA LEU 116 0.902 -1.717 8.323 867 HB2 LEU 116 HB2 LEU 116 1.030 0.297 6.473 868 HB3 LEU 116 HB1 LEU 116 2.662 0.311 7.140 869 HG LEU 116 HG LEU 116 2.461 -2.307 6.692 870 HD11 LEU 116 HD11 LEU 116 0.900 -2.995 5.233 871 HD12 LEU 116 HD12 LEU 116 0.998 -1.518 4.275 872 HD13 LEU 116 HD13 LEU 116 0.032 -1.550 5.752 873 HD21 LEU 116 HD21 LEU 116 2.917 -0.464 4.373 874 HD22 LEU 116 HD22 LEU 116 3.718 -1.993 4.732 875 HD23 LEU 116 HD23 LEU 116 4.040 -0.569 5.722 876 H ASN 117 HN ASN 117 2.848 -2.426 9.245 877 HA ASN 117 HA ASN 117 3.652 -0.884 11.463 878 HB2 ASN 117 HB2 ASN 117 4.130 -2.852 12.048 879 HB3 ASN 117 HB1 ASN 117 4.412 -3.457 10.432 880 HD21 ASN 117 HD21 ASN 117 5.740 -2.381 13.342 881 HD22 ASN 117 HD22 ASN 117 7.412 -2.511 12.932 882 H THR 118 HN THR 118 4.188 0.745 11.139 883 HA THR 118 HA THR 118 5.676 1.850 9.008 884 HB THR 118 HB THR 118 3.758 2.772 10.390 885 HG1 THR 118 HG1 THR 118 5.931 4.549 9.978 886 HG21 THR 118 HG21 THR 118 5.607 2.658 12.446 887 HG22 THR 118 HG22 THR 118 4.043 3.468 12.463 888 HG23 THR 118 HG23 THR 118 5.500 4.366 12.028 889 H THR 119 HN THR 119 6.957 0.015 11.187 890 HA THR 119 HA THR 119 8.935 1.616 12.423 891 HB THR 119 HB THR 119 8.365 -0.767 13.012 892 HG1 THR 119 HG1 THR 119 10.167 0.010 13.967 893 HG21 THR 119 HG21 THR 119 9.050 -2.572 11.830 894 HG22 THR 119 HG22 THR 119 10.408 -1.719 11.096 895 HG23 THR 119 HG23 THR 119 8.771 -1.460 10.491 896 H SER 120 HN SER 120 8.554 2.076 9.432 897 HA SER 120 HA SER 120 11.135 2.768 8.769 898 HB2 SER 120 HB2 SER 120 10.509 0.879 6.681 899 HB3 SER 120 HB1 SER 120 11.975 1.000 7.653 900 HG SER 120 HG SER 120 10.016 -0.822 7.789 901 H LYS 121 HN LYS 121 10.706 4.534 7.584 902 HA LYS 121 HA LYS 121 8.119 5.041 6.554 903 HB2 LYS 121 HB2 LYS 121 9.665 6.749 7.421 904 HB3 LYS 121 HB1 LYS 121 10.693 6.513 6.012 905 HG2 LYS 121 HG2 LYS 121 8.377 7.009 4.764 906 HG3 LYS 121 HG1 LYS 121 8.099 7.915 6.253 907 HD2 LYS 121 HD2 LYS 121 10.689 8.248 4.807 908 HD3 LYS 121 HD1 LYS 121 9.246 9.048 4.182 909 HE2 LYS 121 HE2 LYS 121 9.704 9.336 7.076 910 HE3 LYS 121 HE1 LYS 121 10.898 10.116 6.039 911 HZ1 LYS 121 HZ1 LYS 121 8.357 10.686 5.019 912 HZ2 LYS 121 HZ2 LYS 121 9.472 11.756 5.705 913 HZ3 LYS 121 HZ3 LYS 121 8.318 10.997 6.682 914 H ASP 122 HN ASP 122 11.189 4.017 5.196 915 HA ASP 122 HA ASP 122 10.313 4.040 2.503 916 HB2 ASP 122 HB2 ASP 122 12.608 2.825 3.980 917 HB3 ASP 122 HB1 ASP 122 12.263 2.328 2.325 918 H ASN 123 HN ASN 123 9.298 2.357 5.168 919 HA ASN 123 HA ASN 123 9.031 -0.254 4.211 920 HB2 ASN 123 HB2 ASN 123 8.670 0.003 6.568 921 HB3 ASN 123 HB1 ASN 123 7.606 1.375 6.289 922 HD21 ASN 123 HD21 ASN 123 7.442 -1.437 4.340 923 HD22 ASN 123 HD22 ASN 123 5.883 -1.867 4.826 924 H LEU 124 HN LEU 124 6.623 2.261 4.381 925 HA LEU 124 HA LEU 124 4.789 0.874 2.773 926 HB2 LEU 124 HB2 LEU 124 4.688 3.790 2.603 927 HB3 LEU 124 HB1 LEU 124 3.418 2.655 3.013 928 HG LEU 124 HG LEU 124 3.806 4.067 4.866 929 HD11 LEU 124 HD11 LEU 124 3.304 2.006 5.779 930 HD12 LEU 124 HD12 LEU 124 4.891 2.277 6.496 931 HD13 LEU 124 HD13 LEU 124 4.731 1.227 5.086 932 HD21 LEU 124 HD21 LEU 124 6.569 3.762 4.033 933 HD22 LEU 124 HD22 LEU 124 6.374 3.553 5.780 934 HD23 LEU 124 HD23 LEU 124 5.816 5.037 5.005 935 H LEU 125 HN LEU 125 6.833 3.625 2.063 936 HA LEU 125 HA LEU 125 6.352 3.690 -0.667 937 HB2 LEU 125 HB2 LEU 125 8.741 4.528 0.952 938 HB3 LEU 125 HB1 LEU 125 8.543 4.885 -0.732 939 HG LEU 125 HG LEU 125 6.339 6.036 -0.020 940 HD11 LEU 125 HD11 LEU 125 5.858 5.882 2.142 941 HD12 LEU 125 HD12 LEU 125 7.282 6.865 2.490 942 HD13 LEU 125 HD13 LEU 125 7.408 5.102 2.464 943 HD21 LEU 125 HD21 LEU 125 7.501 8.112 0.365 944 HD22 LEU 125 HD22 LEU 125 8.393 7.180 -0.837 945 HD23 LEU 125 HD23 LEU 125 8.968 7.253 0.829 946 H TYR 126 HN TYR 126 8.970 2.076 1.156 947 HA TYR 126 HA TYR 126 9.775 0.834 -1.398 948 HB2 TYR 126 HB2 TYR 126 11.223 1.940 0.856 949 HB3 TYR 126 HB1 TYR 126 11.757 0.308 0.484 950 HD1 TYR 126 HD1 TYR 126 10.848 3.428 -1.324 951 HD2 TYR 126 HD2 TYR 126 13.519 0.139 -0.997 952 HE1 TYR 126 HE1 TYR 126 12.187 4.335 -3.175 953 HE2 TYR 126 HE2 TYR 126 14.872 1.038 -2.843 954 HH TYR 126 HH TYR 126 14.471 4.203 -4.042 955 H GLY 127 HN GLY 127 8.781 0.164 1.907 956 HA2 GLY 127 HA2 GLY 127 7.706 -1.952 2.425 957 HA3 GLY 127 HA1 GLY 127 8.580 -2.688 1.092 958 H LYS 128 HN LYS 128 10.209 -0.541 3.246 959 HA LYS 128 HA LYS 128 12.070 -2.541 3.979 960 HB2 LYS 128 HB2 LYS 128 11.664 0.251 5.022 961 HB3 LYS 128 HB1 LYS 128 13.080 -0.740 5.267 962 HG2 LYS 128 HG2 LYS 128 13.228 -0.803 2.706 963 HG3 LYS 128 HG1 LYS 128 12.130 0.582 2.778 964 HD2 LYS 128 HD2 LYS 128 13.717 1.782 4.196 965 HD3 LYS 128 HD1 LYS 128 14.795 0.383 4.189 966 HE2 LYS 128 HE2 LYS 128 15.379 0.675 1.957 967 HE3 LYS 128 HE1 LYS 128 13.958 1.657 1.612 968 HZ1 LYS 128 HZ1 LYS 128 15.572 3.247 1.708 969 HZ2 LYS 128 HZ2 LYS 128 16.490 2.430 2.871 970 HZ3 LYS 128 HZ3 LYS 128 15.083 3.251 3.328 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 -5.309 -5.451 -27.432 2 H2 MET 1 HT2 MET 1 -3.945 -4.442 -27.172 3 H3 MET 1 HT3 MET 1 -4.225 -5.129 -28.720 4 HA MET 1 HA MET 1 -6.443 -3.905 -28.573 5 HB2 MET 1 HB2 MET 1 -5.120 -3.121 -26.177 6 HB3 MET 1 HB1 MET 1 -5.219 -1.703 -27.212 7 HG2 MET 1 HG2 MET 1 -7.139 -1.735 -25.815 8 HG3 MET 1 HG1 MET 1 -7.654 -2.125 -27.455 9 HE1 MET 1 HE1 MET 1 -10.116 -3.622 -26.664 10 HE2 MET 1 HE2 MET 1 -9.562 -2.398 -25.521 11 HE3 MET 1 HE3 MET 1 -9.999 -4.008 -24.948 12 H ARG 2 HN ARG 2 -6.519 -1.846 -29.781 13 HA ARG 2 HA ARG 2 -4.042 -1.445 -31.325 14 HB2 ARG 2 HB2 ARG 2 -6.926 -1.473 -32.121 15 HB3 ARG 2 HB1 ARG 2 -5.787 -0.509 -33.049 16 HG2 ARG 2 HG2 ARG 2 -4.399 -2.617 -33.271 17 HG3 ARG 2 HG1 ARG 2 -5.802 -3.483 -32.640 18 HD2 ARG 2 HD2 ARG 2 -6.197 -1.603 -34.913 19 HD3 ARG 2 HD1 ARG 2 -5.427 -3.157 -35.234 20 HE ARG 2 HE ARG 2 -7.861 -3.370 -33.723 21 HH11 ARG 2 HH11 ARG 2 -6.500 -3.162 -36.930 22 HH12 ARG 2 HH12 ARG 2 -7.852 -3.933 -37.689 23 HH21 ARG 2 HH21 ARG 2 -9.639 -4.385 -34.720 24 HH22 ARG 2 HH22 ARG 2 -9.635 -4.628 -36.435 25 H GLY 3 HN GLY 3 -6.663 0.111 -29.612 26 HA2 GLY 3 HA2 GLY 3 -5.255 2.387 -28.924 27 HA3 GLY 3 HA1 GLY 3 -6.068 2.771 -30.434 28 H SER 4 HN SER 4 -6.928 1.063 -27.422 29 HA SER 4 HA SER 4 -9.467 2.552 -27.420 30 HB2 SER 4 HB2 SER 4 -8.747 -0.213 -26.783 31 HB3 SER 4 HB1 SER 4 -9.744 0.545 -25.541 32 HG SER 4 HG SER 4 -10.368 -0.144 -28.146 33 H HIS 5 HN HIS 5 -6.520 2.060 -25.698 34 HA HIS 5 HA HIS 5 -7.511 3.823 -23.565 35 HB2 HIS 5 HB2 HIS 5 -6.924 1.188 -23.148 36 HB3 HIS 5 HB1 HIS 5 -5.379 1.947 -22.781 37 HD1 HIS 5 HD1 HIS 5 -8.489 3.826 -21.959 38 HD2 HIS 5 HD2 HIS 5 -5.756 1.344 -20.050 39 HE1 HIS 5 HE1 HIS 5 -8.950 4.083 -19.501 40 HE2 HIS 5 HE2 HIS 5 -7.346 2.504 -18.372 41 H HIS 6 HN HIS 6 -6.494 5.696 -23.780 42 HA HIS 6 HA HIS 6 -3.804 5.797 -24.895 43 HB2 HIS 6 HB2 HIS 6 -6.013 7.452 -25.122 44 HB3 HIS 6 HB1 HIS 6 -4.956 8.339 -24.029 45 HD1 HIS 6 HD1 HIS 6 -2.302 8.331 -25.063 46 HD2 HIS 6 HD2 HIS 6 -5.519 8.109 -27.683 47 HE1 HIS 6 HE1 HIS 6 -1.407 9.082 -27.290 48 HE2 HIS 6 HE2 HIS 6 -3.357 8.881 -28.874 49 H HIS 7 HN HIS 7 -2.344 5.197 -23.366 50 HA HIS 7 HA HIS 7 -2.149 6.920 -21.006 51 HB2 HIS 7 HB2 HIS 7 -3.096 4.331 -20.818 52 HB3 HIS 7 HB1 HIS 7 -1.388 4.156 -20.430 53 HD1 HIS 7 HD1 HIS 7 -3.894 3.904 -18.430 54 HD2 HIS 7 HD2 HIS 7 -1.257 7.099 -18.756 55 HE1 HIS 7 HE1 HIS 7 -3.996 5.088 -16.215 56 HE2 HIS 7 HE2 HIS 7 -2.457 7.067 -16.465 57 H HIS 8 HN HIS 8 -0.193 7.785 -20.904 58 HA HIS 8 HA HIS 8 1.981 6.625 -22.455 59 HB2 HIS 8 HB2 HIS 8 2.034 9.190 -20.865 60 HB3 HIS 8 HB1 HIS 8 3.111 8.712 -22.173 61 HD1 HIS 8 HD1 HIS 8 -0.379 9.952 -21.536 62 HD2 HIS 8 HD2 HIS 8 2.187 9.251 -24.729 63 HE1 HIS 8 HE1 HIS 8 -1.488 11.004 -23.533 64 HE2 HIS 8 HE2 HIS 8 0.052 10.513 -25.466 65 H HIS 9 HN HIS 9 3.858 5.830 -21.626 66 HA HIS 9 HA HIS 9 4.684 6.160 -18.934 67 HB2 HIS 9 HB2 HIS 9 2.668 4.329 -19.137 68 HB3 HIS 9 HB1 HIS 9 4.088 3.300 -19.292 69 HD1 HIS 9 HD1 HIS 9 2.053 5.081 -16.832 70 HD2 HIS 9 HD2 HIS 9 5.877 3.469 -17.010 71 HE1 HIS 9 HE1 HIS 9 2.822 4.910 -14.444 72 HE2 HIS 9 HE2 HIS 9 5.100 3.843 -14.572 73 H HIS 10 HN HIS 10 5.612 6.055 -21.818 74 HA HIS 10 HA HIS 10 7.613 3.925 -21.773 75 HB2 HIS 10 HB2 HIS 10 7.006 6.045 -23.850 76 HB3 HIS 10 HB1 HIS 10 8.152 4.721 -24.044 77 HD1 HIS 10 HD1 HIS 10 6.997 3.405 -25.847 78 HD2 HIS 10 HD2 HIS 10 4.497 4.276 -22.646 79 HE1 HIS 10 HE1 HIS 10 4.904 2.070 -26.247 80 HE2 HIS 10 HE2 HIS 10 3.453 2.526 -24.238 81 H GLY 11 HN GLY 11 7.764 7.422 -22.522 82 HA2 GLY 11 HA2 GLY 11 9.171 8.900 -21.186 83 HA3 GLY 11 HA1 GLY 11 10.272 7.547 -20.966 84 H SER 12 HN SER 12 11.772 9.345 -21.726 85 HA SER 12 HA SER 12 11.828 9.433 -24.674 86 HB2 SER 12 HB2 SER 12 12.912 11.532 -24.568 87 HB3 SER 12 HB1 SER 12 11.645 11.621 -23.345 88 HG SER 12 HG SER 12 14.183 12.055 -22.984 89 H GLU 13 HN GLU 13 13.707 8.844 -21.766 90 HA GLU 13 HA GLU 13 15.947 7.897 -23.423 91 HB2 GLU 13 HB2 GLU 13 16.175 9.700 -21.520 92 HB3 GLU 13 HB1 GLU 13 16.159 8.296 -20.463 93 HG2 GLU 13 HG2 GLU 13 18.295 7.914 -20.871 94 HG3 GLU 13 HG1 GLU 13 17.983 7.824 -22.603 95 HA PRO 14 HA PRO 14 14.726 3.832 -22.037 96 HB2 PRO 14 HB2 PRO 14 16.537 2.391 -23.371 97 HB3 PRO 14 HB1 PRO 14 15.243 3.248 -24.219 98 HG2 PRO 14 HG2 PRO 14 18.115 4.004 -23.886 99 HG3 PRO 14 HG1 PRO 14 17.074 4.157 -25.311 100 HD2 PRO 14 HD2 PRO 14 17.662 6.210 -23.550 101 HD3 PRO 14 HD1 PRO 14 16.256 6.173 -24.629 102 H THR 15 HN THR 15 16.271 5.341 -20.169 103 HA THR 15 HA THR 15 18.513 3.706 -19.368 104 HB THR 15 HB THR 15 17.204 6.061 -17.993 105 HG1 THR 15 HG1 THR 15 19.465 5.879 -19.689 106 HG21 THR 15 HG21 THR 15 19.405 6.287 -16.855 107 HG22 THR 15 HG22 THR 15 19.817 4.681 -17.455 108 HG23 THR 15 HG23 THR 15 18.457 4.888 -16.351 109 H THR 16 HN THR 16 18.646 2.889 -17.101 110 HA THR 16 HA THR 16 16.227 1.405 -16.501 111 HB THR 16 HB THR 16 18.039 0.640 -14.599 112 HG1 THR 16 HG1 THR 16 19.553 1.138 -16.934 113 HG21 THR 16 HG21 THR 16 18.531 -0.670 -17.160 114 HG22 THR 16 HG22 THR 16 16.829 -0.568 -16.710 115 HG23 THR 16 HG23 THR 16 17.983 -1.339 -15.624 116 HA PRO 17 HA PRO 17 15.011 4.094 -13.203 117 HB2 PRO 17 HB2 PRO 17 13.269 2.486 -11.923 118 HB3 PRO 17 HB1 PRO 17 12.915 3.181 -13.509 119 HG2 PRO 17 HG2 PRO 17 13.885 0.435 -12.819 120 HG3 PRO 17 HG1 PRO 17 12.639 0.920 -13.983 121 HD2 PRO 17 HD2 PRO 17 15.189 0.287 -14.704 122 HD3 PRO 17 HD1 PRO 17 14.180 1.433 -15.608 123 H THR 18 HN THR 18 15.196 4.399 -10.950 124 HA THR 18 HA THR 18 16.355 2.333 -9.299 125 HB THR 18 HB THR 18 18.192 4.217 -8.710 126 HG1 THR 18 HG1 THR 18 17.367 5.472 -10.544 127 HG21 THR 18 HG21 THR 18 18.638 1.846 -9.288 128 HG22 THR 18 HG22 THR 18 19.821 2.983 -9.935 129 HG23 THR 18 HG23 THR 18 18.584 2.302 -10.992 130 H THR 19 HN THR 19 13.933 3.788 -9.248 131 HA THR 19 HA THR 19 14.049 4.815 -6.550 132 HB THR 19 HB THR 19 14.549 6.853 -7.741 133 HG1 THR 19 HG1 THR 19 12.894 6.864 -6.044 134 HG21 THR 19 HG21 THR 19 12.567 5.878 -9.646 135 HG22 THR 19 HG22 THR 19 13.920 6.987 -9.872 136 HG23 THR 19 HG23 THR 19 12.391 7.583 -9.226 137 H ASN 20 HN ASN 20 12.862 2.591 -8.002 138 HA ASN 20 HA ASN 20 10.019 3.138 -8.111 139 HB2 ASN 20 HB2 ASN 20 11.602 1.437 -9.514 140 HB3 ASN 20 HB1 ASN 20 10.935 0.341 -8.308 141 HD21 ASN 20 HD21 ASN 20 9.969 2.848 -10.613 142 HD22 ASN 20 HD22 ASN 20 8.463 2.118 -11.042 143 H LEU 21 HN LEU 21 8.484 2.378 -6.766 144 HA LEU 21 HA LEU 21 8.973 2.058 -4.052 145 HB2 LEU 21 HB2 LEU 21 6.557 0.875 -5.371 146 HB3 LEU 21 HB1 LEU 21 6.677 1.689 -3.824 147 HG LEU 21 HG LEU 21 7.301 3.407 -6.123 148 HD11 LEU 21 HD11 LEU 21 4.624 2.088 -5.853 149 HD12 LEU 21 HD12 LEU 21 5.622 2.282 -7.295 150 HD13 LEU 21 HD13 LEU 21 4.813 3.680 -6.588 151 HD21 LEU 21 HD21 LEU 21 5.304 3.757 -3.911 152 HD22 LEU 21 HD22 LEU 21 6.076 5.003 -4.892 153 HD23 LEU 21 HD23 LEU 21 7.029 4.081 -3.727 154 H LYS 22 HN LYS 22 10.441 0.503 -3.611 155 HA LYS 22 HA LYS 22 10.858 -1.956 -4.614 156 HB2 LYS 22 HB2 LYS 22 11.390 -0.638 -2.108 157 HB3 LYS 22 HB1 LYS 22 11.126 -2.354 -1.886 158 HG2 LYS 22 HG2 LYS 22 12.792 -2.182 -4.103 159 HG3 LYS 22 HG1 LYS 22 13.407 -0.982 -2.965 160 HD2 LYS 22 HD2 LYS 22 12.710 -3.690 -1.943 161 HD3 LYS 22 HD1 LYS 22 14.199 -3.495 -2.869 162 HE2 LYS 22 HE2 LYS 22 14.995 -1.826 -1.330 163 HE3 LYS 22 HE1 LYS 22 13.459 -1.832 -0.466 164 HZ1 LYS 22 HZ1 LYS 22 15.050 -4.303 -0.704 165 HZ2 LYS 22 HZ2 LYS 22 13.894 -3.890 0.460 166 HZ3 LYS 22 HZ3 LYS 22 15.419 -3.159 0.487 167 H ILE 23 HN ILE 23 10.398 -4.117 -3.705 168 HA ILE 23 HA ILE 23 7.638 -4.637 -3.826 169 HB ILE 23 HB ILE 23 10.071 -6.066 -4.081 170 HG12 ILE 23 HG12 ILE 23 7.612 -7.519 -4.629 171 HG13 ILE 23 HG11 ILE 23 7.591 -5.864 -5.221 172 HG21 ILE 23 HG21 ILE 23 9.653 -6.928 -1.812 173 HG22 ILE 23 HG22 ILE 23 9.558 -8.186 -3.043 174 HG23 ILE 23 HG23 ILE 23 8.084 -7.520 -2.350 175 HD11 ILE 23 HD11 ILE 23 8.413 -7.123 -6.994 176 HD12 ILE 23 HD12 ILE 23 9.484 -8.057 -5.954 177 HD13 ILE 23 HD13 ILE 23 9.830 -6.357 -6.283 178 H TYR 24 HN TYR 24 6.346 -5.803 -2.461 179 HA TYR 24 HA TYR 24 6.771 -5.447 0.421 180 HB2 TYR 24 HB2 TYR 24 4.470 -5.279 -1.387 181 HB3 TYR 24 HB1 TYR 24 4.187 -6.049 0.138 182 HD1 TYR 24 HD2 TYR 24 5.593 -2.903 -1.277 183 HD2 TYR 24 HD1 TYR 24 3.536 -4.794 1.910 184 HE1 TYR 24 HE2 TYR 24 5.210 -0.715 -0.228 185 HE2 TYR 24 HE1 TYR 24 3.141 -2.626 2.966 186 HH TYR 24 HH TYR 24 4.072 -0.420 2.967 187 H LYS 25 HN LYS 25 5.571 -7.330 1.628 188 HA LYS 25 HA LYS 25 5.941 -9.794 0.057 189 HB2 LYS 25 HB2 LYS 25 6.604 -9.178 2.892 190 HB3 LYS 25 HB1 LYS 25 6.215 -10.826 2.405 191 HG2 LYS 25 HG2 LYS 25 8.605 -10.518 2.382 192 HG3 LYS 25 HG1 LYS 25 8.018 -10.731 0.732 193 HD2 LYS 25 HD2 LYS 25 8.480 -8.577 0.142 194 HD3 LYS 25 HD1 LYS 25 8.215 -7.959 1.774 195 HE2 LYS 25 HE2 LYS 25 10.424 -7.881 2.006 196 HE3 LYS 25 HE1 LYS 25 10.418 -9.644 2.004 197 HZ1 LYS 25 HZ1 LYS 25 11.645 -7.999 0.178 198 HZ2 LYS 25 HZ2 LYS 25 10.299 -8.605 -0.644 199 HZ3 LYS 25 HZ3 LYS 25 11.422 -9.670 0.038 200 H VAL 26 HN VAL 26 3.964 -10.569 -0.473 201 HA VAL 26 HA VAL 26 1.742 -10.053 1.235 202 HB VAL 26 HB VAL 26 1.258 -12.038 -0.837 203 HG11 VAL 26 HG11 VAL 26 -0.487 -11.041 0.340 204 HG12 VAL 26 HG12 VAL 26 -0.515 -10.315 -1.270 205 HG13 VAL 26 HG13 VAL 26 0.180 -9.433 0.094 206 HG21 VAL 26 HG21 VAL 26 2.325 -11.063 -2.526 207 HG22 VAL 26 HG22 VAL 26 2.883 -9.766 -1.474 208 HG23 VAL 26 HG23 VAL 26 1.320 -9.639 -2.270 209 H ASP 27 HN ASP 27 2.499 -10.971 3.009 210 HA ASP 27 HA ASP 27 2.988 -13.793 3.205 211 HB2 ASP 27 HB2 ASP 27 3.093 -11.523 5.128 212 HB3 ASP 27 HB1 ASP 27 3.059 -13.153 5.771 213 H ASP 28 HN ASP 28 0.295 -11.695 3.669 214 HA ASP 28 HA ASP 28 -1.495 -13.874 3.828 215 HB2 ASP 28 HB2 ASP 28 -0.344 -13.816 6.141 216 HB3 ASP 28 HB1 ASP 28 -1.340 -12.395 6.436 217 H LEU 29 HN LEU 29 -3.195 -13.096 2.779 218 HA LEU 29 HA LEU 29 -4.245 -10.524 3.590 219 HB2 LEU 29 HB2 LEU 29 -3.712 -9.615 1.676 220 HB3 LEU 29 HB1 LEU 29 -3.258 -11.152 1.019 221 HG LEU 29 HG LEU 29 -6.138 -10.739 1.246 222 HD11 LEU 29 HD11 LEU 29 -4.414 -8.923 -0.332 223 HD12 LEU 29 HD12 LEU 29 -5.893 -8.598 0.579 224 HD13 LEU 29 HD13 LEU 29 -5.975 -9.426 -0.982 225 HD21 LEU 29 HD21 LEU 29 -4.623 -11.503 -1.183 226 HD22 LEU 29 HD22 LEU 29 -6.200 -12.054 -0.608 227 HD23 LEU 29 HD23 LEU 29 -4.728 -12.589 0.198 228 H GLN 30 HN GLN 30 -6.340 -10.407 3.831 229 HA GLN 30 HA GLN 30 -8.030 -12.696 3.166 230 HB2 GLN 30 HB2 GLN 30 -7.345 -11.521 5.778 231 HB3 GLN 30 HB1 GLN 30 -9.056 -11.758 5.514 232 HG2 GLN 30 HG2 GLN 30 -7.867 -13.628 6.667 233 HG3 GLN 30 HG1 GLN 30 -8.788 -14.091 5.235 234 HE21 GLN 30 HE21 GLN 30 -7.562 -14.099 3.209 235 HE22 GLN 30 HE22 GLN 30 -5.916 -14.609 3.242 236 H LYS 31 HN LYS 31 -10.356 -12.287 3.240 237 HA LYS 31 HA LYS 31 -10.989 -9.745 2.083 238 HB2 LYS 31 HB2 LYS 31 -12.196 -12.130 1.866 239 HB3 LYS 31 HB1 LYS 31 -13.110 -11.515 3.233 240 HG2 LYS 31 HG2 LYS 31 -13.753 -11.159 0.613 241 HG3 LYS 31 HG1 LYS 31 -14.337 -10.176 1.951 242 HD2 LYS 31 HD2 LYS 31 -12.815 -8.454 1.494 243 HD3 LYS 31 HD1 LYS 31 -11.810 -9.498 0.485 244 HE2 LYS 31 HE2 LYS 31 -13.584 -9.611 -1.184 245 HE3 LYS 31 HE1 LYS 31 -14.611 -8.596 -0.173 246 HZ1 LYS 31 HZ1 LYS 31 -12.165 -7.290 -0.541 247 HZ2 LYS 31 HZ2 LYS 31 -13.692 -6.821 -1.088 248 HZ3 LYS 31 HZ3 LYS 31 -12.710 -7.796 -2.059 249 H ILE 32 HN ILE 32 -10.633 -8.115 3.453 250 HA ILE 32 HA ILE 32 -11.573 -8.365 6.229 251 HB ILE 32 HB ILE 32 -9.168 -6.919 5.159 252 HG12 ILE 32 HG12 ILE 32 -9.654 -9.705 5.497 253 HG13 ILE 32 HG11 ILE 32 -8.221 -8.897 4.893 254 HG21 ILE 32 HG21 ILE 32 -10.006 -7.528 7.957 255 HG22 ILE 32 HG22 ILE 32 -9.631 -5.961 7.233 256 HG23 ILE 32 HG23 ILE 32 -8.334 -7.147 7.498 257 HD11 ILE 32 HD11 ILE 32 -7.119 -9.324 6.726 258 HD12 ILE 32 HD12 ILE 32 -8.435 -10.402 7.155 259 HD13 ILE 32 HD13 ILE 32 -8.425 -8.740 7.743 260 H ASN 33 HN ASN 33 -12.891 -6.882 7.014 261 HA ASN 33 HA ASN 33 -14.291 -5.106 7.145 262 HB2 ASN 33 HB2 ASN 33 -13.274 -3.003 7.252 263 HB3 ASN 33 HB1 ASN 33 -11.972 -4.119 7.630 264 HD21 ASN 33 HD21 ASN 33 -10.230 -4.246 6.298 265 HD22 ASN 33 HD22 ASN 33 -9.987 -3.208 4.941 266 H GLY 34 HN GLY 34 -14.472 -6.606 4.755 267 HA2 GLY 34 HA2 GLY 34 -15.860 -6.466 2.923 268 HA3 GLY 34 HA1 GLY 34 -15.939 -4.737 3.176 269 H ILE 35 HN ILE 35 -12.745 -5.545 3.192 270 HA ILE 35 HA ILE 35 -12.425 -5.433 0.289 271 HB ILE 35 HB ILE 35 -10.453 -3.757 1.622 272 HG12 ILE 35 HG12 ILE 35 -12.505 -3.287 3.031 273 HG13 ILE 35 HG11 ILE 35 -11.801 -1.890 2.227 274 HG21 ILE 35 HG21 ILE 35 -12.130 -3.737 -0.810 275 HG22 ILE 35 HG22 ILE 35 -10.399 -3.463 -0.617 276 HG23 ILE 35 HG23 ILE 35 -11.543 -2.179 -0.227 277 HD11 ILE 35 HD11 ILE 35 -13.684 -1.470 1.136 278 HD12 ILE 35 HD12 ILE 35 -14.449 -2.659 2.192 279 HD13 ILE 35 HD13 ILE 35 -13.842 -3.145 0.610 280 H TRP 36 HN TRP 36 -10.504 -6.390 -0.450 281 HA TRP 36 HA TRP 36 -9.417 -8.405 1.177 282 HB2 TRP 36 HB2 TRP 36 -8.399 -7.163 -1.393 283 HB3 TRP 36 HB1 TRP 36 -7.697 -8.602 -0.654 284 HD1 TRP 36 HD1 TRP 36 -10.269 -7.613 -3.095 285 HE1 TRP 36 HE1 TRP 36 -11.835 -9.581 -3.637 286 HE3 TRP 36 HE3 TRP 36 -8.929 -10.788 0.684 287 HZ2 TRP 36 HZ2 TRP 36 -12.429 -12.139 -2.601 288 HZ3 TRP 36 HZ3 TRP 36 -10.049 -12.973 0.840 289 HH2 TRP 36 HH2 TRP 36 -11.764 -13.633 -0.769 290 H GLN 37 HN GLN 37 -7.734 -8.380 2.625 291 HA GLN 37 HA GLN 37 -6.220 -5.867 2.807 292 HB2 GLN 37 HB2 GLN 37 -7.627 -6.088 4.695 293 HB3 GLN 37 HB1 GLN 37 -7.133 -7.747 4.950 294 HG2 GLN 37 HG2 GLN 37 -4.789 -6.316 5.093 295 HG3 GLN 37 HG1 GLN 37 -5.984 -5.304 5.877 296 HE21 GLN 37 HE21 GLN 37 -5.425 -8.823 5.815 297 HE22 GLN 37 HE22 GLN 37 -5.330 -8.996 7.550 298 H VAL 38 HN VAL 38 -4.055 -5.907 3.249 299 HA VAL 38 HA VAL 38 -2.806 -8.529 2.745 300 HB VAL 38 HB VAL 38 -1.689 -5.766 2.147 301 HG11 VAL 38 HG11 VAL 38 -0.788 -8.593 1.580 302 HG12 VAL 38 HG12 VAL 38 0.124 -7.260 2.285 303 HG13 VAL 38 HG13 VAL 38 -0.268 -7.250 0.564 304 HG21 VAL 38 HG21 VAL 38 -3.226 -5.760 0.513 305 HG22 VAL 38 HG22 VAL 38 -3.594 -7.475 0.704 306 HG23 VAL 38 HG23 VAL 38 -2.210 -6.971 -0.267 307 H ARG 39 HN ARG 39 -0.891 -9.128 3.679 308 HA ARG 39 HA ARG 39 0.198 -7.520 5.853 309 HB2 ARG 39 HB2 ARG 39 -0.767 -10.366 6.238 310 HB3 ARG 39 HB1 ARG 39 0.167 -9.442 7.392 311 HG2 ARG 39 HG2 ARG 39 -1.566 -8.184 8.022 312 HG3 ARG 39 HG1 ARG 39 -2.323 -8.209 6.438 313 HD2 ARG 39 HD2 ARG 39 -3.537 -9.458 8.279 314 HD3 ARG 39 HD1 ARG 39 -3.238 -10.353 6.791 315 HE ARG 39 HE ARG 39 -1.115 -10.855 8.525 316 HH11 ARG 39 HH11 ARG 39 -4.541 -11.461 8.316 317 HH12 ARG 39 HH12 ARG 39 -4.475 -12.906 9.268 318 HH21 ARG 39 HH21 ARG 39 -1.019 -12.763 9.772 319 HH22 ARG 39 HH22 ARG 39 -2.474 -13.647 10.093 320 H ASN 40 HN ASN 40 2.404 -7.939 6.266 321 HA ASN 40 HA ASN 40 3.603 -10.160 4.846 322 HB2 ASN 40 HB2 ASN 40 5.506 -7.993 5.025 323 HB3 ASN 40 HB1 ASN 40 5.133 -9.054 3.707 324 HD21 ASN 40 HD21 ASN 40 5.750 -6.219 3.836 325 HD22 ASN 40 HD22 ASN 40 4.519 -5.510 2.863 326 H ASN 41 HN ASN 41 5.452 -10.842 5.740 327 HA ASN 41 HA ASN 41 5.435 -10.980 8.501 328 HB2 ASN 41 HB2 ASN 41 7.887 -11.946 7.997 329 HB3 ASN 41 HB1 ASN 41 6.434 -12.844 7.593 330 HD21 ASN 41 HD21 ASN 41 7.376 -10.025 5.888 331 HD22 ASN 41 HD22 ASN 41 7.708 -10.757 4.388 332 H ILE 42 HN ILE 42 6.839 -8.551 6.495 333 HA ILE 42 HA ILE 42 8.912 -7.821 8.273 334 HB ILE 42 HB ILE 42 7.808 -6.297 5.955 335 HG12 ILE 42 HG12 ILE 42 10.093 -7.423 5.063 336 HG13 ILE 42 HG11 ILE 42 9.494 -8.698 6.113 337 HG21 ILE 42 HG21 ILE 42 10.570 -5.967 6.332 338 HG22 ILE 42 HG22 ILE 42 9.777 -5.756 7.891 339 HG23 ILE 42 HG23 ILE 42 9.277 -4.784 6.511 340 HD11 ILE 42 HD11 ILE 42 7.272 -8.386 4.943 341 HD12 ILE 42 HD12 ILE 42 8.569 -9.178 4.039 342 HD13 ILE 42 HD13 ILE 42 8.177 -7.488 3.723 343 H LEU 43 HN LEU 43 5.923 -6.411 7.059 344 HA LEU 43 HA LEU 43 5.915 -4.519 9.249 345 HB2 LEU 43 HB2 LEU 43 4.067 -4.612 6.891 346 HB3 LEU 43 HB1 LEU 43 4.213 -3.319 8.055 347 HG LEU 43 HG LEU 43 5.435 -2.381 6.440 348 HD11 LEU 43 HD11 LEU 43 7.024 -2.850 8.285 349 HD12 LEU 43 HD12 LEU 43 7.788 -2.637 6.710 350 HD13 LEU 43 HD13 LEU 43 7.582 -4.255 7.378 351 HD21 LEU 43 HD21 LEU 43 6.922 -4.082 4.960 352 HD22 LEU 43 HD22 LEU 43 5.285 -3.554 4.557 353 HD23 LEU 43 HD23 LEU 43 5.540 -5.098 5.380 354 H VAL 44 HN VAL 44 4.643 -7.530 8.390 355 HA VAL 44 HA VAL 44 2.740 -7.301 10.560 356 HB VAL 44 HB VAL 44 1.694 -8.478 8.088 357 HG11 VAL 44 HG11 VAL 44 -0.252 -8.594 9.212 358 HG12 VAL 44 HG12 VAL 44 -0.011 -7.025 9.979 359 HG13 VAL 44 HG13 VAL 44 0.787 -8.456 10.627 360 HG21 VAL 44 HG21 VAL 44 0.700 -6.395 7.435 361 HG22 VAL 44 HG22 VAL 44 2.443 -6.173 7.572 362 HG23 VAL 44 HG23 VAL 44 1.380 -5.593 8.852 363 HA PRO 45 HA PRO 45 5.233 -11.202 10.552 364 HB2 PRO 45 HB2 PRO 45 4.588 -10.437 13.358 365 HB3 PRO 45 HB1 PRO 45 6.064 -11.198 12.755 366 HG2 PRO 45 HG2 PRO 45 6.078 -8.668 13.340 367 HG3 PRO 45 HG1 PRO 45 6.767 -9.163 11.776 368 HD2 PRO 45 HD2 PRO 45 4.094 -7.956 12.378 369 HD3 PRO 45 HD1 PRO 45 5.204 -7.617 11.065 370 H THR 46 HN THR 46 2.412 -9.966 12.088 371 HA THR 46 HA THR 46 0.572 -11.797 11.254 372 HB THR 46 HB THR 46 1.976 -13.424 12.574 373 HG1 THR 46 HG1 THR 46 -0.670 -13.117 13.534 374 HG21 THR 46 HG21 THR 46 0.747 -12.751 15.108 375 HG22 THR 46 HG22 THR 46 1.912 -11.540 14.571 376 HG23 THR 46 HG23 THR 46 2.404 -13.226 14.738 377 H ASP 47 HN ASP 47 -1.515 -11.514 12.187 378 HA ASP 47 HA ASP 47 -3.173 -10.465 13.384 379 HB2 ASP 47 HB2 ASP 47 -1.242 -9.044 15.056 380 HB3 ASP 47 HB1 ASP 47 -2.804 -9.698 15.503 381 H PHE 48 HN PHE 48 -2.740 -9.132 11.115 382 HA PHE 48 HA PHE 48 -2.150 -6.395 11.610 383 HB2 PHE 48 HB2 PHE 48 -2.058 -7.971 9.393 384 HB3 PHE 48 HB1 PHE 48 -3.585 -7.150 9.143 385 HD1 PHE 48 HD2 PHE 48 -1.489 -4.939 10.933 386 HD2 PHE 48 HD1 PHE 48 -2.105 -6.597 7.069 387 HE1 PHE 48 HE2 PHE 48 -0.283 -3.055 9.905 388 HE2 PHE 48 HE1 PHE 48 -0.876 -4.748 6.063 389 HZ PHE 48 HZ PHE 48 0.031 -2.963 7.474 390 H THR 49 HN THR 49 -3.683 -5.276 12.663 391 HA THR 49 HA THR 49 -6.209 -6.078 13.276 392 HB THR 49 HB THR 49 -5.978 -3.198 12.673 393 HG1 THR 49 HG1 THR 49 -3.882 -3.704 13.482 394 HG21 THR 49 HG21 THR 49 -7.883 -3.953 13.850 395 HG22 THR 49 HG22 THR 49 -6.876 -2.976 14.924 396 HG23 THR 49 HG23 THR 49 -6.874 -4.735 15.073 397 H TRP 50 HN TRP 50 -7.210 -7.067 11.647 398 HA TRP 50 HA TRP 50 -7.640 -6.392 9.031 399 HB2 TRP 50 HB2 TRP 50 -9.451 -7.619 11.089 400 HB3 TRP 50 HB1 TRP 50 -9.953 -7.452 9.466 401 HD1 TRP 50 HD1 TRP 50 -6.350 -8.432 9.842 402 HE1 TRP 50 HE1 TRP 50 -6.056 -10.930 9.321 403 HE3 TRP 50 HE3 TRP 50 -11.268 -9.811 9.682 404 HZ2 TRP 50 HZ2 TRP 50 -7.689 -13.191 8.896 405 HZ3 TRP 50 HZ3 TRP 50 -11.816 -12.163 9.207 406 HH2 TRP 50 HH2 TRP 50 -10.062 -13.816 8.822 407 H VAL 51 HN VAL 51 -8.958 -4.968 11.881 408 HA VAL 51 HA VAL 51 -11.246 -3.742 11.018 409 HB VAL 51 HB VAL 51 -10.274 -3.822 13.381 410 HG11 VAL 51 HG11 VAL 51 -8.951 -2.053 14.172 411 HG12 VAL 51 HG12 VAL 51 -9.144 -1.138 12.678 412 HG13 VAL 51 HG13 VAL 51 -8.162 -2.603 12.693 413 HG21 VAL 51 HG21 VAL 51 -11.284 -1.106 13.097 414 HG22 VAL 51 HG22 VAL 51 -11.961 -2.481 13.973 415 HG23 VAL 51 HG23 VAL 51 -12.250 -2.312 12.242 416 H ASP 52 HN ASP 52 -8.075 -2.367 11.189 417 HA ASP 52 HA ASP 52 -8.589 -0.761 8.854 418 HB2 ASP 52 HB2 ASP 52 -9.514 0.492 10.741 419 HB3 ASP 52 HB1 ASP 52 -7.940 0.453 11.509 420 H ASN 53 HN ASN 53 -6.448 -2.316 10.910 421 HA ASN 53 HA ASN 53 -4.148 -0.864 9.953 422 HB2 ASN 53 HB2 ASN 53 -4.250 -3.271 11.747 423 HB3 ASN 53 HB1 ASN 53 -2.832 -2.305 11.417 424 HD21 ASN 53 HD21 ASN 53 -5.477 -0.239 11.642 425 HD22 ASN 53 HD22 ASN 53 -5.343 0.179 13.303 426 H GLY 54 HN GLY 54 -5.948 -3.440 9.013 427 HA2 GLY 54 HA2 GLY 54 -3.876 -4.803 7.662 428 HA3 GLY 54 HA1 GLY 54 -5.613 -5.041 7.518 429 H ILE 55 HN ILE 55 -3.438 -4.576 5.537 430 HA ILE 55 HA ILE 55 -4.108 -2.051 4.378 431 HB ILE 55 HB ILE 55 -2.010 -2.389 3.660 432 HG12 ILE 55 HG12 ILE 55 -2.010 -3.915 1.508 433 HG13 ILE 55 HG11 ILE 55 -3.738 -3.670 1.689 434 HG21 ILE 55 HG21 ILE 55 -2.438 -5.279 3.747 435 HG22 ILE 55 HG22 ILE 55 -1.581 -4.291 4.913 436 HG23 ILE 55 HG23 ILE 55 -0.936 -4.490 3.287 437 HD11 ILE 55 HD11 ILE 55 -3.209 -1.224 1.931 438 HD12 ILE 55 HD12 ILE 55 -3.094 -1.948 0.333 439 HD13 ILE 55 HD13 ILE 55 -1.632 -1.642 1.277 440 H ALA 56 HN ALA 56 -5.863 -1.697 3.122 441 HA ALA 56 HA ALA 56 -7.313 -3.891 2.075 442 HB1 ALA 56 HB1 ALA 56 -7.758 -1.060 2.337 443 HB2 ALA 56 HB2 ALA 56 -8.937 -2.349 2.099 444 HB3 ALA 56 HB3 ALA 56 -8.161 -1.596 0.706 445 H ALA 57 HN ALA 57 -5.891 -5.026 0.938 446 HA ALA 57 HA ALA 57 -4.011 -4.444 -0.722 447 HB1 ALA 57 HB1 ALA 57 -5.284 -6.700 -0.272 448 HB2 ALA 57 HB2 ALA 57 -4.144 -6.513 -1.607 449 HB3 ALA 57 HB3 ALA 57 -5.881 -6.390 -1.903 450 H ASP 58 HN ASP 58 -7.354 -3.937 -1.617 451 HA ASP 58 HA ASP 58 -7.095 -3.522 -4.334 452 HB2 ASP 58 HB2 ASP 58 -9.212 -3.570 -2.940 453 HB3 ASP 58 HB1 ASP 58 -8.870 -1.885 -2.620 454 H ASP 59 HN ASP 59 -6.399 -1.394 -1.664 455 HA ASP 59 HA ASP 59 -5.992 0.964 -3.124 456 HB2 ASP 59 HB2 ASP 59 -4.500 0.399 -0.595 457 HB3 ASP 59 HB1 ASP 59 -5.307 1.858 -1.112 458 H VAL 60 HN VAL 60 -3.933 -1.832 -2.519 459 HA VAL 60 HA VAL 60 -1.655 -0.362 -3.516 460 HB VAL 60 HB VAL 60 -0.321 -2.180 -2.804 461 HG11 VAL 60 HG11 VAL 60 -0.667 -0.518 -1.211 462 HG12 VAL 60 HG12 VAL 60 -0.867 -2.051 -0.362 463 HG13 VAL 60 HG13 VAL 60 -2.281 -1.110 -0.847 464 HG21 VAL 60 HG21 VAL 60 -2.329 -3.641 -1.356 465 HG22 VAL 60 HG22 VAL 60 -1.065 -4.228 -2.444 466 HG23 VAL 60 HG23 VAL 60 -2.598 -3.654 -3.095 467 H ILE 61 HN ILE 61 -0.121 -2.197 -4.639 468 HA ILE 61 HA ILE 61 -1.626 -3.377 -6.797 469 HB ILE 61 HB ILE 61 0.437 -2.152 -8.090 470 HG12 ILE 61 HG12 ILE 61 -0.812 0.038 -6.666 471 HG13 ILE 61 HG11 ILE 61 0.274 -0.875 -5.682 472 HG21 ILE 61 HG21 ILE 61 -1.307 -1.011 -9.133 473 HG22 ILE 61 HG22 ILE 61 -2.174 -0.852 -7.596 474 HG23 ILE 61 HG23 ILE 61 -2.125 -2.420 -8.432 475 HD11 ILE 61 HD11 ILE 61 1.656 -0.464 -8.019 476 HD12 ILE 61 HD12 ILE 61 1.895 0.349 -6.471 477 HD13 ILE 61 HD13 ILE 61 0.833 1.062 -7.683 478 H GLU 62 HN GLU 62 -0.972 -5.414 -6.706 479 HA GLU 62 HA GLU 62 1.494 -6.287 -5.696 480 HB2 GLU 62 HB2 GLU 62 0.738 -8.437 -6.979 481 HB3 GLU 62 HB1 GLU 62 -0.086 -7.929 -5.523 482 HG2 GLU 62 HG2 GLU 62 -1.564 -8.679 -7.386 483 HG3 GLU 62 HG1 GLU 62 -1.911 -7.064 -6.776 484 H VAL 63 HN VAL 63 3.413 -6.424 -6.512 485 HA VAL 63 HA VAL 63 3.692 -6.195 -9.436 486 HB VAL 63 HB VAL 63 6.084 -5.633 -8.872 487 HG11 VAL 63 HG11 VAL 63 5.173 -3.673 -9.432 488 HG12 VAL 63 HG12 VAL 63 5.215 -3.346 -7.707 489 HG13 VAL 63 HG13 VAL 63 3.735 -3.950 -8.452 490 HG21 VAL 63 HG21 VAL 63 5.847 -6.626 -6.545 491 HG22 VAL 63 HG22 VAL 63 5.082 -5.098 -6.106 492 HG23 VAL 63 HG23 VAL 63 6.744 -5.116 -6.697 493 H THR 64 HN THR 64 5.691 -7.353 -10.302 494 HA THR 64 HA THR 64 5.630 -10.094 -9.329 495 HB THR 64 HB THR 64 6.622 -10.752 -11.330 496 HG1 THR 64 HG1 THR 64 7.840 -9.339 -12.628 497 HG21 THR 64 HG21 THR 64 5.763 -8.910 -13.094 498 HG22 THR 64 HG22 THR 64 4.764 -8.516 -11.694 499 HG23 THR 64 HG23 THR 64 4.740 -10.146 -12.366 500 H SER 65 HN SER 65 7.672 -11.263 -8.967 501 HA SER 65 HA SER 65 9.148 -10.425 -6.906 502 HB2 SER 65 HB2 SER 65 10.792 -12.074 -7.436 503 HB3 SER 65 HB1 SER 65 9.244 -12.680 -8.022 504 HG SER 65 HG SER 65 9.938 -11.679 -10.101 505 H ASN 66 HN ASN 66 9.715 -9.395 -10.210 506 HA ASN 66 HA ASN 66 12.223 -8.188 -9.592 507 HB2 ASN 66 HB2 ASN 66 11.126 -9.100 -11.883 508 HB3 ASN 66 HB1 ASN 66 10.861 -7.370 -12.009 509 HD21 ASN 66 HD21 ASN 66 12.991 -9.832 -12.595 510 HD22 ASN 66 HD22 ASN 66 14.431 -8.905 -12.817 511 H GLY 67 HN GLY 67 9.077 -7.364 -9.091 512 HA2 GLY 67 HA2 GLY 67 8.364 -5.415 -7.970 513 HA3 GLY 67 HA1 GLY 67 9.749 -4.558 -8.634 514 H THR 68 HN THR 68 7.888 -6.593 -10.711 515 HA THR 68 HA THR 68 7.280 -4.385 -12.379 516 HB THR 68 HB THR 68 7.149 -7.293 -12.542 517 HG1 THR 68 HG1 THR 68 7.525 -5.260 -14.477 518 HG21 THR 68 HG21 THR 68 4.834 -6.992 -12.926 519 HG22 THR 68 HG22 THR 68 5.617 -7.273 -14.481 520 HG23 THR 68 HG23 THR 68 5.137 -5.641 -14.015 521 H ARG 69 HN ARG 69 5.644 -3.051 -12.116 522 HA ARG 69 HA ARG 69 3.460 -3.641 -10.369 523 HB2 ARG 69 HB2 ARG 69 4.383 -1.315 -11.935 524 HB3 ARG 69 HB1 ARG 69 2.650 -1.394 -11.646 525 HG2 ARG 69 HG2 ARG 69 3.193 -1.696 -9.202 526 HG3 ARG 69 HG1 ARG 69 4.859 -1.280 -9.615 527 HD2 ARG 69 HD2 ARG 69 2.670 0.518 -10.531 528 HD3 ARG 69 HD1 ARG 69 3.136 0.557 -8.830 529 HE ARG 69 HE ARG 69 5.503 0.780 -10.087 530 HH11 ARG 69 HH11 ARG 69 2.480 2.485 -10.459 531 HH12 ARG 69 HH12 ARG 69 3.231 3.958 -10.974 532 HH21 ARG 69 HH21 ARG 69 6.491 2.717 -10.762 533 HH22 ARG 69 HH22 ARG 69 5.507 4.090 -11.145 534 H THR 70 HN THR 70 1.327 -4.031 -10.819 535 HA THR 70 HA THR 70 0.346 -4.084 -13.528 536 HB THR 70 HB THR 70 -0.188 -6.465 -13.592 537 HG1 THR 70 HG1 THR 70 -0.350 -7.036 -11.482 538 HG21 THR 70 HG21 THR 70 2.729 -6.227 -12.920 539 HG22 THR 70 HG22 THR 70 2.032 -5.724 -14.461 540 HG23 THR 70 HG23 THR 70 1.948 -7.414 -13.964 541 H SER 71 HN SER 71 -1.172 -2.631 -12.621 542 HA SER 71 HA SER 71 -2.841 -3.399 -10.418 543 HB2 SER 71 HB2 SER 71 -4.195 -1.341 -11.352 544 HB3 SER 71 HB1 SER 71 -2.651 -1.099 -10.538 545 HG SER 71 HG SER 71 -2.899 -1.389 -13.346 546 H ASP 72 HN ASP 72 -3.008 -3.703 -13.881 547 HA ASP 72 HA ASP 72 -5.749 -3.990 -14.257 548 HB2 ASP 72 HB2 ASP 72 -3.321 -4.929 -15.700 549 HB3 ASP 72 HB1 ASP 72 -4.858 -5.673 -16.128 550 H GLN 73 HN GLN 73 -3.384 -6.262 -13.033 551 HA GLN 73 HA GLN 73 -5.136 -8.537 -13.149 552 HB2 GLN 73 HB2 GLN 73 -2.369 -8.012 -12.481 553 HB3 GLN 73 HB1 GLN 73 -3.107 -9.088 -11.303 554 HG2 GLN 73 HG2 GLN 73 -3.494 -10.743 -12.851 555 HG3 GLN 73 HG1 GLN 73 -3.477 -9.622 -14.210 556 HE21 GLN 73 HE21 GLN 73 -1.403 -11.047 -11.731 557 HE22 GLN 73 HE22 GLN 73 0.032 -11.068 -12.691 558 H VAL 74 HN VAL 74 -5.197 -9.853 -10.939 559 HA VAL 74 HA VAL 74 -6.498 -8.083 -8.970 560 HB VAL 74 HB VAL 74 -7.986 -9.752 -10.015 561 HG11 VAL 74 HG11 VAL 74 -6.371 -11.876 -8.629 562 HG12 VAL 74 HG12 VAL 74 -6.146 -11.460 -10.327 563 HG13 VAL 74 HG13 VAL 74 -7.699 -12.082 -9.770 564 HG21 VAL 74 HG21 VAL 74 -7.432 -9.605 -7.133 565 HG22 VAL 74 HG22 VAL 74 -8.419 -10.975 -7.639 566 HG23 VAL 74 HG23 VAL 74 -8.932 -9.331 -8.017 567 H LEU 75 HN LEU 75 -5.660 -7.947 -6.970 568 HA LEU 75 HA LEU 75 -3.162 -9.003 -6.323 569 HB2 LEU 75 HB2 LEU 75 -4.818 -7.151 -5.224 570 HB3 LEU 75 HB1 LEU 75 -4.863 -8.415 -4.019 571 HG LEU 75 HG LEU 75 -2.210 -7.522 -5.034 572 HD11 LEU 75 HD11 LEU 75 -4.126 -5.826 -3.608 573 HD12 LEU 75 HD12 LEU 75 -2.688 -5.393 -4.530 574 HD13 LEU 75 HD13 LEU 75 -2.533 -5.934 -2.858 575 HD21 LEU 75 HD21 LEU 75 -2.900 -8.048 -2.193 576 HD22 LEU 75 HD22 LEU 75 -1.418 -8.396 -3.083 577 HD23 LEU 75 HD23 LEU 75 -2.843 -9.407 -3.315 578 H GLN 76 HN GLN 76 -2.482 -10.547 -4.919 579 HA GLN 76 HA GLN 76 -4.290 -12.428 -3.711 580 HB2 GLN 76 HB2 GLN 76 -2.297 -13.485 -5.719 581 HB3 GLN 76 HB1 GLN 76 -3.540 -14.385 -4.865 582 HG2 GLN 76 HG2 GLN 76 -5.240 -13.568 -6.212 583 HG3 GLN 76 HG1 GLN 76 -4.285 -12.190 -6.751 584 HE21 GLN 76 HE21 GLN 76 -4.377 -15.722 -6.887 585 HE22 GLN 76 HE22 GLN 76 -3.727 -15.851 -8.482 586 H LYS 77 HN LYS 77 -3.388 -13.193 -1.890 587 HA LYS 77 HA LYS 77 -0.765 -12.291 -1.191 588 HB2 LYS 77 HB2 LYS 77 -1.184 -12.797 0.970 589 HB3 LYS 77 HB1 LYS 77 -2.809 -12.497 0.369 590 HG2 LYS 77 HG2 LYS 77 -1.775 -15.289 0.368 591 HG3 LYS 77 HG1 LYS 77 -2.277 -14.567 1.893 592 HD2 LYS 77 HD2 LYS 77 -4.481 -14.131 0.996 593 HD3 LYS 77 HD1 LYS 77 -3.989 -14.739 -0.585 594 HE2 LYS 77 HE2 LYS 77 -5.270 -16.411 0.633 595 HE3 LYS 77 HE1 LYS 77 -3.608 -16.947 0.394 596 HZ1 LYS 77 HZ1 LYS 77 -4.886 -16.996 2.745 597 HZ2 LYS 77 HZ2 LYS 77 -4.083 -15.512 2.860 598 HZ3 LYS 77 HZ3 LYS 77 -3.204 -16.930 2.584 599 H GLY 78 HN GLY 78 0.970 -13.480 -0.432 600 HA2 GLY 78 HA2 GLY 78 1.936 -15.703 -0.056 601 HA3 GLY 78 HA1 GLY 78 1.059 -16.235 -1.487 602 H GLY 79 HN GLY 79 2.399 -13.049 -1.547 603 HA2 GLY 79 HA2 GLY 79 4.858 -14.016 -2.789 604 HA3 GLY 79 HA1 GLY 79 3.726 -13.223 -3.865 605 H TYR 80 HN TYR 80 3.813 -11.121 -4.064 606 HA TYR 80 HA TYR 80 4.948 -9.408 -2.042 607 HB2 TYR 80 HB2 TYR 80 6.197 -8.765 -4.578 608 HB3 TYR 80 HB1 TYR 80 6.948 -9.021 -3.010 609 HD1 TYR 80 HD2 TYR 80 5.432 -11.008 -5.792 610 HD2 TYR 80 HD1 TYR 80 8.463 -10.749 -2.818 611 HE1 TYR 80 HE2 TYR 80 6.414 -13.105 -6.620 612 HE2 TYR 80 HE1 TYR 80 9.456 -12.843 -3.639 613 HH TYR 80 HH TYR 80 9.296 -14.074 -6.207 614 H PHE 81 HN PHE 81 4.681 -7.113 -2.615 615 HA PHE 81 HA PHE 81 3.072 -6.534 -4.921 616 HB2 PHE 81 HB2 PHE 81 1.271 -5.366 -3.639 617 HB3 PHE 81 HB1 PHE 81 1.240 -7.117 -3.524 618 HD1 PHE 81 HD1 PHE 81 2.810 -7.987 -1.496 619 HD2 PHE 81 HD2 PHE 81 0.797 -4.217 -1.703 620 HE1 PHE 81 HE1 PHE 81 2.759 -7.854 0.971 621 HE2 PHE 81 HE2 PHE 81 0.761 -4.087 0.719 622 HZ PHE 81 HZ PHE 81 1.738 -5.901 2.080 623 H VAL 82 HN VAL 82 2.381 -4.197 -4.839 624 HA VAL 82 HA VAL 82 4.426 -2.595 -3.494 625 HB VAL 82 HB VAL 82 4.103 -3.062 -6.364 626 HG11 VAL 82 HG11 VAL 82 3.838 -0.288 -5.334 627 HG12 VAL 82 HG12 VAL 82 3.221 -1.019 -6.815 628 HG13 VAL 82 HG13 VAL 82 4.912 -0.541 -6.709 629 HG21 VAL 82 HG21 VAL 82 6.266 -3.361 -5.985 630 HG22 VAL 82 HG22 VAL 82 6.192 -2.520 -4.438 631 HG23 VAL 82 HG23 VAL 82 6.417 -1.609 -5.931 632 H ILE 83 HN ILE 83 3.448 -0.968 -2.438 633 HA ILE 83 HA ILE 83 0.638 -0.593 -2.709 634 HB ILE 83 HB ILE 83 2.738 0.897 -1.227 635 HG12 ILE 83 HG12 ILE 83 2.166 -0.294 0.656 636 HG13 ILE 83 HG11 ILE 83 0.494 -0.471 0.143 637 HG21 ILE 83 HG21 ILE 83 -0.064 1.609 -1.685 638 HG22 ILE 83 HG22 ILE 83 1.329 2.634 -1.344 639 HG23 ILE 83 HG23 ILE 83 0.525 1.778 -0.033 640 HD11 ILE 83 HD11 ILE 83 1.097 -2.249 -1.347 641 HD12 ILE 83 HD12 ILE 83 1.734 -2.586 0.261 642 HD13 ILE 83 HD13 ILE 83 2.807 -2.003 -1.003 643 H ASN 84 HN ASN 84 -0.233 0.476 -4.368 644 HA ASN 84 HA ASN 84 1.122 2.202 -6.043 645 HB2 ASN 84 HB2 ASN 84 -1.453 1.208 -5.908 646 HB3 ASN 84 HB1 ASN 84 -1.666 2.931 -5.680 647 HD21 ASN 84 HD21 ASN 84 -2.000 0.865 -7.974 648 HD22 ASN 84 HD22 ASN 84 -1.395 1.723 -9.340 649 HA PRO 85 HA PRO 85 1.651 5.623 -3.115 650 HB2 PRO 85 HB2 PRO 85 2.969 7.247 -4.801 651 HB3 PRO 85 HB1 PRO 85 3.760 5.812 -4.122 652 HG2 PRO 85 HG2 PRO 85 2.295 6.061 -6.745 653 HG3 PRO 85 HG1 PRO 85 3.946 5.521 -6.472 654 HD2 PRO 85 HD2 PRO 85 2.068 3.718 -6.736 655 HD3 PRO 85 HD1 PRO 85 3.255 3.529 -5.423 656 H ASN 86 HN ASN 86 0.397 5.637 -6.274 657 HA ASN 86 HA ASN 86 -0.744 8.204 -6.153 658 HB2 ASN 86 HB2 ASN 86 -0.695 5.973 -8.070 659 HB3 ASN 86 HB1 ASN 86 -2.154 6.943 -8.118 660 HD21 ASN 86 HD21 ASN 86 1.352 7.395 -7.897 661 HD22 ASN 86 HD22 ASN 86 1.426 8.706 -9.021 662 H ASN 87 HN ASN 87 -1.671 5.068 -5.123 663 HA ASN 87 HA ASN 87 -4.459 5.722 -4.705 664 HB2 ASN 87 HB2 ASN 87 -3.116 3.359 -4.897 665 HB3 ASN 87 HB1 ASN 87 -3.244 3.604 -3.159 666 HD21 ASN 87 HD21 ASN 87 -4.723 2.428 -5.856 667 HD22 ASN 87 HD22 ASN 87 -6.330 2.245 -5.248 668 H VAL 88 HN VAL 88 -1.590 6.564 -3.433 669 HA VAL 88 HA VAL 88 -2.369 6.575 -0.716 670 HB VAL 88 HB VAL 88 0.210 7.034 -2.149 671 HG11 VAL 88 HG11 VAL 88 0.735 6.910 0.543 672 HG12 VAL 88 HG12 VAL 88 -0.783 7.824 0.486 673 HG13 VAL 88 HG13 VAL 88 0.631 8.396 -0.408 674 HG21 VAL 88 HG21 VAL 88 0.236 5.076 -0.100 675 HG22 VAL 88 HG22 VAL 88 0.363 4.839 -1.863 676 HG23 VAL 88 HG23 VAL 88 -1.224 4.836 -1.071 677 H LYS 89 HN LYS 89 -2.879 8.165 0.241 678 HA LYS 89 HA LYS 89 -2.924 10.815 -0.917 679 HB2 LYS 89 HB2 LYS 89 -4.117 9.768 1.617 680 HB3 LYS 89 HB1 LYS 89 -4.371 11.377 0.970 681 HG2 LYS 89 HG2 LYS 89 -6.237 9.902 0.557 682 HG3 LYS 89 HG1 LYS 89 -5.490 10.434 -0.936 683 HD2 LYS 89 HD2 LYS 89 -4.487 7.924 0.171 684 HD3 LYS 89 HD1 LYS 89 -6.168 7.914 -0.352 685 HE2 LYS 89 HE2 LYS 89 -3.745 7.853 -1.893 686 HE3 LYS 89 HE1 LYS 89 -5.386 7.485 -2.378 687 HZ1 LYS 89 HZ1 LYS 89 -5.740 9.927 -2.622 688 HZ2 LYS 89 HZ2 LYS 89 -4.637 9.266 -3.717 689 HZ3 LYS 89 HZ3 LYS 89 -4.078 10.142 -2.384 690 H SER 90 HN SER 90 -1.770 8.948 1.730 691 HA SER 90 HA SER 90 0.624 10.385 2.073 692 HB2 SER 90 HB2 SER 90 0.278 12.113 3.497 693 HB3 SER 90 HB1 SER 90 -1.363 12.045 2.861 694 HG SER 90 HG SER 90 -1.611 11.983 5.023 695 H VAL 91 HN VAL 91 1.608 10.123 4.323 696 HA VAL 91 HA VAL 91 0.904 7.520 5.430 697 HB VAL 91 HB VAL 91 3.418 8.146 6.382 698 HG11 VAL 91 HG11 VAL 91 4.098 6.483 4.458 699 HG12 VAL 91 HG12 VAL 91 2.347 6.352 4.273 700 HG13 VAL 91 HG13 VAL 91 3.104 5.954 5.815 701 HG21 VAL 91 HG21 VAL 91 3.235 8.978 3.496 702 HG22 VAL 91 HG22 VAL 91 4.745 8.639 4.341 703 HG23 VAL 91 HG23 VAL 91 3.724 9.978 4.863 704 H GLY 92 HN GLY 92 0.211 7.537 7.513 705 HA2 GLY 92 HA2 GLY 92 0.169 10.074 8.896 706 HA3 GLY 92 HA1 GLY 92 -0.911 8.719 9.176 707 H THR 93 HN THR 93 -0.173 9.690 11.264 708 HA THR 93 HA THR 93 2.292 9.119 12.483 709 HB THR 93 HB THR 93 -0.219 9.133 14.061 710 HG1 THR 93 HG1 THR 93 -0.963 10.645 12.773 711 HG21 THR 93 HG21 THR 93 1.778 9.390 15.290 712 HG22 THR 93 HG22 THR 93 0.991 10.968 15.239 713 HG23 THR 93 HG23 THR 93 2.361 10.630 14.182 714 HA PRO 94 HA PRO 94 2.065 4.855 13.144 715 HB2 PRO 94 HB2 PRO 94 4.283 4.634 14.504 716 HB3 PRO 94 HB1 PRO 94 4.324 5.309 12.867 717 HG2 PRO 94 HG2 PRO 94 4.186 6.823 15.443 718 HG3 PRO 94 HG1 PRO 94 5.401 6.967 14.164 719 HD2 PRO 94 HD2 PRO 94 3.295 8.587 14.281 720 HD3 PRO 94 HD1 PRO 94 3.951 8.016 12.731 721 H MET 95 HN MET 95 1.826 3.330 14.760 722 HA MET 95 HA MET 95 1.400 4.175 17.505 723 HB2 MET 95 HB2 MET 95 -0.815 2.966 15.842 724 HB3 MET 95 HB1 MET 95 -0.869 3.158 17.589 725 HG2 MET 95 HG2 MET 95 -0.356 5.672 16.972 726 HG3 MET 95 HG1 MET 95 -1.090 5.195 15.443 727 HE1 MET 95 HE1 MET 95 -2.285 6.461 19.186 728 HE2 MET 95 HE2 MET 95 -3.338 7.299 18.046 729 HE3 MET 95 HE3 MET 95 -1.600 7.228 17.753 730 H LYS 96 HN LYS 96 1.868 2.570 18.947 731 HA LYS 96 HA LYS 96 2.832 0.065 17.840 732 HB2 LYS 96 HB2 LYS 96 2.749 0.800 20.761 733 HB3 LYS 96 HB1 LYS 96 3.808 -0.354 19.965 734 HG2 LYS 96 HG2 LYS 96 4.975 1.454 18.844 735 HG3 LYS 96 HG1 LYS 96 3.882 2.631 19.577 736 HD2 LYS 96 HD2 LYS 96 5.043 2.647 21.486 737 HD3 LYS 96 HD1 LYS 96 5.078 0.884 21.560 738 HE2 LYS 96 HE2 LYS 96 6.884 1.106 19.704 739 HE3 LYS 96 HE1 LYS 96 7.018 2.767 20.280 740 HZ1 LYS 96 HZ1 LYS 96 8.358 0.674 21.307 741 HZ2 LYS 96 HZ2 LYS 96 7.049 0.780 22.373 742 HZ3 LYS 96 HZ3 LYS 96 8.056 2.118 22.135 743 H GLY 97 HN GLY 97 1.685 -1.799 17.773 744 HA2 GLY 97 HA2 GLY 97 -0.118 -2.541 19.835 745 HA3 GLY 97 HA1 GLY 97 -1.016 -1.890 18.478 746 H SER 98 HN SER 98 0.134 -2.887 16.289 747 HA SER 98 HA SER 98 -0.744 -5.565 16.270 748 HB2 SER 98 HB2 SER 98 0.552 -3.726 14.337 749 HB3 SER 98 HB1 SER 98 0.722 -5.429 13.999 750 HG SER 98 HG SER 98 -1.489 -5.635 13.933 751 H GLY 99 HN GLY 99 0.662 -6.158 18.217 752 HA2 GLY 99 HA2 GLY 99 2.214 -7.986 18.519 753 HA3 GLY 99 HA1 GLY 99 3.180 -7.318 17.216 754 H GLY 100 HN GLY 100 3.498 -4.697 17.938 755 HA2 GLY 100 HA2 GLY 100 3.965 -3.842 20.425 756 HA3 GLY 100 HA1 GLY 100 5.279 -4.970 20.173 757 H LEU 101 HN LEU 101 5.063 -4.048 17.206 758 HA LEU 101 HA LEU 101 7.176 -2.173 17.272 759 HB2 LEU 101 HB2 LEU 101 5.600 -2.709 14.863 760 HB3 LEU 101 HB1 LEU 101 7.315 -2.550 15.079 761 HG LEU 101 HG LEU 101 7.139 -4.853 16.264 762 HD11 LEU 101 HD11 LEU 101 5.410 -6.280 15.464 763 HD12 LEU 101 HD12 LEU 101 4.820 -5.028 14.377 764 HD13 LEU 101 HD13 LEU 101 4.587 -4.861 16.107 765 HD21 LEU 101 HD21 LEU 101 8.041 -3.974 14.032 766 HD22 LEU 101 HD22 LEU 101 6.653 -4.847 13.368 767 HD23 LEU 101 HD23 LEU 101 7.878 -5.711 14.309 768 H SER 102 HN SER 102 6.413 -0.873 14.938 769 HA SER 102 HA SER 102 4.458 1.071 15.903 770 HB2 SER 102 HB2 SER 102 7.132 1.336 14.703 771 HB3 SER 102 HB1 SER 102 5.898 2.495 14.171 772 HG SER 102 HG SER 102 7.323 2.592 16.374 773 H TRP 103 HN TRP 103 2.709 1.016 14.762 774 HA TRP 103 HA TRP 103 2.752 0.296 11.941 775 HB2 TRP 103 HB2 TRP 103 0.626 -0.184 14.006 776 HB3 TRP 103 HB1 TRP 103 0.569 -0.662 12.337 777 HD1 TRP 103 HD1 TRP 103 3.258 -1.073 15.036 778 HE1 TRP 103 HE1 TRP 103 4.162 -3.419 14.932 779 HE3 TRP 103 HE3 TRP 103 0.220 -3.040 11.435 780 HZ2 TRP 103 HZ2 TRP 103 3.682 -5.849 13.581 781 HZ3 TRP 103 HZ3 TRP 103 0.527 -5.382 10.799 782 HH2 TRP 103 HH2 TRP 103 2.210 -6.759 11.869 783 H ALA 104 HN ALA 104 2.296 2.001 10.787 784 HA ALA 104 HA ALA 104 0.893 4.239 11.988 785 HB1 ALA 104 HB1 ALA 104 2.755 4.239 9.653 786 HB2 ALA 104 HB2 ALA 104 3.098 4.808 11.289 787 HB3 ALA 104 HB3 ALA 104 1.922 5.656 10.286 788 H GLN 105 HN GLN 105 -0.574 5.434 11.114 789 HA GLN 105 HA GLN 105 -2.444 4.114 9.469 790 HB2 GLN 105 HB2 GLN 105 -2.786 5.740 11.480 791 HB3 GLN 105 HB1 GLN 105 -2.633 6.981 10.252 792 HG2 GLN 105 HG2 GLN 105 -4.470 6.216 9.089 793 HG3 GLN 105 HG1 GLN 105 -4.490 4.696 9.966 794 HE21 GLN 105 HE21 GLN 105 -6.808 5.377 10.153 795 HE22 GLN 105 HE22 GLN 105 -7.245 6.364 11.500 796 H VAL 106 HN VAL 106 -1.924 4.053 7.253 797 HA VAL 106 HA VAL 106 -0.955 6.551 6.123 798 HB VAL 106 HB VAL 106 -0.810 3.687 5.241 799 HG11 VAL 106 HG11 VAL 106 0.345 4.685 3.175 800 HG12 VAL 106 HG12 VAL 106 -0.598 6.134 3.542 801 HG13 VAL 106 HG13 VAL 106 -1.417 4.617 3.217 802 HG21 VAL 106 HG21 VAL 106 1.608 4.493 4.933 803 HG22 VAL 106 HG22 VAL 106 0.999 4.297 6.581 804 HG23 VAL 106 HG23 VAL 106 1.103 5.913 5.856 805 H ASN 107 HN ASN 107 -2.078 7.629 4.641 806 HA ASN 107 HA ASN 107 -4.902 7.067 4.486 807 HB2 ASN 107 HB2 ASN 107 -3.358 9.382 4.651 808 HB3 ASN 107 HB1 ASN 107 -3.947 9.393 2.997 809 HD21 ASN 107 HD21 ASN 107 -6.397 8.431 3.082 810 HD22 ASN 107 HD22 ASN 107 -7.421 9.364 4.115 811 H PHE 108 HN PHE 108 -5.304 5.554 2.975 812 HA PHE 108 HA PHE 108 -4.172 5.790 0.370 813 HB2 PHE 108 HB2 PHE 108 -5.639 3.605 1.839 814 HB3 PHE 108 HB1 PHE 108 -5.501 3.573 0.106 815 HD1 PHE 108 HD2 PHE 108 -3.471 3.637 3.202 816 HD2 PHE 108 HD1 PHE 108 -3.671 2.557 -0.906 817 HE1 PHE 108 HE2 PHE 108 -1.373 2.374 3.436 818 HE2 PHE 108 HE1 PHE 108 -1.588 1.274 -0.675 819 HZ PHE 108 HZ PHE 108 -0.432 1.184 1.499 820 H THR 109 HN THR 109 -5.567 5.539 -1.363 821 HA THR 109 HA THR 109 -7.679 7.294 -1.477 822 HB THR 109 HB THR 109 -6.125 5.900 -3.256 823 HG1 THR 109 HG1 THR 109 -8.287 7.664 -3.750 824 HG21 THR 109 HG21 THR 109 -8.821 5.617 -4.343 825 HG22 THR 109 HG22 THR 109 -8.309 4.409 -3.170 826 HG23 THR 109 HG23 THR 109 -7.363 4.669 -4.637 827 H THR 110 HN THR 110 -7.929 3.836 -1.929 828 HA THR 110 HA THR 110 -10.794 3.902 -1.563 829 HB THR 110 HB THR 110 -9.473 1.308 -1.758 830 HG1 THR 110 HG1 THR 110 -9.155 1.748 -4.092 831 HG21 THR 110 HG21 THR 110 -11.435 0.742 -2.593 832 HG22 THR 110 HG22 THR 110 -11.216 1.878 -3.925 833 HG23 THR 110 HG23 THR 110 -11.969 2.413 -2.423 834 H GLY 111 HN GLY 111 -7.986 2.498 -0.095 835 HA2 GLY 111 HA2 GLY 111 -9.406 1.336 2.068 836 HA3 GLY 111 HA1 GLY 111 -7.667 1.519 1.955 837 H GLY 112 HN GLY 112 -8.843 4.543 1.373 838 HA2 GLY 112 HA2 GLY 112 -8.681 6.458 2.647 839 HA3 GLY 112 HA1 GLY 112 -9.779 5.590 3.708 840 H ASN 113 HN ASN 113 -8.989 4.631 5.555 841 HA ASN 113 HA ASN 113 -6.256 5.380 6.275 842 HB2 ASN 113 HB2 ASN 113 -7.119 4.345 8.526 843 HB3 ASN 113 HB1 ASN 113 -7.616 5.968 8.080 844 HD21 ASN 113 HD21 ASN 113 -8.663 2.790 6.997 845 HD22 ASN 113 HD22 ASN 113 -10.327 2.973 7.440 846 H VAL 114 HN VAL 114 -4.689 3.868 6.331 847 HA VAL 114 HA VAL 114 -5.361 1.045 6.543 848 HB VAL 114 HB VAL 114 -3.477 1.919 4.372 849 HG11 VAL 114 HG11 VAL 114 -4.949 -0.655 4.857 850 HG12 VAL 114 HG12 VAL 114 -3.262 -0.349 5.269 851 HG13 VAL 114 HG13 VAL 114 -3.771 -0.357 3.577 852 HG21 VAL 114 HG21 VAL 114 -5.229 2.624 3.171 853 HG22 VAL 114 HG22 VAL 114 -6.387 1.962 4.314 854 HG23 VAL 114 HG23 VAL 114 -5.696 0.929 3.067 855 H TRP 115 HN TRP 115 -4.063 0.300 8.072 856 HA TRP 115 HA TRP 115 -1.706 1.867 8.684 857 HB2 TRP 115 HB2 TRP 115 -3.078 -0.282 10.234 858 HB3 TRP 115 HB1 TRP 115 -1.625 0.534 10.765 859 HD1 TRP 115 HD1 TRP 115 -5.184 1.459 9.649 860 HE1 TRP 115 HE1 TRP 115 -5.903 3.409 11.096 861 HE3 TRP 115 HE3 TRP 115 -0.869 2.205 12.200 862 HZ2 TRP 115 HZ2 TRP 115 -4.805 5.100 12.983 863 HZ3 TRP 115 HZ3 TRP 115 -0.772 4.059 13.841 864 HH2 TRP 115 HH2 TRP 115 -2.721 5.486 14.230 865 H LEU 116 HN LEU 116 0.277 0.976 9.190 866 HA LEU 116 HA LEU 116 0.885 -1.688 8.247 867 HB2 LEU 116 HB2 LEU 116 1.058 0.453 6.482 868 HB3 LEU 116 HB1 LEU 116 2.703 0.262 7.085 869 HG LEU 116 HG LEU 116 2.058 -2.323 6.504 870 HD11 LEU 116 HD11 LEU 116 0.552 -2.579 4.855 871 HD12 LEU 116 HD12 LEU 116 0.984 -1.057 4.077 872 HD13 LEU 116 HD13 LEU 116 -0.092 -1.057 5.475 873 HD21 LEU 116 HD21 LEU 116 2.985 -0.970 4.125 874 HD22 LEU 116 HD22 LEU 116 3.823 -2.116 5.168 875 HD23 LEU 116 HD23 LEU 116 3.815 -0.399 5.570 876 H ASN 117 HN ASN 117 2.862 -2.411 9.121 877 HA ASN 117 HA ASN 117 3.657 -0.902 11.370 878 HB2 ASN 117 HB2 ASN 117 4.133 -2.909 11.875 879 HB3 ASN 117 HB1 ASN 117 4.535 -3.423 10.251 880 HD21 ASN 117 HD21 ASN 117 5.651 -2.460 13.285 881 HD22 ASN 117 HD22 ASN 117 7.346 -2.469 12.957 882 H THR 118 HN THR 118 4.208 0.724 11.124 883 HA THR 118 HA THR 118 5.617 1.914 8.980 884 HB THR 118 HB THR 118 3.715 2.779 10.349 885 HG1 THR 118 HG1 THR 118 5.959 4.504 10.085 886 HG21 THR 118 HG21 THR 118 5.314 2.394 12.483 887 HG22 THR 118 HG22 THR 118 3.918 3.467 12.453 888 HG23 THR 118 HG23 THR 118 5.540 4.116 12.194 889 H THR 119 HN THR 119 6.958 0.032 11.080 890 HA THR 119 HA THR 119 8.939 1.624 12.324 891 HB THR 119 HB THR 119 8.425 -0.790 12.847 892 HG1 THR 119 HG1 THR 119 11.153 -0.199 12.354 893 HG21 THR 119 HG21 THR 119 10.464 -1.738 10.973 894 HG22 THR 119 HG22 THR 119 8.914 -1.323 10.242 895 HG23 THR 119 HG23 THR 119 8.985 -2.512 11.543 896 H SER 120 HN SER 120 8.453 2.128 9.337 897 HA SER 120 HA SER 120 10.985 2.951 8.636 898 HB2 SER 120 HB2 SER 120 10.148 0.272 7.625 899 HB3 SER 120 HB1 SER 120 10.882 1.377 6.463 900 HG SER 120 HG SER 120 12.701 1.493 7.774 901 H LYS 121 HN LYS 121 10.526 4.674 7.390 902 HA LYS 121 HA LYS 121 7.854 5.136 6.513 903 HB2 LYS 121 HB2 LYS 121 9.288 6.888 7.393 904 HB3 LYS 121 HB1 LYS 121 10.391 6.694 6.039 905 HG2 LYS 121 HG2 LYS 121 9.232 8.316 5.035 906 HG3 LYS 121 HG1 LYS 121 7.957 7.117 4.811 907 HD2 LYS 121 HD2 LYS 121 6.925 7.799 6.908 908 HD3 LYS 121 HD1 LYS 121 8.224 8.963 7.185 909 HE2 LYS 121 HE2 LYS 121 6.577 9.072 4.687 910 HE3 LYS 121 HE1 LYS 121 5.982 9.786 6.185 911 HZ1 LYS 121 HZ1 LYS 121 8.152 10.647 4.449 912 HZ2 LYS 121 HZ2 LYS 121 8.414 10.824 6.110 913 HZ3 LYS 121 HZ3 LYS 121 7.081 11.567 5.380 914 H ASP 122 HN ASP 122 10.949 4.375 5.013 915 HA ASP 122 HA ASP 122 9.972 4.396 2.355 916 HB2 ASP 122 HB2 ASP 122 12.344 3.140 3.682 917 HB3 ASP 122 HB1 ASP 122 11.968 2.846 1.987 918 H ASN 123 HN ASN 123 9.122 2.582 4.997 919 HA ASN 123 HA ASN 123 8.972 -0.038 4.025 920 HB2 ASN 123 HB2 ASN 123 8.624 0.195 6.383 921 HB3 ASN 123 HB1 ASN 123 7.511 1.531 6.130 922 HD21 ASN 123 HD21 ASN 123 7.482 -1.349 4.262 923 HD22 ASN 123 HD22 ASN 123 5.929 -1.821 4.731 924 H LEU 124 HN LEU 124 6.437 2.347 4.233 925 HA LEU 124 HA LEU 124 4.645 0.889 2.644 926 HB2 LEU 124 HB2 LEU 124 4.394 3.786 2.471 927 HB3 LEU 124 HB1 LEU 124 3.199 2.585 2.914 928 HG LEU 124 HG LEU 124 3.551 4.019 4.756 929 HD11 LEU 124 HD11 LEU 124 3.191 1.872 5.601 930 HD12 LEU 124 HD12 LEU 124 4.693 2.338 6.398 931 HD13 LEU 124 HD13 LEU 124 4.735 1.264 4.997 932 HD21 LEU 124 HD21 LEU 124 6.311 3.845 3.863 933 HD22 LEU 124 HD22 LEU 124 6.149 3.683 5.617 934 HD23 LEU 124 HD23 LEU 124 5.502 5.109 4.803 935 H LEU 125 HN LEU 125 6.588 3.708 1.922 936 HA LEU 125 HA LEU 125 6.071 3.798 -0.805 937 HB2 LEU 125 HB2 LEU 125 8.439 4.673 0.826 938 HB3 LEU 125 HB1 LEU 125 8.242 5.054 -0.855 939 HG LEU 125 HG LEU 125 5.981 6.103 -0.114 940 HD11 LEU 125 HD11 LEU 125 5.544 5.895 2.052 941 HD12 LEU 125 HD12 LEU 125 6.913 6.959 2.385 942 HD13 LEU 125 HD13 LEU 125 7.143 5.206 2.346 943 HD21 LEU 125 HD21 LEU 125 7.371 7.723 -0.885 944 HD22 LEU 125 HD22 LEU 125 8.742 7.152 0.066 945 HD23 LEU 125 HD23 LEU 125 7.481 8.121 0.830 946 H TYR 126 HN TYR 126 8.694 2.176 0.960 947 HA TYR 126 HA TYR 126 9.430 0.898 -1.596 948 HB2 TYR 126 HB2 TYR 126 10.983 2.262 0.449 949 HB3 TYR 126 HB1 TYR 126 11.616 0.669 0.073 950 HD1 TYR 126 HD1 TYR 126 10.115 3.478 -1.841 951 HD2 TYR 126 HD2 TYR 126 13.328 0.718 -1.491 952 HE1 TYR 126 HE1 TYR 126 11.130 4.409 -3.883 953 HE2 TYR 126 HE2 TYR 126 14.355 1.640 -3.526 954 HH TYR 126 HH TYR 126 13.357 2.934 -5.659 955 H GLY 127 HN GLY 127 8.809 0.404 1.834 956 HA2 GLY 127 HA2 GLY 127 7.944 -1.739 2.576 957 HA3 GLY 127 HA1 GLY 127 8.789 -2.503 1.242 958 H LYS 128 HN LYS 128 10.326 -0.074 3.175 959 HA LYS 128 HA LYS 128 12.410 -1.853 3.888 960 HB2 LYS 128 HB2 LYS 128 11.794 0.972 4.725 961 HB3 LYS 128 HB1 LYS 128 13.290 0.131 5.045 962 HG2 LYS 128 HG2 LYS 128 13.438 -0.169 2.505 963 HG3 LYS 128 HG1 LYS 128 12.215 1.106 2.448 964 HD2 LYS 128 HD2 LYS 128 13.727 2.528 3.839 965 HD3 LYS 128 HD1 LYS 128 14.955 1.262 3.721 966 HE2 LYS 128 HE2 LYS 128 15.138 1.539 1.363 967 HE3 LYS 128 HE1 LYS 128 13.722 2.588 1.314 968 HZ1 LYS 128 HZ1 LYS 128 16.352 3.206 2.541 969 HZ2 LYS 128 HZ2 LYS 128 14.985 4.192 2.682 970 HZ3 LYS 128 HZ3 LYS 128 15.680 3.921 1.164 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 36.220 -7.650 7.676 2 H2 MET 1 HT2 MET 1 35.231 -6.926 6.475 3 H3 MET 1 HT3 MET 1 36.798 -6.301 6.791 4 HA MET 1 HA MET 1 37.756 -8.379 6.065 5 HB2 MET 1 HB2 MET 1 34.840 -8.979 5.708 6 HB3 MET 1 HB1 MET 1 36.019 -9.750 4.656 7 HG2 MET 1 HG2 MET 1 37.091 -10.806 6.495 8 HG3 MET 1 HG1 MET 1 36.155 -9.866 7.655 9 HE1 MET 1 HE1 MET 1 32.672 -10.797 6.377 10 HE2 MET 1 HE2 MET 1 33.689 -9.641 7.238 11 HE3 MET 1 HE3 MET 1 33.025 -11.037 8.089 12 H ARG 2 HN ARG 2 34.910 -7.428 4.150 13 HA ARG 2 HA ARG 2 36.427 -7.011 1.795 14 HB2 ARG 2 HB2 ARG 2 33.635 -6.084 2.487 15 HB3 ARG 2 HB1 ARG 2 34.338 -6.062 0.876 16 HG2 ARG 2 HG2 ARG 2 34.702 -8.628 1.391 17 HG3 ARG 2 HG1 ARG 2 33.350 -8.346 2.488 18 HD2 ARG 2 HD2 ARG 2 32.506 -7.086 0.218 19 HD3 ARG 2 HD1 ARG 2 33.416 -8.446 -0.439 20 HE ARG 2 HE ARG 2 31.831 -9.561 1.475 21 HH11 ARG 2 HH11 ARG 2 31.243 -7.574 -1.333 22 HH12 ARG 2 HH12 ARG 2 29.673 -8.240 -1.630 23 HH21 ARG 2 HH21 ARG 2 29.766 -10.438 1.087 24 HH22 ARG 2 HH22 ARG 2 28.834 -9.867 -0.258 25 H GLY 3 HN GLY 3 37.240 -5.192 0.872 26 HA2 GLY 3 HA2 GLY 3 37.261 -2.791 2.580 27 HA3 GLY 3 HA1 GLY 3 38.499 -3.207 1.404 28 H SER 4 HN SER 4 36.539 -3.934 -0.649 29 HA SER 4 HA SER 4 36.198 -1.334 -1.790 30 HB2 SER 4 HB2 SER 4 36.724 -3.439 -3.083 31 HB3 SER 4 HB1 SER 4 35.054 -3.940 -2.813 32 HG SER 4 HG SER 4 36.061 -2.149 -4.594 33 H HIS 5 HN HIS 5 34.468 -0.040 -1.745 34 HA HIS 5 HA HIS 5 31.799 -1.051 -1.435 35 HB2 HIS 5 HB2 HIS 5 33.121 -0.649 0.929 36 HB3 HIS 5 HB1 HIS 5 32.330 0.906 0.695 37 HD1 HIS 5 HD1 HIS 5 31.213 -0.330 3.014 38 HD2 HIS 5 HD2 HIS 5 29.938 -1.511 -0.761 39 HE1 HIS 5 HE1 HIS 5 28.973 -1.415 3.370 40 HE2 HIS 5 HE2 HIS 5 28.261 -2.199 1.084 41 H HIS 6 HN HIS 6 33.080 0.442 -3.429 42 HA HIS 6 HA HIS 6 31.458 2.879 -3.349 43 HB2 HIS 6 HB2 HIS 6 34.167 3.001 -2.931 44 HB3 HIS 6 HB1 HIS 6 34.057 3.250 -4.670 45 HD1 HIS 6 HD1 HIS 6 32.819 5.396 -5.481 46 HD2 HIS 6 HD2 HIS 6 33.256 5.104 -1.359 47 HE1 HIS 6 HE1 HIS 6 32.305 7.690 -4.587 48 HE2 HIS 6 HE2 HIS 6 32.473 7.461 -2.084 49 H HIS 7 HN HIS 7 30.246 3.032 -5.118 50 HA HIS 7 HA HIS 7 31.274 2.005 -7.658 51 HB2 HIS 7 HB2 HIS 7 28.605 1.258 -6.452 52 HB3 HIS 7 HB1 HIS 7 29.043 0.967 -8.131 53 HD1 HIS 7 HD1 HIS 7 31.865 -0.145 -7.806 54 HD2 HIS 7 HD2 HIS 7 28.666 -1.237 -5.387 55 HE1 HIS 7 HE1 HIS 7 32.471 -2.397 -6.864 56 HE2 HIS 7 HE2 HIS 7 30.500 -3.059 -5.441 57 H HIS 8 HN HIS 8 31.299 3.751 -8.906 58 HA HIS 8 HA HIS 8 29.277 5.819 -8.599 59 HB2 HIS 8 HB2 HIS 8 31.947 5.623 -9.883 60 HB3 HIS 8 HB1 HIS 8 30.800 6.742 -10.611 61 HD1 HIS 8 HD1 HIS 8 33.250 6.498 -7.964 62 HD2 HIS 8 HD2 HIS 8 29.794 8.703 -8.639 63 HE1 HIS 8 HE1 HIS 8 33.366 8.434 -6.363 64 HE2 HIS 8 HE2 HIS 8 31.224 9.709 -6.733 65 H HIS 9 HN HIS 9 27.396 5.428 -9.583 66 HA HIS 9 HA HIS 9 27.469 4.464 -12.368 67 HB2 HIS 9 HB2 HIS 9 25.531 3.802 -10.154 68 HB3 HIS 9 HB1 HIS 9 25.144 3.535 -11.850 69 HD1 HIS 9 HD1 HIS 9 28.234 2.710 -9.770 70 HD2 HIS 9 HD2 HIS 9 25.519 0.915 -12.352 71 HE1 HIS 9 HE1 HIS 9 29.008 0.329 -10.010 72 HE2 HIS 9 HE2 HIS 9 27.295 -0.761 -11.501 73 H HIS 10 HN HIS 10 25.707 5.204 -13.734 74 HA HIS 10 HA HIS 10 24.365 6.809 -14.653 75 HB2 HIS 10 HB2 HIS 10 23.701 6.899 -11.769 76 HB3 HIS 10 HB1 HIS 10 23.254 8.328 -12.699 77 HD1 HIS 10 HD1 HIS 10 21.876 7.639 -15.026 78 HD2 HIS 10 HD2 HIS 10 21.800 4.984 -11.832 79 HE1 HIS 10 HE1 HIS 10 19.905 6.136 -15.449 80 HE2 HIS 10 HE2 HIS 10 19.822 4.600 -13.455 81 H GLY 11 HN GLY 11 26.231 7.877 -15.529 82 HA2 GLY 11 HA2 GLY 11 26.588 10.549 -14.394 83 HA3 GLY 11 HA1 GLY 11 28.028 9.569 -14.597 84 H SER 12 HN SER 12 26.940 8.370 -17.122 85 HA SER 12 HA SER 12 27.603 10.652 -18.847 86 HB2 SER 12 HB2 SER 12 27.925 8.699 -20.555 87 HB3 SER 12 HB1 SER 12 29.149 8.988 -19.320 88 HG SER 12 HG SER 12 28.778 6.880 -19.102 89 H GLU 13 HN GLU 13 25.062 8.398 -18.127 90 HA GLU 13 HA GLU 13 23.344 9.784 -20.020 91 HB2 GLU 13 HB2 GLU 13 24.473 7.348 -20.737 92 HB3 GLU 13 HB1 GLU 13 22.858 6.922 -20.189 93 HG2 GLU 13 HG2 GLU 13 23.095 9.224 -22.034 94 HG3 GLU 13 HG1 GLU 13 23.397 7.617 -22.695 95 HA PRO 14 HA PRO 14 21.146 9.057 -16.073 96 HB2 PRO 14 HB2 PRO 14 19.549 11.239 -16.291 97 HB3 PRO 14 HB1 PRO 14 21.195 11.312 -15.654 98 HG2 PRO 14 HG2 PRO 14 20.193 11.979 -18.394 99 HG3 PRO 14 HG1 PRO 14 21.366 12.850 -17.388 100 HD2 PRO 14 HD2 PRO 14 22.112 11.219 -19.416 101 HD3 PRO 14 HD1 PRO 14 23.092 11.428 -17.951 102 H THR 15 HN THR 15 20.232 7.172 -17.184 103 HA THR 15 HA THR 15 17.875 7.551 -18.803 104 HB THR 15 HB THR 15 17.752 5.012 -18.605 105 HG1 THR 15 HG1 THR 15 20.358 5.230 -17.554 106 HG21 THR 15 HG21 THR 15 19.170 6.484 -20.322 107 HG22 THR 15 HG22 THR 15 19.140 4.721 -20.345 108 HG23 THR 15 HG23 THR 15 20.476 5.570 -19.566 109 H THR 16 HN THR 16 16.222 5.485 -17.865 110 HA THR 16 HA THR 16 14.797 6.856 -15.826 111 HB THR 16 HB THR 16 14.354 4.017 -16.756 112 HG1 THR 16 HG1 THR 16 14.232 5.100 -18.608 113 HG21 THR 16 HG21 THR 16 13.048 4.940 -14.769 114 HG22 THR 16 HG22 THR 16 12.134 4.233 -16.102 115 HG23 THR 16 HG23 THR 16 12.253 5.986 -15.947 116 HA PRO 17 HA PRO 17 16.909 4.952 -12.390 117 HB2 PRO 17 HB2 PRO 17 15.502 6.076 -10.400 118 HB3 PRO 17 HB1 PRO 17 16.630 7.018 -11.383 119 HG2 PRO 17 HG2 PRO 17 13.649 6.835 -11.572 120 HG3 PRO 17 HG1 PRO 17 14.692 8.263 -11.692 121 HD2 PRO 17 HD2 PRO 17 13.653 6.947 -13.860 122 HD3 PRO 17 HD1 PRO 17 15.158 7.886 -13.903 123 H THR 18 HN THR 18 16.602 3.235 -11.008 124 HA THR 18 HA THR 18 14.063 1.826 -11.302 125 HB THR 18 HB THR 18 16.398 0.631 -9.879 126 HG1 THR 18 HG1 THR 18 16.257 1.161 -12.651 127 HG21 THR 18 HG21 THR 18 15.689 -1.314 -11.395 128 HG22 THR 18 HG22 THR 18 14.218 -0.377 -11.657 129 HG23 THR 18 HG23 THR 18 14.660 -0.889 -10.028 130 H THR 19 HN THR 19 15.596 3.826 -9.100 131 HA THR 19 HA THR 19 14.718 2.637 -6.660 132 HB THR 19 HB THR 19 15.470 4.629 -5.600 133 HG1 THR 19 HG1 THR 19 15.884 6.529 -6.825 134 HG21 THR 19 HG21 THR 19 17.205 4.434 -8.044 135 HG22 THR 19 HG22 THR 19 17.276 3.310 -6.688 136 HG23 THR 19 HG23 THR 19 17.659 5.014 -6.442 137 H ASN 20 HN ASN 20 12.544 2.246 -6.574 138 HA ASN 20 HA ASN 20 10.786 4.334 -5.968 139 HB2 ASN 20 HB2 ASN 20 9.294 4.193 -7.964 140 HB3 ASN 20 HB1 ASN 20 10.862 4.920 -8.297 141 HD21 ASN 20 HD21 ASN 20 12.374 3.787 -9.513 142 HD22 ASN 20 HD22 ASN 20 11.930 2.438 -10.495 143 H LEU 21 HN LEU 21 8.939 3.609 -5.074 144 HA LEU 21 HA LEU 21 7.880 1.999 -3.765 145 HB2 LEU 21 HB2 LEU 21 7.116 1.980 -6.627 146 HB3 LEU 21 HB1 LEU 21 6.366 0.785 -5.592 147 HG LEU 21 HG LEU 21 4.922 2.704 -5.845 148 HD11 LEU 21 HD11 LEU 21 5.159 1.495 -3.622 149 HD12 LEU 21 HD12 LEU 21 4.376 3.077 -3.617 150 HD13 LEU 21 HD13 LEU 21 6.050 2.920 -3.090 151 HD21 LEU 21 HD21 LEU 21 7.253 4.295 -4.807 152 HD22 LEU 21 HD22 LEU 21 5.599 4.903 -4.878 153 HD23 LEU 21 HD23 LEU 21 6.444 4.458 -6.365 154 H LYS 22 HN LYS 22 9.871 0.704 -3.232 155 HA LYS 22 HA LYS 22 10.578 -1.609 -4.649 156 HB2 LYS 22 HB2 LYS 22 11.152 -0.437 -2.061 157 HB3 LYS 22 HB1 LYS 22 11.034 -2.183 -1.978 158 HG2 LYS 22 HG2 LYS 22 12.766 -0.726 -3.951 159 HG3 LYS 22 HG1 LYS 22 13.330 -1.315 -2.386 160 HD2 LYS 22 HD2 LYS 22 13.030 -3.557 -2.996 161 HD3 LYS 22 HD1 LYS 22 11.992 -3.137 -4.360 162 HE2 LYS 22 HE2 LYS 22 14.943 -2.553 -4.140 163 HE3 LYS 22 HE1 LYS 22 14.220 -3.846 -5.096 164 HZ1 LYS 22 HZ1 LYS 22 14.360 -0.995 -5.638 165 HZ2 LYS 22 HZ2 LYS 22 12.896 -1.744 -6.038 166 HZ3 LYS 22 HZ3 LYS 22 14.344 -2.304 -6.711 167 H ILE 23 HN ILE 23 10.266 -3.875 -3.716 168 HA ILE 23 HA ILE 23 7.518 -4.457 -3.779 169 HB ILE 23 HB ILE 23 9.980 -5.838 -4.080 170 HG12 ILE 23 HG12 ILE 23 7.547 -7.311 -4.684 171 HG13 ILE 23 HG11 ILE 23 7.489 -5.635 -5.225 172 HG21 ILE 23 HG21 ILE 23 9.648 -6.804 -1.882 173 HG22 ILE 23 HG22 ILE 23 9.389 -8.022 -3.132 174 HG23 ILE 23 HG23 ILE 23 8.011 -7.285 -2.322 175 HD11 ILE 23 HD11 ILE 23 8.914 -5.997 -6.884 176 HD12 ILE 23 HD12 ILE 23 8.644 -7.716 -6.586 177 HD13 ILE 23 HD13 ILE 23 10.018 -6.894 -5.845 178 H TYR 24 HN TYR 24 6.284 -5.666 -2.395 179 HA TYR 24 HA TYR 24 6.743 -5.323 0.491 180 HB2 TYR 24 HB2 TYR 24 4.421 -5.166 -1.296 181 HB3 TYR 24 HB1 TYR 24 4.154 -5.956 0.223 182 HD1 TYR 24 HD2 TYR 24 5.541 -2.774 -1.144 183 HD2 TYR 24 HD1 TYR 24 3.451 -4.718 1.988 184 HE1 TYR 24 HE2 TYR 24 5.104 -0.598 -0.089 185 HE2 TYR 24 HE1 TYR 24 2.994 -2.561 3.047 186 HH TYR 24 HH TYR 24 2.943 -0.306 2.646 187 H LYS 25 HN LYS 25 5.540 -7.239 1.684 188 HA LYS 25 HA LYS 25 5.947 -9.680 0.083 189 HB2 LYS 25 HB2 LYS 25 6.649 -9.061 2.893 190 HB3 LYS 25 HB1 LYS 25 6.144 -10.698 2.490 191 HG2 LYS 25 HG2 LYS 25 8.554 -10.534 2.426 192 HG3 LYS 25 HG1 LYS 25 7.924 -10.818 0.802 193 HD2 LYS 25 HD2 LYS 25 8.165 -8.462 0.271 194 HD3 LYS 25 HD1 LYS 25 8.713 -8.125 1.914 195 HE2 LYS 25 HE2 LYS 25 10.662 -9.565 1.547 196 HE3 LYS 25 HE1 LYS 25 10.111 -9.887 -0.096 197 HZ1 LYS 25 HZ1 LYS 25 11.285 -8.120 -0.698 198 HZ2 LYS 25 HZ2 LYS 25 11.576 -7.664 0.904 199 HZ3 LYS 25 HZ3 LYS 25 10.167 -7.149 0.122 200 H VAL 26 HN VAL 26 3.978 -10.466 -0.472 201 HA VAL 26 HA VAL 26 1.743 -9.991 1.238 202 HB VAL 26 HB VAL 26 1.203 -11.927 -0.845 203 HG11 VAL 26 HG11 VAL 26 -0.664 -10.588 -1.094 204 HG12 VAL 26 HG12 VAL 26 0.195 -9.155 -0.531 205 HG13 VAL 26 HG13 VAL 26 -0.238 -10.426 0.613 206 HG21 VAL 26 HG21 VAL 26 1.394 -9.584 -2.329 207 HG22 VAL 26 HG22 VAL 26 2.365 -11.041 -2.520 208 HG23 VAL 26 HG23 VAL 26 2.934 -9.727 -1.494 209 H ASP 27 HN ASP 27 2.527 -10.947 2.994 210 HA ASP 27 HA ASP 27 3.035 -13.767 3.113 211 HB2 ASP 27 HB2 ASP 27 3.280 -11.525 5.000 212 HB3 ASP 27 HB1 ASP 27 3.009 -13.087 5.734 213 H ASP 28 HN ASP 28 0.324 -11.712 3.649 214 HA ASP 28 HA ASP 28 -1.446 -13.915 3.769 215 HB2 ASP 28 HB2 ASP 28 -0.267 -13.825 6.102 216 HB3 ASP 28 HB1 ASP 28 -1.366 -12.484 6.398 217 H LEU 29 HN LEU 29 -3.156 -13.117 2.732 218 HA LEU 29 HA LEU 29 -4.194 -10.548 3.584 219 HB2 LEU 29 HB2 LEU 29 -3.676 -9.630 1.669 220 HB3 LEU 29 HB1 LEU 29 -3.237 -11.164 0.999 221 HG LEU 29 HG LEU 29 -6.112 -10.729 1.264 222 HD11 LEU 29 HD11 LEU 29 -5.972 -9.416 -0.960 223 HD12 LEU 29 HD12 LEU 29 -4.390 -8.936 -0.346 224 HD13 LEU 29 HD13 LEU 29 -5.845 -8.588 0.596 225 HD21 LEU 29 HD21 LEU 29 -6.204 -12.012 -0.634 226 HD22 LEU 29 HD22 LEU 29 -4.787 -12.618 0.224 227 HD23 LEU 29 HD23 LEU 29 -4.584 -11.536 -1.154 228 H GLN 30 HN GLN 30 -6.282 -10.414 3.854 229 HA GLN 30 HA GLN 30 -7.987 -12.698 3.197 230 HB2 GLN 30 HB2 GLN 30 -7.318 -11.493 5.790 231 HB3 GLN 30 HB1 GLN 30 -9.037 -11.651 5.509 232 HG2 GLN 30 HG2 GLN 30 -8.059 -13.559 6.708 233 HG3 GLN 30 HG1 GLN 30 -8.827 -14.016 5.187 234 HE21 GLN 30 HE21 GLN 30 -7.377 -14.034 3.303 235 HE22 GLN 30 HE22 GLN 30 -5.766 -14.608 3.520 236 H LYS 31 HN LYS 31 -10.302 -12.282 3.218 237 HA LYS 31 HA LYS 31 -10.888 -9.747 2.022 238 HB2 LYS 31 HB2 LYS 31 -12.102 -12.138 1.791 239 HB3 LYS 31 HB1 LYS 31 -13.069 -11.484 3.101 240 HG2 LYS 31 HG2 LYS 31 -13.571 -11.171 0.439 241 HG3 LYS 31 HG1 LYS 31 -14.222 -10.168 1.732 242 HD2 LYS 31 HD2 LYS 31 -12.672 -8.459 1.339 243 HD3 LYS 31 HD1 LYS 31 -11.610 -9.520 0.411 244 HE2 LYS 31 HE2 LYS 31 -12.912 -9.406 -1.477 245 HE3 LYS 31 HE1 LYS 31 -14.379 -9.040 -0.571 246 HZ1 LYS 31 HZ1 LYS 31 -13.671 -7.104 -1.767 247 HZ2 LYS 31 HZ2 LYS 31 -12.120 -7.188 -1.098 248 HZ3 LYS 31 HZ3 LYS 31 -13.445 -6.826 -0.113 249 H ILE 32 HN ILE 32 -10.564 -8.119 3.399 250 HA ILE 32 HA ILE 32 -11.573 -8.377 6.149 251 HB ILE 32 HB ILE 32 -9.121 -6.982 5.114 252 HG12 ILE 32 HG12 ILE 32 -9.705 -9.751 5.578 253 HG13 ILE 32 HG11 ILE 32 -8.278 -9.014 4.875 254 HG21 ILE 32 HG21 ILE 32 -9.616 -5.959 7.156 255 HG22 ILE 32 HG22 ILE 32 -8.345 -7.156 7.474 256 HG23 ILE 32 HG23 ILE 32 -10.031 -7.504 7.908 257 HD11 ILE 32 HD11 ILE 32 -8.317 -8.689 7.708 258 HD12 ILE 32 HD12 ILE 32 -7.112 -9.432 6.663 259 HD13 ILE 32 HD13 ILE 32 -8.469 -10.379 7.242 260 H ASN 33 HN ASN 33 -13.064 -6.977 6.750 261 HA ASN 33 HA ASN 33 -14.376 -5.136 6.918 262 HB2 ASN 33 HB2 ASN 33 -11.721 -4.002 6.144 263 HB3 ASN 33 HB1 ASN 33 -13.127 -2.947 6.120 264 HD21 ASN 33 HD21 ASN 33 -12.316 -5.607 8.293 265 HD22 ASN 33 HD22 ASN 33 -12.306 -4.658 9.735 266 H GLY 34 HN GLY 34 -14.527 -6.747 4.565 267 HA2 GLY 34 HA2 GLY 34 -15.772 -6.701 2.640 268 HA3 GLY 34 HA1 GLY 34 -15.999 -4.983 2.897 269 H ILE 35 HN ILE 35 -12.754 -5.600 3.085 270 HA ILE 35 HA ILE 35 -12.288 -5.275 0.217 271 HB ILE 35 HB ILE 35 -10.330 -3.771 1.571 272 HG12 ILE 35 HG12 ILE 35 -12.815 -2.356 2.252 273 HG13 ILE 35 HG11 ILE 35 -12.503 -3.775 3.235 274 HG21 ILE 35 HG21 ILE 35 -12.465 -3.312 -0.407 275 HG22 ILE 35 HG22 ILE 35 -10.740 -2.958 -0.493 276 HG23 ILE 35 HG23 ILE 35 -11.819 -1.879 0.391 277 HD11 ILE 35 HD11 ILE 35 -10.335 -2.907 3.850 278 HD12 ILE 35 HD12 ILE 35 -11.618 -1.769 4.261 279 HD13 ILE 35 HD13 ILE 35 -10.607 -1.484 2.843 280 H TRP 36 HN TRP 36 -10.448 -6.328 -0.510 281 HA TRP 36 HA TRP 36 -9.370 -8.385 1.072 282 HB2 TRP 36 HB2 TRP 36 -8.408 -7.085 -1.488 283 HB3 TRP 36 HB1 TRP 36 -7.592 -8.466 -0.757 284 HD1 TRP 36 HD1 TRP 36 -10.203 -7.705 -3.210 285 HE1 TRP 36 HE1 TRP 36 -11.649 -9.775 -3.710 286 HE3 TRP 36 HE3 TRP 36 -8.716 -10.693 0.665 287 HZ2 TRP 36 HZ2 TRP 36 -12.104 -12.333 -2.605 288 HZ3 TRP 36 HZ3 TRP 36 -9.711 -12.934 0.874 289 HH2 TRP 36 HH2 TRP 36 -11.369 -13.736 -0.727 290 H GLN 37 HN GLN 37 -7.718 -8.373 2.558 291 HA GLN 37 HA GLN 37 -6.180 -5.872 2.756 292 HB2 GLN 37 HB2 GLN 37 -7.595 -6.052 4.631 293 HB3 GLN 37 HB1 GLN 37 -7.166 -7.731 4.890 294 HG2 GLN 37 HG2 GLN 37 -4.771 -6.393 5.068 295 HG3 GLN 37 HG1 GLN 37 -5.932 -5.322 5.820 296 HE21 GLN 37 HE21 GLN 37 -5.406 -8.846 5.814 297 HE22 GLN 37 HE22 GLN 37 -5.375 -9.002 7.552 298 H VAL 38 HN VAL 38 -4.030 -5.921 3.177 299 HA VAL 38 HA VAL 38 -2.787 -8.557 2.724 300 HB VAL 38 HB VAL 38 -1.636 -5.811 2.118 301 HG11 VAL 38 HG11 VAL 38 -0.219 -7.364 0.566 302 HG12 VAL 38 HG12 VAL 38 -0.749 -8.659 1.639 303 HG13 VAL 38 HG13 VAL 38 0.169 -7.298 2.286 304 HG21 VAL 38 HG21 VAL 38 -2.137 -7.063 -0.288 305 HG22 VAL 38 HG22 VAL 38 -3.135 -5.807 0.448 306 HG23 VAL 38 HG23 VAL 38 -3.549 -7.507 0.675 307 H ARG 39 HN ARG 39 -0.877 -9.158 3.669 308 HA ARG 39 HA ARG 39 0.185 -7.553 5.856 309 HB2 ARG 39 HB2 ARG 39 -0.765 -10.405 6.234 310 HB3 ARG 39 HB1 ARG 39 0.137 -9.465 7.398 311 HG2 ARG 39 HG2 ARG 39 -1.617 -8.220 7.988 312 HG3 ARG 39 HG1 ARG 39 -2.352 -8.269 6.394 313 HD2 ARG 39 HD2 ARG 39 -3.669 -9.503 8.070 314 HD3 ARG 39 HD1 ARG 39 -3.097 -10.544 6.767 315 HE ARG 39 HE ARG 39 -1.232 -10.658 8.833 316 HH11 ARG 39 HH11 ARG 39 -4.553 -11.560 8.247 317 HH12 ARG 39 HH12 ARG 39 -4.520 -12.884 9.361 318 HH21 ARG 39 HH21 ARG 39 -1.188 -12.397 10.298 319 HH22 ARG 39 HH22 ARG 39 -2.608 -13.361 10.526 320 H ASN 40 HN ASN 40 2.398 -7.913 6.224 321 HA ASN 40 HA ASN 40 3.610 -10.139 4.815 322 HB2 ASN 40 HB2 ASN 40 5.510 -7.980 5.019 323 HB3 ASN 40 HB1 ASN 40 5.121 -9.014 3.683 324 HD21 ASN 40 HD21 ASN 40 5.727 -6.159 3.910 325 HD22 ASN 40 HD22 ASN 40 4.495 -5.431 2.952 326 H ASN 41 HN ASN 41 5.454 -10.844 5.714 327 HA ASN 41 HA ASN 41 5.435 -10.996 8.479 328 HB2 ASN 41 HB2 ASN 41 7.817 -12.019 8.069 329 HB3 ASN 41 HB1 ASN 41 6.398 -12.844 7.441 330 HD21 ASN 41 HD21 ASN 41 7.143 -9.977 5.822 331 HD22 ASN 41 HD22 ASN 41 7.837 -10.644 4.420 332 H ILE 42 HN ILE 42 6.847 -8.547 6.495 333 HA ILE 42 HA ILE 42 8.926 -7.828 8.268 334 HB ILE 42 HB ILE 42 7.776 -6.271 5.993 335 HG12 ILE 42 HG12 ILE 42 10.067 -7.371 5.059 336 HG13 ILE 42 HG11 ILE 42 9.464 -8.672 6.077 337 HG21 ILE 42 HG21 ILE 42 10.595 -6.167 6.852 338 HG22 ILE 42 HG22 ILE 42 9.378 -5.334 7.813 339 HG23 ILE 42 HG23 ILE 42 9.584 -4.929 6.112 340 HD11 ILE 42 HD11 ILE 42 8.103 -7.364 3.761 341 HD12 ILE 42 HD12 ILE 42 7.257 -8.372 4.936 342 HD13 ILE 42 HD13 ILE 42 8.560 -9.055 3.956 343 H LEU 43 HN LEU 43 5.911 -6.445 7.122 344 HA LEU 43 HA LEU 43 5.886 -4.588 9.346 345 HB2 LEU 43 HB2 LEU 43 4.066 -4.635 6.966 346 HB3 LEU 43 HB1 LEU 43 4.223 -3.353 8.148 347 HG LEU 43 HG LEU 43 5.484 -2.421 6.563 348 HD11 LEU 43 HD11 LEU 43 7.023 -3.190 8.471 349 HD12 LEU 43 HD12 LEU 43 7.749 -2.574 6.988 350 HD13 LEU 43 HD13 LEU 43 7.672 -4.311 7.278 351 HD21 LEU 43 HD21 LEU 43 5.314 -3.573 4.661 352 HD22 LEU 43 HD22 LEU 43 5.536 -5.127 5.472 353 HD23 LEU 43 HD23 LEU 43 6.938 -4.135 5.067 354 H VAL 44 HN VAL 44 4.639 -7.581 8.415 355 HA VAL 44 HA VAL 44 2.692 -7.394 10.554 356 HB VAL 44 HB VAL 44 1.703 -8.571 8.063 357 HG11 VAL 44 HG11 VAL 44 0.001 -7.107 9.967 358 HG12 VAL 44 HG12 VAL 44 0.745 -8.588 10.560 359 HG13 VAL 44 HG13 VAL 44 -0.289 -8.635 9.137 360 HG21 VAL 44 HG21 VAL 44 2.458 -6.270 7.545 361 HG22 VAL 44 HG22 VAL 44 1.380 -5.681 8.807 362 HG23 VAL 44 HG23 VAL 44 0.717 -6.489 7.385 363 HA PRO 45 HA PRO 45 5.208 -11.286 10.526 364 HB2 PRO 45 HB2 PRO 45 4.612 -10.541 13.344 365 HB3 PRO 45 HB1 PRO 45 6.085 -11.277 12.705 366 HG2 PRO 45 HG2 PRO 45 6.077 -8.751 13.317 367 HG3 PRO 45 HG1 PRO 45 6.752 -9.225 11.741 368 HD2 PRO 45 HD2 PRO 45 4.071 -8.059 12.387 369 HD3 PRO 45 HD1 PRO 45 5.165 -7.688 11.069 370 H THR 46 HN THR 46 2.398 -10.034 12.062 371 HA THR 46 HA THR 46 0.561 -11.900 11.292 372 HB THR 46 HB THR 46 1.948 -13.509 12.597 373 HG1 THR 46 HG1 THR 46 0.169 -14.387 13.740 374 HG21 THR 46 HG21 THR 46 1.049 -11.905 14.973 375 HG22 THR 46 HG22 THR 46 2.707 -12.106 14.407 376 HG23 THR 46 HG23 THR 46 1.814 -13.492 15.035 377 H ASP 47 HN ASP 47 -1.521 -11.568 12.188 378 HA ASP 47 HA ASP 47 -3.182 -10.509 13.374 379 HB2 ASP 47 HB2 ASP 47 -1.254 -9.101 15.059 380 HB3 ASP 47 HB1 ASP 47 -2.823 -9.747 15.496 381 H PHE 48 HN PHE 48 -2.750 -9.164 11.110 382 HA PHE 48 HA PHE 48 -2.162 -6.423 11.610 383 HB2 PHE 48 HB2 PHE 48 -2.117 -8.024 9.383 384 HB3 PHE 48 HB1 PHE 48 -3.602 -7.126 9.147 385 HD1 PHE 48 HD2 PHE 48 -1.328 -5.042 10.929 386 HD2 PHE 48 HD1 PHE 48 -2.166 -6.619 7.067 387 HE1 PHE 48 HE2 PHE 48 -0.035 -3.230 9.872 388 HE2 PHE 48 HE1 PHE 48 -0.853 -4.837 6.042 389 HZ PHE 48 HZ PHE 48 0.204 -3.134 7.436 390 H THR 49 HN THR 49 -3.697 -5.324 12.686 391 HA THR 49 HA THR 49 -6.235 -6.106 13.274 392 HB THR 49 HB THR 49 -5.990 -3.229 12.695 393 HG1 THR 49 HG1 THR 49 -4.629 -3.061 14.638 394 HG21 THR 49 HG21 THR 49 -6.764 -4.758 15.146 395 HG22 THR 49 HG22 THR 49 -7.843 -4.015 13.956 396 HG23 THR 49 HG23 THR 49 -6.807 -3.003 14.964 397 H TRP 50 HN TRP 50 -7.232 -7.068 11.618 398 HA TRP 50 HA TRP 50 -7.629 -6.368 9.009 399 HB2 TRP 50 HB2 TRP 50 -9.495 -7.553 11.039 400 HB3 TRP 50 HB1 TRP 50 -9.958 -7.392 9.406 401 HD1 TRP 50 HD1 TRP 50 -6.376 -8.421 9.838 402 HE1 TRP 50 HE1 TRP 50 -6.114 -10.936 9.368 403 HE3 TRP 50 HE3 TRP 50 -11.311 -9.725 9.662 404 HZ2 TRP 50 HZ2 TRP 50 -7.784 -13.181 8.974 405 HZ3 TRP 50 HZ3 TRP 50 -11.897 -12.075 9.232 406 HH2 TRP 50 HH2 TRP 50 -10.168 -13.766 8.894 407 H VAL 51 HN VAL 51 -8.969 -4.925 11.850 408 HA VAL 51 HA VAL 51 -11.191 -3.604 10.938 409 HB VAL 51 HB VAL 51 -10.421 -3.689 13.317 410 HG11 VAL 51 HG11 VAL 51 -8.809 -2.288 14.190 411 HG12 VAL 51 HG12 VAL 51 -8.837 -1.222 12.786 412 HG13 VAL 51 HG13 VAL 51 -8.090 -2.815 12.669 413 HG21 VAL 51 HG21 VAL 51 -11.911 -2.089 13.770 414 HG22 VAL 51 HG22 VAL 51 -11.983 -1.817 12.029 415 HG23 VAL 51 HG23 VAL 51 -10.900 -0.846 13.030 416 H ASP 52 HN ASP 52 -7.987 -2.341 11.243 417 HA ASP 52 HA ASP 52 -8.361 -0.714 8.885 418 HB2 ASP 52 HB2 ASP 52 -9.246 0.565 10.782 419 HB3 ASP 52 HB1 ASP 52 -7.674 0.462 11.547 420 H ASN 53 HN ASN 53 -6.327 -2.390 10.960 421 HA ASN 53 HA ASN 53 -3.955 -1.053 10.018 422 HB2 ASN 53 HB2 ASN 53 -4.202 -3.438 11.827 423 HB3 ASN 53 HB1 ASN 53 -2.708 -2.615 11.439 424 HD21 ASN 53 HD21 ASN 53 -5.118 -0.294 11.657 425 HD22 ASN 53 HD22 ASN 53 -4.927 0.141 13.309 426 H GLY 54 HN GLY 54 -5.906 -3.415 8.967 427 HA2 GLY 54 HA2 GLY 54 -3.922 -4.904 7.600 428 HA3 GLY 54 HA1 GLY 54 -5.673 -5.037 7.471 429 H ILE 55 HN ILE 55 -3.446 -4.619 5.498 430 HA ILE 55 HA ILE 55 -4.047 -2.055 4.370 431 HB ILE 55 HB ILE 55 -1.941 -2.443 3.675 432 HG12 ILE 55 HG12 ILE 55 -1.971 -3.959 1.506 433 HG13 ILE 55 HG11 ILE 55 -3.685 -3.613 1.657 434 HG21 ILE 55 HG21 ILE 55 -0.918 -4.565 3.289 435 HG22 ILE 55 HG22 ILE 55 -2.453 -5.319 3.706 436 HG23 ILE 55 HG23 ILE 55 -1.588 -4.378 4.904 437 HD11 ILE 55 HD11 ILE 55 -2.910 -1.925 0.333 438 HD12 ILE 55 HD12 ILE 55 -1.448 -1.718 1.304 439 HD13 ILE 55 HD13 ILE 55 -3.011 -1.208 1.936 440 H ALA 56 HN ALA 56 -5.857 -1.676 3.151 441 HA ALA 56 HA ALA 56 -7.278 -3.860 2.041 442 HB1 ALA 56 HB1 ALA 56 -8.832 -2.237 2.354 443 HB2 ALA 56 HB2 ALA 56 -8.344 -1.747 0.733 444 HB3 ALA 56 HB3 ALA 56 -7.658 -0.940 2.143 445 H ALA 57 HN ALA 57 -5.845 -4.947 0.886 446 HA ALA 57 HA ALA 57 -3.964 -4.283 -0.762 447 HB1 ALA 57 HB1 ALA 57 -5.859 -6.292 -1.844 448 HB2 ALA 57 HB2 ALA 57 -5.028 -6.585 -0.315 449 HB3 ALA 57 HB3 ALA 57 -4.095 -6.325 -1.792 450 H ASP 58 HN ASP 58 -7.316 -3.844 -1.610 451 HA ASP 58 HA ASP 58 -7.114 -3.413 -4.325 452 HB2 ASP 58 HB2 ASP 58 -9.215 -3.495 -2.935 453 HB3 ASP 58 HB1 ASP 58 -8.875 -1.825 -2.545 454 H ASP 59 HN ASP 59 -6.328 -1.304 -1.674 455 HA ASP 59 HA ASP 59 -5.998 1.063 -3.157 456 HB2 ASP 59 HB2 ASP 59 -4.851 0.169 -0.509 457 HB3 ASP 59 HB1 ASP 59 -4.823 1.804 -1.132 458 H VAL 60 HN VAL 60 -3.906 -1.699 -2.517 459 HA VAL 60 HA VAL 60 -1.646 -0.214 -3.528 460 HB VAL 60 HB VAL 60 -0.297 -2.034 -2.815 461 HG11 VAL 60 HG11 VAL 60 -2.236 -0.969 -0.828 462 HG12 VAL 60 HG12 VAL 60 -0.668 -0.311 -1.267 463 HG13 VAL 60 HG13 VAL 60 -0.765 -1.836 -0.388 464 HG21 VAL 60 HG21 VAL 60 -2.580 -3.502 -3.057 465 HG22 VAL 60 HG22 VAL 60 -2.299 -3.452 -1.322 466 HG23 VAL 60 HG23 VAL 60 -1.046 -4.069 -2.407 467 H ILE 61 HN ILE 61 -0.096 -1.969 -4.672 468 HA ILE 61 HA ILE 61 -1.604 -3.215 -6.789 469 HB ILE 61 HB ILE 61 0.425 -2.011 -8.128 470 HG12 ILE 61 HG12 ILE 61 -0.769 0.198 -6.675 471 HG13 ILE 61 HG11 ILE 61 0.352 -0.715 -5.731 472 HG21 ILE 61 HG21 ILE 61 -2.153 -0.665 -7.582 473 HG22 ILE 61 HG22 ILE 61 -2.159 -2.257 -8.373 474 HG23 ILE 61 HG23 ILE 61 -1.348 -0.879 -9.143 475 HD11 ILE 61 HD11 ILE 61 0.824 1.166 -7.845 476 HD12 ILE 61 HD12 ILE 61 1.715 -0.347 -8.044 477 HD13 ILE 61 HD13 ILE 61 1.894 0.600 -6.567 478 H GLU 62 HN GLU 62 -0.989 -5.231 -6.540 479 HA GLU 62 HA GLU 62 1.517 -6.040 -5.553 480 HB2 GLU 62 HB2 GLU 62 0.509 -7.991 -5.337 481 HB3 GLU 62 HB1 GLU 62 -0.929 -7.236 -5.991 482 HG2 GLU 62 HG2 GLU 62 -0.504 -8.090 -8.151 483 HG3 GLU 62 HG1 GLU 62 1.133 -8.579 -7.717 484 H VAL 63 HN VAL 63 3.387 -6.314 -6.398 485 HA VAL 63 HA VAL 63 3.573 -6.402 -9.331 486 HB VAL 63 HB VAL 63 5.884 -5.502 -9.007 487 HG11 VAL 63 HG11 VAL 63 4.661 -3.771 -9.734 488 HG12 VAL 63 HG12 VAL 63 4.883 -3.181 -8.089 489 HG13 VAL 63 HG13 VAL 63 3.396 -4.023 -8.531 490 HG21 VAL 63 HG21 VAL 63 5.141 -4.530 -6.313 491 HG22 VAL 63 HG22 VAL 63 6.729 -4.865 -6.996 492 HG23 VAL 63 HG23 VAL 63 5.699 -6.193 -6.463 493 H THR 64 HN THR 64 5.481 -7.593 -10.175 494 HA THR 64 HA THR 64 5.775 -10.095 -8.736 495 HB THR 64 HB THR 64 6.568 -11.043 -10.698 496 HG1 THR 64 HG1 THR 64 7.814 -8.638 -11.057 497 HG21 THR 64 HG21 THR 64 4.526 -10.664 -11.547 498 HG22 THR 64 HG22 THR 64 5.435 -9.646 -12.662 499 HG23 THR 64 HG23 THR 64 4.608 -8.925 -11.283 500 H SER 65 HN SER 65 7.982 -11.061 -8.533 501 HA SER 65 HA SER 65 9.555 -9.860 -6.746 502 HB2 SER 65 HB2 SER 65 9.746 -12.169 -8.231 503 HB3 SER 65 HB1 SER 65 11.221 -11.308 -8.669 504 HG SER 65 HG SER 65 11.536 -11.045 -6.342 505 H ASN 66 HN ASN 66 9.793 -9.260 -10.221 506 HA ASN 66 HA ASN 66 12.152 -7.696 -9.968 507 HB2 ASN 66 HB2 ASN 66 11.081 -9.005 -12.030 508 HB3 ASN 66 HB1 ASN 66 10.463 -7.389 -12.314 509 HD21 ASN 66 HD21 ASN 66 11.823 -5.784 -12.993 510 HD22 ASN 66 HD22 ASN 66 13.477 -6.055 -13.409 511 H GLY 67 HN GLY 67 9.024 -7.154 -9.204 512 HA2 GLY 67 HA2 GLY 67 8.123 -5.190 -8.303 513 HA3 GLY 67 HA1 GLY 67 9.381 -4.268 -9.108 514 H THR 68 HN THR 68 7.665 -6.678 -10.863 515 HA THR 68 HA THR 68 6.751 -4.744 -12.724 516 HB THR 68 HB THR 68 6.993 -7.638 -12.590 517 HG1 THR 68 HG1 THR 68 6.899 -5.837 -14.774 518 HG21 THR 68 HG21 THR 68 4.637 -7.715 -12.816 519 HG22 THR 68 HG22 THR 68 5.347 -8.039 -14.397 520 HG23 THR 68 HG23 THR 68 4.660 -6.453 -14.041 521 H ARG 69 HN ARG 69 4.990 -3.568 -12.509 522 HA ARG 69 HA ARG 69 3.002 -4.089 -10.562 523 HB2 ARG 69 HB2 ARG 69 3.684 -1.965 -12.355 524 HB3 ARG 69 HB1 ARG 69 1.958 -2.287 -12.470 525 HG2 ARG 69 HG2 ARG 69 2.137 -2.283 -9.843 526 HG3 ARG 69 HG1 ARG 69 3.557 -1.289 -10.184 527 HD2 ARG 69 HD2 ARG 69 1.814 0.258 -9.957 528 HD3 ARG 69 HD1 ARG 69 2.011 0.074 -11.698 529 HE ARG 69 HE ARG 69 -0.004 -1.569 -10.373 530 HH11 ARG 69 HH11 ARG 69 0.721 1.193 -12.389 531 HH12 ARG 69 HH12 ARG 69 -0.890 1.314 -13.009 532 HH21 ARG 69 HH21 ARG 69 -2.120 -1.398 -11.184 533 HH22 ARG 69 HH22 ARG 69 -2.502 -0.152 -12.325 534 H THR 70 HN THR 70 1.493 -5.547 -10.637 535 HA THR 70 HA THR 70 0.664 -6.772 -13.108 536 HB THR 70 HB THR 70 -0.726 -8.205 -11.706 537 HG1 THR 70 HG1 THR 70 -0.030 -6.357 -9.691 538 HG21 THR 70 HG21 THR 70 0.932 -9.443 -10.840 539 HG22 THR 70 HG22 THR 70 1.651 -8.083 -9.979 540 HG23 THR 70 HG23 THR 70 1.952 -8.292 -11.704 541 H SER 71 HN SER 71 -0.334 -5.122 -14.238 542 HA SER 71 HA SER 71 -2.328 -3.420 -13.256 543 HB2 SER 71 HB2 SER 71 -1.651 -4.365 -16.035 544 HB3 SER 71 HB1 SER 71 -2.961 -3.223 -15.730 545 HG SER 71 HG SER 71 -0.291 -2.836 -14.856 546 H ASP 72 HN ASP 72 -2.488 -6.759 -13.807 547 HA ASP 72 HA ASP 72 -4.981 -7.249 -14.834 548 HB2 ASP 72 HB2 ASP 72 -3.284 -8.653 -12.821 549 HB3 ASP 72 HB1 ASP 72 -4.941 -9.205 -13.047 550 H GLN 73 HN GLN 73 -4.194 -5.876 -11.741 551 HA GLN 73 HA GLN 73 -5.515 -4.808 -10.211 552 HB2 GLN 73 HB2 GLN 73 -6.981 -4.508 -12.413 553 HB3 GLN 73 HB1 GLN 73 -8.056 -5.600 -11.550 554 HG2 GLN 73 HG2 GLN 73 -8.776 -3.977 -10.225 555 HG3 GLN 73 HG1 GLN 73 -7.132 -3.477 -9.831 556 HE21 GLN 73 HE21 GLN 73 -9.006 -3.485 -12.844 557 HE22 GLN 73 HE22 GLN 73 -8.799 -1.803 -13.180 558 H VAL 74 HN VAL 74 -5.254 -7.965 -10.648 559 HA VAL 74 HA VAL 74 -7.205 -8.697 -8.564 560 HB VAL 74 HB VAL 74 -7.437 -9.971 -10.643 561 HG11 VAL 74 HG11 VAL 74 -4.946 -11.487 -10.279 562 HG12 VAL 74 HG12 VAL 74 -4.744 -9.836 -10.865 563 HG13 VAL 74 HG13 VAL 74 -5.758 -10.970 -11.757 564 HG21 VAL 74 HG21 VAL 74 -7.211 -11.006 -8.046 565 HG22 VAL 74 HG22 VAL 74 -6.433 -12.179 -9.107 566 HG23 VAL 74 HG23 VAL 74 -8.100 -11.691 -9.405 567 H LEU 75 HN LEU 75 -6.181 -8.375 -6.649 568 HA LEU 75 HA LEU 75 -3.397 -9.082 -6.305 569 HB2 LEU 75 HB2 LEU 75 -5.370 -7.533 -4.866 570 HB3 LEU 75 HB1 LEU 75 -4.466 -8.567 -3.788 571 HG LEU 75 HG LEU 75 -2.869 -6.998 -5.721 572 HD11 LEU 75 HD11 LEU 75 -3.401 -5.381 -3.398 573 HD12 LEU 75 HD12 LEU 75 -4.886 -5.685 -4.301 574 HD13 LEU 75 HD13 LEU 75 -3.497 -4.959 -5.108 575 HD21 LEU 75 HD21 LEU 75 -2.639 -7.668 -2.790 576 HD22 LEU 75 HD22 LEU 75 -1.449 -6.742 -3.704 577 HD23 LEU 75 HD23 LEU 75 -1.769 -8.425 -4.125 578 H GLN 76 HN GLN 76 -2.610 -10.578 -4.830 579 HA GLN 76 HA GLN 76 -4.341 -12.443 -3.517 580 HB2 GLN 76 HB2 GLN 76 -2.531 -13.447 -5.714 581 HB3 GLN 76 HB1 GLN 76 -3.512 -14.439 -4.647 582 HG2 GLN 76 HG2 GLN 76 -5.504 -13.131 -5.597 583 HG3 GLN 76 HG1 GLN 76 -4.391 -12.641 -6.872 584 HE21 GLN 76 HE21 GLN 76 -4.007 -14.007 -8.504 585 HE22 GLN 76 HE22 GLN 76 -4.604 -15.625 -8.604 586 H LYS 77 HN LYS 77 -3.382 -13.204 -1.763 587 HA LYS 77 HA LYS 77 -0.777 -12.278 -1.086 588 HB2 LYS 77 HB2 LYS 77 -1.115 -12.973 1.062 589 HB3 LYS 77 HB1 LYS 77 -2.730 -12.544 0.515 590 HG2 LYS 77 HG2 LYS 77 -1.837 -15.376 0.293 591 HG3 LYS 77 HG1 LYS 77 -2.304 -14.744 1.869 592 HD2 LYS 77 HD2 LYS 77 -4.499 -14.311 1.165 593 HD3 LYS 77 HD1 LYS 77 -4.071 -14.437 -0.540 594 HE2 LYS 77 HE2 LYS 77 -3.934 -16.762 -0.457 595 HE3 LYS 77 HE1 LYS 77 -3.780 -16.782 1.299 596 HZ1 LYS 77 HZ1 LYS 77 -6.244 -15.644 0.274 597 HZ2 LYS 77 HZ2 LYS 77 -5.994 -16.689 1.580 598 HZ3 LYS 77 HZ3 LYS 77 -6.049 -17.304 0.005 599 H GLY 78 HN GLY 78 1.019 -13.423 -0.415 600 HA2 GLY 78 HA2 GLY 78 2.046 -15.631 -0.111 601 HA3 GLY 78 HA1 GLY 78 1.167 -16.146 -1.547 602 H GLY 79 HN GLY 79 2.407 -12.922 -1.601 603 HA2 GLY 79 HA2 GLY 79 4.884 -13.844 -2.868 604 HA3 GLY 79 HA1 GLY 79 3.738 -13.024 -3.908 605 H TYR 80 HN TYR 80 3.855 -10.937 -4.076 606 HA TYR 80 HA TYR 80 4.963 -9.254 -2.011 607 HB2 TYR 80 HB2 TYR 80 6.200 -8.697 -4.621 608 HB3 TYR 80 HB1 TYR 80 6.919 -8.682 -3.020 609 HD1 TYR 80 HD1 TYR 80 5.872 -10.957 -5.764 610 HD2 TYR 80 HD2 TYR 80 8.338 -10.416 -2.340 611 HE1 TYR 80 HE1 TYR 80 7.047 -13.053 -6.287 612 HE2 TYR 80 HE2 TYR 80 9.521 -12.510 -2.852 613 HH TYR 80 HH TYR 80 8.399 -14.712 -5.272 614 H PHE 81 HN PHE 81 4.668 -6.964 -2.541 615 HA PHE 81 HA PHE 81 3.097 -6.379 -4.876 616 HB2 PHE 81 HB2 PHE 81 1.267 -5.234 -3.605 617 HB3 PHE 81 HB1 PHE 81 1.247 -6.988 -3.514 618 HD1 PHE 81 HD2 PHE 81 2.752 -7.892 -1.473 619 HD2 PHE 81 HD1 PHE 81 0.806 -4.095 -1.684 620 HE1 PHE 81 HE2 PHE 81 2.673 -7.780 0.992 621 HE2 PHE 81 HE1 PHE 81 0.724 -3.979 0.738 622 HZ PHE 81 HZ PHE 81 1.658 -5.820 2.105 623 H VAL 82 HN VAL 82 2.395 -4.043 -4.800 624 HA VAL 82 HA VAL 82 4.410 -2.461 -3.396 625 HB VAL 82 HB VAL 82 4.202 -2.949 -6.262 626 HG11 VAL 82 HG11 VAL 82 4.012 -0.119 -5.285 627 HG12 VAL 82 HG12 VAL 82 3.179 -0.901 -6.627 628 HG13 VAL 82 HG13 VAL 82 4.888 -0.496 -6.768 629 HG21 VAL 82 HG21 VAL 82 6.299 -1.520 -4.629 630 HG22 VAL 82 HG22 VAL 82 6.495 -2.185 -6.251 631 HG23 VAL 82 HG23 VAL 82 6.217 -3.263 -4.885 632 H ILE 83 HN ILE 83 3.422 -0.831 -2.343 633 HA ILE 83 HA ILE 83 0.621 -0.434 -2.697 634 HB ILE 83 HB ILE 83 2.668 1.057 -1.138 635 HG12 ILE 83 HG12 ILE 83 2.100 -0.170 0.713 636 HG13 ILE 83 HG11 ILE 83 0.438 -0.367 0.185 637 HG21 ILE 83 HG21 ILE 83 0.597 2.015 0.056 638 HG22 ILE 83 HG22 ILE 83 -0.233 1.609 -1.448 639 HG23 ILE 83 HG23 ILE 83 1.129 2.729 -1.464 640 HD11 ILE 83 HD11 ILE 83 1.063 -2.139 -1.288 641 HD12 ILE 83 HD12 ILE 83 1.737 -2.461 0.308 642 HD13 ILE 83 HD13 ILE 83 2.773 -1.853 -0.976 643 H ASN 84 HN ASN 84 -0.168 0.630 -4.396 644 HA ASN 84 HA ASN 84 1.237 2.335 -6.036 645 HB2 ASN 84 HB2 ASN 84 -1.365 1.407 -5.877 646 HB3 ASN 84 HB1 ASN 84 -1.529 3.136 -5.679 647 HD21 ASN 84 HD21 ASN 84 -2.008 1.072 -7.908 648 HD22 ASN 84 HD22 ASN 84 -1.388 1.865 -9.308 649 HA PRO 85 HA PRO 85 1.825 5.675 -3.021 650 HB2 PRO 85 HB2 PRO 85 3.395 7.209 -4.546 651 HB3 PRO 85 HB1 PRO 85 4.008 5.689 -3.866 652 HG2 PRO 85 HG2 PRO 85 2.772 6.150 -6.568 653 HG3 PRO 85 HG1 PRO 85 4.340 5.453 -6.207 654 HD2 PRO 85 HD2 PRO 85 2.309 3.850 -6.669 655 HD3 PRO 85 HD1 PRO 85 3.406 3.489 -5.316 656 H ASN 86 HN ASN 86 0.818 5.844 -6.260 657 HA ASN 86 HA ASN 86 -0.111 8.489 -6.164 658 HB2 ASN 86 HB2 ASN 86 -0.329 6.229 -8.116 659 HB3 ASN 86 HB1 ASN 86 -1.333 7.646 -8.326 660 HD21 ASN 86 HD21 ASN 86 1.997 6.614 -7.914 661 HD22 ASN 86 HD22 ASN 86 2.703 7.876 -8.858 662 H ASN 87 HN ASN 87 -1.406 5.376 -5.440 663 HA ASN 87 HA ASN 87 -4.149 6.239 -5.223 664 HB2 ASN 87 HB2 ASN 87 -2.671 3.849 -5.250 665 HB3 ASN 87 HB1 ASN 87 -3.560 3.959 -3.746 666 HD21 ASN 87 HD21 ASN 87 -4.015 2.035 -5.541 667 HD22 ASN 87 HD22 ASN 87 -5.584 2.219 -6.247 668 H VAL 88 HN VAL 88 -1.365 6.734 -3.597 669 HA VAL 88 HA VAL 88 -2.406 6.554 -0.981 670 HB VAL 88 HB VAL 88 0.288 7.044 -2.167 671 HG11 VAL 88 HG11 VAL 88 -0.859 7.695 0.484 672 HG12 VAL 88 HG12 VAL 88 0.485 8.446 -0.384 673 HG13 VAL 88 HG13 VAL 88 0.738 6.929 0.486 674 HG21 VAL 88 HG21 VAL 88 -1.245 4.854 -1.310 675 HG22 VAL 88 HG22 VAL 88 0.051 5.064 -0.117 676 HG23 VAL 88 HG23 VAL 88 0.444 4.856 -1.846 677 H LYS 89 HN LYS 89 -2.982 8.081 0.066 678 HA LYS 89 HA LYS 89 -3.120 10.752 -0.941 679 HB2 LYS 89 HB2 LYS 89 -3.982 9.633 1.688 680 HB3 LYS 89 HB1 LYS 89 -4.392 11.221 1.082 681 HG2 LYS 89 HG2 LYS 89 -6.170 9.454 0.946 682 HG3 LYS 89 HG1 LYS 89 -5.841 10.340 -0.537 683 HD2 LYS 89 HD2 LYS 89 -4.530 7.714 0.028 684 HD3 LYS 89 HD1 LYS 89 -6.170 7.791 -0.616 685 HE2 LYS 89 HE2 LYS 89 -4.221 9.473 -2.008 686 HE3 LYS 89 HE1 LYS 89 -3.897 7.742 -2.086 687 HZ1 LYS 89 HZ1 LYS 89 -6.641 8.596 -2.605 688 HZ2 LYS 89 HZ2 LYS 89 -5.734 7.373 -3.338 689 HZ3 LYS 89 HZ3 LYS 89 -5.496 8.985 -3.790 690 H SER 90 HN SER 90 -1.776 8.951 1.668 691 HA SER 90 HA SER 90 0.681 10.256 1.819 692 HB2 SER 90 HB2 SER 90 0.514 12.106 3.119 693 HB3 SER 90 HB1 SER 90 -1.162 12.099 2.576 694 HG SER 90 HG SER 90 -0.103 11.522 5.059 695 H VAL 91 HN VAL 91 1.752 10.016 4.067 696 HA VAL 91 HA VAL 91 0.886 7.502 5.238 697 HB VAL 91 HB VAL 91 3.294 8.000 6.380 698 HG11 VAL 91 HG11 VAL 91 2.265 6.356 4.215 699 HG12 VAL 91 HG12 VAL 91 3.323 5.921 5.561 700 HG13 VAL 91 HG13 VAL 91 4.006 6.634 4.098 701 HG21 VAL 91 HG21 VAL 91 4.860 8.831 4.770 702 HG22 VAL 91 HG22 VAL 91 3.583 10.032 4.970 703 HG23 VAL 91 HG23 VAL 91 3.593 8.982 3.552 704 H GLY 92 HN GLY 92 0.563 7.418 7.526 705 HA2 GLY 92 HA2 GLY 92 0.258 10.044 8.759 706 HA3 GLY 92 HA1 GLY 92 -0.844 8.700 9.015 707 H THR 93 HN THR 93 -0.161 9.709 11.128 708 HA THR 93 HA THR 93 2.245 9.130 12.436 709 HB THR 93 HB THR 93 -0.336 9.160 13.906 710 HG1 THR 93 HG1 THR 93 -0.998 10.705 12.623 711 HG21 THR 93 HG21 THR 93 1.675 9.362 15.181 712 HG22 THR 93 HG22 THR 93 0.815 10.900 15.207 713 HG23 THR 93 HG23 THR 93 2.219 10.692 14.162 714 HA PRO 94 HA PRO 94 1.992 4.865 13.103 715 HB2 PRO 94 HB2 PRO 94 4.199 4.643 14.487 716 HB3 PRO 94 HB1 PRO 94 4.254 5.298 12.841 717 HG2 PRO 94 HG2 PRO 94 4.129 6.830 15.405 718 HG3 PRO 94 HG1 PRO 94 5.331 6.966 14.112 719 HD2 PRO 94 HD2 PRO 94 3.214 8.587 14.257 720 HD3 PRO 94 HD1 PRO 94 3.882 8.041 12.704 721 H MET 95 HN MET 95 1.750 3.345 14.717 722 HA MET 95 HA MET 95 1.300 4.182 17.459 723 HB2 MET 95 HB2 MET 95 -0.900 2.945 15.792 724 HB3 MET 95 HB1 MET 95 -0.964 3.170 17.535 725 HG2 MET 95 HG2 MET 95 -0.504 5.668 16.934 726 HG3 MET 95 HG1 MET 95 -1.125 5.191 15.356 727 HE1 MET 95 HE1 MET 95 -4.205 3.196 16.964 728 HE2 MET 95 HE2 MET 95 -2.868 3.077 15.821 729 HE3 MET 95 HE3 MET 95 -4.262 4.090 15.445 730 H LYS 96 HN LYS 96 1.944 2.605 18.843 731 HA LYS 96 HA LYS 96 2.799 0.083 17.691 732 HB2 LYS 96 HB2 LYS 96 2.959 0.829 20.607 733 HB3 LYS 96 HB1 LYS 96 3.962 -0.310 19.719 734 HG2 LYS 96 HG2 LYS 96 4.343 2.118 18.419 735 HG3 LYS 96 HG1 LYS 96 4.311 2.524 20.135 736 HD2 LYS 96 HD2 LYS 96 6.039 0.883 20.586 737 HD3 LYS 96 HD1 LYS 96 6.029 0.375 18.896 738 HE2 LYS 96 HE2 LYS 96 7.851 1.804 18.984 739 HE3 LYS 96 HE1 LYS 96 6.563 2.853 18.394 740 HZ1 LYS 96 HZ1 LYS 96 6.651 2.858 21.232 741 HZ2 LYS 96 HZ2 LYS 96 6.789 4.155 20.157 742 HZ3 LYS 96 HZ3 LYS 96 8.163 3.273 20.595 743 H GLY 97 HN GLY 97 1.642 -1.756 17.712 744 HA2 GLY 97 HA2 GLY 97 0.000 -2.498 19.913 745 HA3 GLY 97 HA1 GLY 97 -0.989 -1.876 18.605 746 H SER 98 HN SER 98 0.228 -2.893 16.371 747 HA SER 98 HA SER 98 -0.702 -5.565 16.394 748 HB2 SER 98 HB2 SER 98 0.581 -3.765 14.413 749 HB3 SER 98 HB1 SER 98 0.742 -5.475 14.101 750 HG SER 98 HG SER 98 -1.304 -5.576 13.617 751 H GLY 99 HN GLY 99 0.701 -6.138 18.334 752 HA2 GLY 99 HA2 GLY 99 2.236 -7.981 18.653 753 HA3 GLY 99 HA1 GLY 99 3.210 -7.329 17.345 754 H GLY 100 HN GLY 100 3.541 -4.709 18.043 755 HA2 GLY 100 HA2 GLY 100 4.024 -3.863 20.544 756 HA3 GLY 100 HA1 GLY 100 5.351 -4.965 20.249 757 H LEU 101 HN LEU 101 5.117 -4.070 17.307 758 HA LEU 101 HA LEU 101 7.170 -2.140 17.349 759 HB2 LEU 101 HB2 LEU 101 5.601 -2.706 14.947 760 HB3 LEU 101 HB1 LEU 101 7.315 -2.524 15.162 761 HG LEU 101 HG LEU 101 7.170 -4.829 16.348 762 HD11 LEU 101 HD11 LEU 101 4.859 -5.048 14.458 763 HD12 LEU 101 HD12 LEU 101 4.609 -4.848 16.185 764 HD13 LEU 101 HD13 LEU 101 5.448 -6.272 15.575 765 HD21 LEU 101 HD21 LEU 101 7.894 -5.692 14.380 766 HD22 LEU 101 HD22 LEU 101 8.067 -3.951 14.122 767 HD23 LEU 101 HD23 LEU 101 6.676 -4.813 13.451 768 H SER 102 HN SER 102 6.383 -0.867 15.019 769 HA SER 102 HA SER 102 4.393 1.052 15.953 770 HB2 SER 102 HB2 SER 102 7.077 1.358 14.790 771 HB3 SER 102 HB1 SER 102 5.829 2.477 14.208 772 HG SER 102 HG SER 102 6.602 3.478 15.967 773 H TRP 103 HN TRP 103 2.661 0.990 14.793 774 HA TRP 103 HA TRP 103 2.737 0.233 11.981 775 HB2 TRP 103 HB2 TRP 103 0.602 -0.258 14.035 776 HB3 TRP 103 HB1 TRP 103 0.558 -0.747 12.370 777 HD1 TRP 103 HD1 TRP 103 3.245 -1.112 15.081 778 HE1 TRP 103 HE1 TRP 103 4.177 -3.448 15.002 779 HE3 TRP 103 HE3 TRP 103 0.237 -3.150 11.489 780 HZ2 TRP 103 HZ2 TRP 103 3.727 -5.895 13.675 781 HZ3 TRP 103 HZ3 TRP 103 0.578 -5.499 10.880 782 HH2 TRP 103 HH2 TRP 103 2.275 -6.841 11.967 783 H ALA 104 HN ALA 104 2.302 1.924 10.811 784 HA ALA 104 HA ALA 104 0.910 4.184 11.974 785 HB1 ALA 104 HB1 ALA 104 1.936 5.564 10.245 786 HB2 ALA 104 HB2 ALA 104 2.746 4.128 9.622 787 HB3 ALA 104 HB3 ALA 104 3.111 4.715 11.247 788 H GLN 105 HN GLN 105 -0.503 5.430 11.041 789 HA GLN 105 HA GLN 105 -2.398 4.108 9.411 790 HB2 GLN 105 HB2 GLN 105 -2.733 5.713 11.440 791 HB3 GLN 105 HB1 GLN 105 -2.590 6.963 10.219 792 HG2 GLN 105 HG2 GLN 105 -4.422 6.180 9.046 793 HG3 GLN 105 HG1 GLN 105 -4.442 4.671 9.943 794 HE21 GLN 105 HE21 GLN 105 -6.691 5.108 10.340 795 HE22 GLN 105 HE22 GLN 105 -7.155 6.204 11.592 796 H VAL 106 HN VAL 106 -1.864 4.076 7.192 797 HA VAL 106 HA VAL 106 -0.958 6.619 6.097 798 HB VAL 106 HB VAL 106 -0.676 3.775 5.159 799 HG11 VAL 106 HG11 VAL 106 -0.458 6.301 3.620 800 HG12 VAL 106 HG12 VAL 106 -1.057 4.733 3.118 801 HG13 VAL 106 HG13 VAL 106 0.679 4.995 3.288 802 HG21 VAL 106 HG21 VAL 106 1.198 5.978 5.975 803 HG22 VAL 106 HG22 VAL 106 1.742 4.527 5.127 804 HG23 VAL 106 HG23 VAL 106 0.985 4.383 6.718 805 H ASN 107 HN ASN 107 -2.132 7.627 4.558 806 HA ASN 107 HA ASN 107 -4.899 6.843 4.369 807 HB2 ASN 107 HB2 ASN 107 -3.354 9.319 4.130 808 HB3 ASN 107 HB1 ASN 107 -4.627 9.171 2.930 809 HD21 ASN 107 HD21 ASN 107 -6.720 8.210 3.981 810 HD22 ASN 107 HD22 ASN 107 -7.235 9.034 5.408 811 H PHE 108 HN PHE 108 -5.174 5.296 2.852 812 HA PHE 108 HA PHE 108 -3.973 5.645 0.294 813 HB2 PHE 108 HB2 PHE 108 -5.523 3.337 1.478 814 HB3 PHE 108 HB1 PHE 108 -4.951 3.400 -0.166 815 HD1 PHE 108 HD2 PHE 108 -3.448 3.986 3.192 816 HD2 PHE 108 HD1 PHE 108 -3.176 1.991 -0.552 817 HE1 PHE 108 HE2 PHE 108 -1.384 2.873 3.926 818 HE2 PHE 108 HE1 PHE 108 -1.125 0.867 0.189 819 HZ PHE 108 HZ PHE 108 -0.219 1.313 2.431 820 H THR 109 HN THR 109 -5.263 4.993 -1.472 821 HA THR 109 HA THR 109 -7.229 6.695 -2.177 822 HB THR 109 HB THR 109 -5.941 5.536 -3.742 823 HG1 THR 109 HG1 THR 109 -8.558 4.485 -4.016 824 HG21 THR 109 HG21 THR 109 -7.083 2.956 -3.684 825 HG22 THR 109 HG22 THR 109 -6.475 3.378 -2.080 826 HG23 THR 109 HG23 THR 109 -5.405 3.448 -3.471 827 H THR 110 HN THR 110 -7.946 3.281 -1.813 828 HA THR 110 HA THR 110 -10.765 3.783 -1.690 829 HB THR 110 HB THR 110 -9.600 1.104 -1.332 830 HG1 THR 110 HG1 THR 110 -9.256 0.981 -3.570 831 HG21 THR 110 HG21 THR 110 -11.398 0.381 -2.741 832 HG22 THR 110 HG22 THR 110 -11.858 2.054 -3.058 833 HG23 THR 110 HG23 THR 110 -12.041 1.382 -1.438 834 H GLY 111 HN GLY 111 -8.536 1.980 0.373 835 HA2 GLY 111 HA2 GLY 111 -10.405 1.647 2.444 836 HA3 GLY 111 HA1 GLY 111 -8.683 1.329 2.550 837 H GLY 112 HN GLY 112 -8.696 4.401 1.512 838 HA2 GLY 112 HA2 GLY 112 -8.332 6.403 2.533 839 HA3 GLY 112 HA1 GLY 112 -9.555 5.897 3.687 840 H ASN 113 HN ASN 113 -8.917 4.893 5.612 841 HA ASN 113 HA ASN 113 -6.152 5.367 6.282 842 HB2 ASN 113 HB2 ASN 113 -6.996 4.413 8.535 843 HB3 ASN 113 HB1 ASN 113 -7.576 5.994 8.055 844 HD21 ASN 113 HD21 ASN 113 -8.438 2.634 7.363 845 HD22 ASN 113 HD22 ASN 113 -10.124 2.803 7.717 846 H VAL 114 HN VAL 114 -4.637 3.864 6.349 847 HA VAL 114 HA VAL 114 -5.332 1.040 6.472 848 HB VAL 114 HB VAL 114 -3.359 1.909 4.405 849 HG11 VAL 114 HG11 VAL 114 -3.399 -0.407 5.194 850 HG12 VAL 114 HG12 VAL 114 -3.792 -0.283 3.475 851 HG13 VAL 114 HG13 VAL 114 -5.075 -0.541 4.660 852 HG21 VAL 114 HG21 VAL 114 -5.251 3.048 3.595 853 HG22 VAL 114 HG22 VAL 114 -6.336 1.741 4.070 854 HG23 VAL 114 HG23 VAL 114 -5.230 1.519 2.714 855 H TRP 115 HN TRP 115 -4.051 0.250 8.025 856 HA TRP 115 HA TRP 115 -1.703 1.813 8.666 857 HB2 TRP 115 HB2 TRP 115 -3.119 -0.317 10.193 858 HB3 TRP 115 HB1 TRP 115 -1.653 0.457 10.749 859 HD1 TRP 115 HD1 TRP 115 -5.193 1.442 9.627 860 HE1 TRP 115 HE1 TRP 115 -5.881 3.413 11.057 861 HE3 TRP 115 HE3 TRP 115 -0.867 2.146 12.174 862 HZ2 TRP 115 HZ2 TRP 115 -4.759 5.098 12.931 863 HZ3 TRP 115 HZ3 TRP 115 -0.744 4.009 13.801 864 HH2 TRP 115 HH2 TRP 115 -2.675 5.466 14.177 865 H LEU 116 HN LEU 116 0.285 0.932 9.176 866 HA LEU 116 HA LEU 116 0.930 -1.720 8.202 867 HB2 LEU 116 HB2 LEU 116 1.119 0.508 6.526 868 HB3 LEU 116 HB1 LEU 116 2.758 0.254 7.115 869 HG LEU 116 HG LEU 116 1.836 -2.292 6.364 870 HD11 LEU 116 HD11 LEU 116 0.101 -0.654 5.163 871 HD12 LEU 116 HD12 LEU 116 0.659 -2.167 4.442 872 HD13 LEU 116 HD13 LEU 116 1.393 -0.637 3.960 873 HD21 LEU 116 HD21 LEU 116 4.103 -1.227 6.140 874 HD22 LEU 116 HD22 LEU 116 3.512 -0.452 4.674 875 HD23 LEU 116 HD23 LEU 116 3.587 -2.210 4.777 876 H ASN 117 HN ASN 117 2.851 -2.462 9.175 877 HA ASN 117 HA ASN 117 3.636 -0.955 11.427 878 HB2 ASN 117 HB2 ASN 117 4.088 -2.953 11.968 879 HB3 ASN 117 HB1 ASN 117 4.441 -3.506 10.348 880 HD21 ASN 117 HD21 ASN 117 5.656 -2.464 13.339 881 HD22 ASN 117 HD22 ASN 117 7.341 -2.566 12.973 882 H THR 118 HN THR 118 4.195 0.673 11.142 883 HA THR 118 HA THR 118 5.678 1.809 9.024 884 HB THR 118 HB THR 118 3.762 2.712 10.377 885 HG1 THR 118 HG1 THR 118 4.774 4.914 10.269 886 HG21 THR 118 HG21 THR 118 3.985 3.445 12.457 887 HG22 THR 118 HG22 THR 118 5.582 4.133 12.150 888 HG23 THR 118 HG23 THR 118 5.413 2.415 12.503 889 H THR 119 HN THR 119 7.008 -0.038 11.187 890 HA THR 119 HA THR 119 8.964 1.575 12.419 891 HB THR 119 HB THR 119 10.265 -0.706 12.239 892 HG1 THR 119 HG1 THR 119 8.708 -1.472 10.662 893 HG21 THR 119 HG21 THR 119 8.999 0.315 14.240 894 HG22 THR 119 HG22 THR 119 9.380 -1.407 14.240 895 HG23 THR 119 HG23 THR 119 7.757 -0.861 13.817 896 H SER 120 HN SER 120 8.528 2.062 9.452 897 HA SER 120 HA SER 120 11.089 2.774 8.732 898 HB2 SER 120 HB2 SER 120 10.126 0.126 7.759 899 HB3 SER 120 HB1 SER 120 10.861 1.191 6.560 900 HG SER 120 HG SER 120 12.192 -0.360 8.004 901 H LYS 121 HN LYS 121 10.706 4.503 7.472 902 HA LYS 121 HA LYS 121 8.043 5.092 6.645 903 HB2 LYS 121 HB2 LYS 121 9.496 6.805 7.483 904 HB3 LYS 121 HB1 LYS 121 10.665 6.507 6.205 905 HG2 LYS 121 HG2 LYS 121 8.671 7.091 4.626 906 HG3 LYS 121 HG1 LYS 121 8.016 7.872 6.067 907 HD2 LYS 121 HD2 LYS 121 10.474 8.877 6.163 908 HD3 LYS 121 HD1 LYS 121 10.386 8.582 4.425 909 HE2 LYS 121 HE2 LYS 121 8.491 10.243 6.082 910 HE3 LYS 121 HE1 LYS 121 9.655 10.831 4.896 911 HZ1 LYS 121 HZ1 LYS 121 8.430 9.680 3.166 912 HZ2 LYS 121 HZ2 LYS 121 7.417 10.756 3.989 913 HZ3 LYS 121 HZ3 LYS 121 7.319 9.097 4.302 914 H ASP 122 HN ASP 122 11.067 4.178 5.093 915 HA ASP 122 HA ASP 122 10.049 4.231 2.451 916 HB2 ASP 122 HB2 ASP 122 12.393 2.884 3.748 917 HB3 ASP 122 HB1 ASP 122 12.004 2.648 2.047 918 H ASN 123 HN ASN 123 9.194 2.463 5.116 919 HA ASN 123 HA ASN 123 8.954 -0.144 4.145 920 HB2 ASN 123 HB2 ASN 123 8.667 0.094 6.509 921 HB3 ASN 123 HB1 ASN 123 7.580 1.454 6.277 922 HD21 ASN 123 HD21 ASN 123 7.431 -1.404 4.381 923 HD22 ASN 123 HD22 ASN 123 5.881 -1.845 4.895 924 H LEU 124 HN LEU 124 6.480 2.291 4.424 925 HA LEU 124 HA LEU 124 4.629 0.867 2.847 926 HB2 LEU 124 HB2 LEU 124 4.396 3.775 2.751 927 HB3 LEU 124 HB1 LEU 124 3.206 2.573 3.208 928 HG LEU 124 HG LEU 124 3.636 3.989 5.059 929 HD11 LEU 124 HD11 LEU 124 3.232 1.881 5.925 930 HD12 LEU 124 HD12 LEU 124 4.815 2.224 6.620 931 HD13 LEU 124 HD13 LEU 124 4.682 1.186 5.198 932 HD21 LEU 124 HD21 LEU 124 5.611 5.023 5.107 933 HD22 LEU 124 HD22 LEU 124 6.365 3.778 4.097 934 HD23 LEU 124 HD23 LEU 124 6.247 3.552 5.848 935 H LEU 125 HN LEU 125 6.590 3.688 2.176 936 HA LEU 125 HA LEU 125 6.024 3.885 -0.527 937 HB2 LEU 125 HB2 LEU 125 8.445 4.649 1.085 938 HB3 LEU 125 HB1 LEU 125 8.236 5.082 -0.583 939 HG LEU 125 HG LEU 125 6.025 6.185 0.209 940 HD11 LEU 125 HD11 LEU 125 5.585 5.963 2.371 941 HD12 LEU 125 HD12 LEU 125 7.031 6.905 2.737 942 HD13 LEU 125 HD13 LEU 125 7.127 5.144 2.624 943 HD21 LEU 125 HD21 LEU 125 7.487 7.765 -0.524 944 HD22 LEU 125 HD22 LEU 125 8.824 7.131 0.436 945 HD23 LEU 125 HD23 LEU 125 7.583 8.125 1.200 946 H TYR 126 HN TYR 126 8.675 2.164 1.121 947 HA TYR 126 HA TYR 126 9.318 0.996 -1.516 948 HB2 TYR 126 HB2 TYR 126 10.936 2.099 0.647 949 HB3 TYR 126 HB1 TYR 126 11.483 0.514 0.137 950 HD1 TYR 126 HD2 TYR 126 10.290 3.674 -1.433 951 HD2 TYR 126 HD1 TYR 126 13.128 0.508 -1.484 952 HE1 TYR 126 HE2 TYR 126 11.432 4.737 -3.339 953 HE2 TYR 126 HE1 TYR 126 14.280 1.558 -3.386 954 HH TYR 126 HH TYR 126 13.483 4.756 -4.477 955 H GLY 127 HN GLY 127 8.684 0.317 1.885 956 HA2 GLY 127 HA2 GLY 127 7.683 -1.819 2.490 957 HA3 GLY 127 HA1 GLY 127 8.491 -2.548 1.115 958 H LYS 128 HN LYS 128 10.156 -0.324 3.178 959 HA LYS 128 HA LYS 128 12.146 -2.234 3.791 960 HB2 LYS 128 HB2 LYS 128 11.636 0.546 4.823 961 HB3 LYS 128 HB1 LYS 128 13.093 -0.375 5.096 962 HG2 LYS 128 HG2 LYS 128 13.205 -0.498 2.515 963 HG3 LYS 128 HG1 LYS 128 12.106 0.886 2.599 964 HD2 LYS 128 HD2 LYS 128 13.697 2.218 3.707 965 HD3 LYS 128 HD1 LYS 128 14.641 0.818 4.209 966 HE2 LYS 128 HE2 LYS 128 15.853 1.926 2.476 967 HE3 LYS 128 HE1 LYS 128 15.221 0.418 1.821 968 HZ1 LYS 128 HZ1 LYS 128 14.209 3.160 1.342 969 HZ2 LYS 128 HZ2 LYS 128 13.340 1.775 0.912 970 HZ3 LYS 128 HZ3 LYS 128 14.848 2.078 0.212 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 5.681 33.606 -31.286 2 H2 MET 1 HT2 MET 1 4.147 33.150 -30.666 3 H3 MET 1 HT3 MET 1 4.252 34.256 -31.976 4 HA MET 1 HA MET 1 4.864 32.669 -33.461 5 HB2 MET 1 HB2 MET 1 5.753 31.246 -30.989 6 HB3 MET 1 HB1 MET 1 5.353 30.284 -32.406 7 HG2 MET 1 HG2 MET 1 6.948 31.926 -33.636 8 HG3 MET 1 HG1 MET 1 7.555 32.256 -32.015 9 HE1 MET 1 HE1 MET 1 9.226 30.005 -30.637 10 HE2 MET 1 HE2 MET 1 9.425 31.550 -31.465 11 HE3 MET 1 HE3 MET 1 10.342 30.139 -31.996 12 H ARG 2 HN ARG 2 3.730 30.590 -34.118 13 HA ARG 2 HA ARG 2 0.963 30.789 -33.283 14 HB2 ARG 2 HB2 ARG 2 2.407 29.828 -35.621 15 HB3 ARG 2 HB1 ARG 2 1.143 28.711 -35.123 16 HG2 ARG 2 HG2 ARG 2 -0.541 30.326 -35.403 17 HG3 ARG 2 HG1 ARG 2 0.629 31.644 -35.496 18 HD2 ARG 2 HD2 ARG 2 1.015 29.554 -37.509 19 HD3 ARG 2 HD1 ARG 2 -0.526 30.401 -37.639 20 HE ARG 2 HE ARG 2 2.073 31.445 -38.232 21 HH11 ARG 2 HH11 ARG 2 -1.148 32.296 -37.193 22 HH12 ARG 2 HH12 ARG 2 -1.037 33.926 -37.766 23 HH21 ARG 2 HH21 ARG 2 2.221 33.589 -38.987 24 HH22 ARG 2 HH22 ARG 2 0.875 34.660 -38.785 25 H GLY 3 HN GLY 3 0.184 29.625 -31.659 26 HA2 GLY 3 HA2 GLY 3 -0.368 27.329 -30.954 27 HA3 GLY 3 HA1 GLY 3 1.325 26.936 -31.206 28 H SER 4 HN SER 4 2.734 27.188 -29.560 29 HA SER 4 HA SER 4 1.751 27.550 -26.943 30 HB2 SER 4 HB2 SER 4 3.687 26.173 -27.256 31 HB3 SER 4 HB1 SER 4 4.566 27.484 -28.040 32 HG SER 4 HG SER 4 3.622 27.822 -25.416 33 H HIS 5 HN HIS 5 1.290 29.352 -25.890 34 HA HIS 5 HA HIS 5 2.094 31.914 -26.970 35 HB2 HIS 5 HB2 HIS 5 0.724 32.772 -24.973 36 HB3 HIS 5 HB1 HIS 5 -0.140 31.907 -26.239 37 HD1 HIS 5 HD1 HIS 5 -1.876 30.495 -25.215 38 HD2 HIS 5 HD2 HIS 5 1.580 30.578 -22.909 39 HE1 HIS 5 HE1 HIS 5 -2.332 28.977 -23.264 40 HE2 HIS 5 HE2 HIS 5 -0.248 29.086 -21.853 41 H HIS 6 HN HIS 6 2.972 29.818 -24.339 42 HA HIS 6 HA HIS 6 5.313 31.384 -23.793 43 HB2 HIS 6 HB2 HIS 6 2.972 31.864 -22.229 44 HB3 HIS 6 HB1 HIS 6 4.158 31.060 -21.208 45 HD1 HIS 6 HD1 HIS 6 5.858 32.541 -20.177 46 HD2 HIS 6 HD2 HIS 6 4.118 34.271 -23.531 47 HE1 HIS 6 HE1 HIS 6 6.799 34.870 -20.298 48 HE2 HIS 6 HE2 HIS 6 5.793 35.870 -22.379 49 H HIS 7 HN HIS 7 6.818 29.856 -23.696 50 HA HIS 7 HA HIS 7 6.127 27.232 -22.589 51 HB2 HIS 7 HB2 HIS 7 7.201 27.535 -24.901 52 HB3 HIS 7 HB1 HIS 7 8.682 27.923 -24.030 53 HD1 HIS 7 HD1 HIS 7 9.171 25.899 -22.073 54 HD2 HIS 7 HD2 HIS 7 7.152 24.929 -25.573 55 HE1 HIS 7 HE1 HIS 7 9.418 23.410 -22.323 56 HE2 HIS 7 HE2 HIS 7 8.122 22.836 -24.407 57 H HIS 8 HN HIS 8 6.774 26.664 -20.632 58 HA HIS 8 HA HIS 8 9.299 27.598 -19.550 59 HB2 HIS 8 HB2 HIS 8 7.632 29.355 -18.930 60 HB3 HIS 8 HB1 HIS 8 6.717 28.127 -18.063 61 HD1 HIS 8 HD1 HIS 8 7.046 28.660 -15.668 62 HD2 HIS 8 HD2 HIS 8 10.602 28.867 -17.806 63 HE1 HIS 8 HE1 HIS 8 8.833 29.100 -13.955 64 HE2 HIS 8 HE2 HIS 8 10.989 29.119 -15.261 65 H HIS 9 HN HIS 9 10.168 26.176 -18.058 66 HA HIS 9 HA HIS 9 8.650 24.280 -16.612 67 HB2 HIS 9 HB2 HIS 9 8.712 23.512 -19.164 68 HB3 HIS 9 HB1 HIS 9 10.264 22.848 -18.660 69 HD1 HIS 9 HD1 HIS 9 10.177 20.596 -17.633 70 HD2 HIS 9 HD2 HIS 9 6.508 22.537 -17.436 71 HE1 HIS 9 HE1 HIS 9 8.579 18.915 -16.660 72 HE2 HIS 9 HE2 HIS 9 6.348 20.084 -16.628 73 H HIS 10 HN HIS 10 9.910 24.719 -14.867 74 HA HIS 10 HA HIS 10 12.802 24.661 -15.012 75 HB2 HIS 10 HB2 HIS 10 10.968 25.869 -13.332 76 HB3 HIS 10 HB1 HIS 10 11.621 24.574 -12.333 77 HD1 HIS 10 HD1 HIS 10 14.180 24.663 -11.806 78 HD2 HIS 10 HD2 HIS 10 12.713 27.960 -13.865 79 HE1 HIS 10 HE1 HIS 10 15.992 26.400 -11.669 80 HE2 HIS 10 HE2 HIS 10 15.129 28.342 -13.024 81 H GLY 11 HN GLY 11 14.089 22.935 -14.579 82 HA2 GLY 11 HA2 GLY 11 12.869 20.364 -14.088 83 HA3 GLY 11 HA1 GLY 11 14.578 20.675 -14.352 84 H SER 12 HN SER 12 12.160 20.018 -12.056 85 HA SER 12 HA SER 12 13.927 20.739 -9.824 86 HB2 SER 12 HB2 SER 12 11.911 20.396 -8.404 87 HB3 SER 12 HB1 SER 12 11.683 21.637 -9.635 88 HG SER 12 HG SER 12 10.469 20.216 -10.829 89 H GLU 13 HN GLU 13 13.777 18.204 -11.712 90 HA GLU 13 HA GLU 13 13.737 16.208 -9.552 91 HB2 GLU 13 HB2 GLU 13 12.805 16.191 -12.294 92 HB3 GLU 13 HB1 GLU 13 13.913 14.859 -11.997 93 HG2 GLU 13 HG2 GLU 13 12.521 14.278 -9.994 94 HG3 GLU 13 HG1 GLU 13 11.351 15.474 -10.554 95 HA PRO 14 HA PRO 14 18.181 16.085 -10.015 96 HB2 PRO 14 HB2 PRO 14 18.674 14.066 -8.292 97 HB3 PRO 14 HB1 PRO 14 18.235 15.688 -7.745 98 HG2 PRO 14 HG2 PRO 14 16.519 13.249 -8.012 99 HG3 PRO 14 HG1 PRO 14 16.573 14.441 -6.700 100 HD2 PRO 14 HD2 PRO 14 14.675 14.465 -8.649 101 HD3 PRO 14 HD1 PRO 14 15.244 15.935 -7.835 102 H THR 15 HN THR 15 19.855 14.223 -10.289 103 HA THR 15 HA THR 15 18.822 12.480 -12.405 104 HB THR 15 HB THR 15 21.731 12.922 -11.785 105 HG1 THR 15 HG1 THR 15 20.778 14.969 -12.048 106 HG21 THR 15 HG21 THR 15 21.683 11.340 -13.426 107 HG22 THR 15 HG22 THR 15 21.691 12.812 -14.398 108 HG23 THR 15 HG23 THR 15 20.180 11.945 -14.122 109 H THR 16 HN THR 16 19.278 12.221 -9.195 110 HA THR 16 HA THR 16 20.362 9.494 -9.328 111 HB THR 16 HB THR 16 19.903 10.806 -6.705 112 HG1 THR 16 HG1 THR 16 20.811 12.521 -7.767 113 HG21 THR 16 HG21 THR 16 21.237 8.559 -7.500 114 HG22 THR 16 HG22 THR 16 21.456 9.398 -5.965 115 HG23 THR 16 HG23 THR 16 22.538 9.734 -7.317 116 HA PRO 17 HA PRO 17 16.007 8.444 -8.665 117 HB2 PRO 17 HB2 PRO 17 16.208 5.857 -9.389 118 HB3 PRO 17 HB1 PRO 17 16.164 7.164 -10.579 119 HG2 PRO 17 HG2 PRO 17 18.516 5.649 -9.513 120 HG3 PRO 17 HG1 PRO 17 18.158 6.131 -11.182 121 HD2 PRO 17 HD2 PRO 17 19.887 7.490 -9.569 122 HD3 PRO 17 HD1 PRO 17 18.957 8.261 -10.869 123 H THR 18 HN THR 18 15.310 8.138 -6.657 124 HA THR 18 HA THR 18 16.091 5.802 -5.165 125 HB THR 18 HB THR 18 16.399 8.093 -3.398 126 HG1 THR 18 HG1 THR 18 17.303 9.094 -5.196 127 HG21 THR 18 HG21 THR 18 18.344 6.973 -2.647 128 HG22 THR 18 HG22 THR 18 18.413 5.982 -4.104 129 HG23 THR 18 HG23 THR 18 17.114 5.744 -2.937 130 H THR 19 HN THR 19 13.690 6.195 -6.143 131 HA THR 19 HA THR 19 12.044 6.532 -3.779 132 HB THR 19 HB THR 19 12.130 8.803 -4.778 133 HG1 THR 19 HG1 THR 19 9.680 7.397 -4.854 134 HG21 THR 19 HG21 THR 19 10.455 8.749 -6.922 135 HG22 THR 19 HG22 THR 19 11.487 7.350 -7.223 136 HG23 THR 19 HG23 THR 19 12.206 8.945 -6.998 137 H ASN 20 HN ASN 20 12.897 4.436 -5.768 138 HA ASN 20 HA ASN 20 10.564 3.752 -7.280 139 HB2 ASN 20 HB2 ASN 20 13.271 2.879 -7.119 140 HB3 ASN 20 HB1 ASN 20 12.240 1.472 -6.875 141 HD21 ASN 20 HD21 ASN 20 12.140 4.381 -8.913 142 HD22 ASN 20 HD22 ASN 20 11.842 3.539 -10.391 143 H LEU 21 HN LEU 21 8.832 2.664 -6.638 144 HA LEU 21 HA LEU 21 8.431 1.973 -3.936 145 HB2 LEU 21 HB2 LEU 21 6.743 0.925 -6.183 146 HB3 LEU 21 HB1 LEU 21 6.256 1.342 -4.552 147 HG LEU 21 HG LEU 21 7.285 3.528 -6.295 148 HD11 LEU 21 HD11 LEU 21 5.658 2.101 -7.631 149 HD12 LEU 21 HD12 LEU 21 5.281 3.815 -7.468 150 HD13 LEU 21 HD13 LEU 21 4.431 2.627 -6.479 151 HD21 LEU 21 HD21 LEU 21 5.601 3.190 -3.904 152 HD22 LEU 21 HD22 LEU 21 5.102 4.456 -5.027 153 HD23 LEU 21 HD23 LEU 21 6.724 4.479 -4.334 154 H LYS 22 HN LYS 22 10.138 0.521 -3.451 155 HA LYS 22 HA LYS 22 10.658 -1.881 -4.739 156 HB2 LYS 22 HB2 LYS 22 11.365 -0.652 -2.233 157 HB3 LYS 22 HB1 LYS 22 11.090 -2.372 -2.035 158 HG2 LYS 22 HG2 LYS 22 12.720 -1.646 -4.360 159 HG3 LYS 22 HG1 LYS 22 13.440 -1.291 -2.789 160 HD2 LYS 22 HD2 LYS 22 13.457 -3.523 -2.150 161 HD3 LYS 22 HD1 LYS 22 12.202 -3.966 -3.308 162 HE2 LYS 22 HE2 LYS 22 13.799 -3.573 -5.146 163 HE3 LYS 22 HE1 LYS 22 15.048 -3.206 -3.958 164 HZ1 LYS 22 HZ1 LYS 22 14.459 -5.671 -4.986 165 HZ2 LYS 22 HZ2 LYS 22 13.785 -5.712 -3.434 166 HZ3 LYS 22 HZ3 LYS 22 15.427 -5.357 -3.634 167 H ILE 23 HN ILE 23 10.300 -4.069 -3.722 168 HA ILE 23 HA ILE 23 7.553 -4.636 -3.812 169 HB ILE 23 HB ILE 23 10.011 -6.015 -4.042 170 HG12 ILE 23 HG12 ILE 23 7.552 -7.504 -4.549 171 HG13 ILE 23 HG11 ILE 23 7.560 -5.877 -5.211 172 HG21 ILE 23 HG21 ILE 23 8.074 -7.414 -2.210 173 HG22 ILE 23 HG22 ILE 23 9.698 -6.875 -1.794 174 HG23 ILE 23 HG23 ILE 23 9.470 -8.156 -2.985 175 HD11 ILE 23 HD11 ILE 23 9.748 -6.386 -6.270 176 HD12 ILE 23 HD12 ILE 23 8.380 -7.308 -6.884 177 HD13 ILE 23 HD13 ILE 23 9.520 -8.066 -5.776 178 H TYR 24 HN TYR 24 6.255 -5.748 -2.419 179 HA TYR 24 HA TYR 24 6.677 -5.370 0.470 180 HB2 TYR 24 HB2 TYR 24 4.376 -5.246 -1.344 181 HB3 TYR 24 HB1 TYR 24 4.095 -6.059 0.156 182 HD1 TYR 24 HD1 TYR 24 5.341 -2.817 -1.195 183 HD2 TYR 24 HD2 TYR 24 3.403 -4.860 1.975 184 HE1 TYR 24 HE1 TYR 24 4.807 -0.671 -0.138 185 HE2 TYR 24 HE2 TYR 24 2.873 -2.727 3.048 186 HH TYR 24 HH TYR 24 3.691 -0.427 3.036 187 H LYS 25 HN LYS 25 5.514 -7.289 1.676 188 HA LYS 25 HA LYS 25 5.909 -9.743 0.089 189 HB2 LYS 25 HB2 LYS 25 6.607 -9.126 2.911 190 HB3 LYS 25 HB1 LYS 25 6.196 -10.775 2.448 191 HG2 LYS 25 HG2 LYS 25 8.006 -9.978 0.516 192 HG3 LYS 25 HG1 LYS 25 8.642 -9.278 2.006 193 HD2 LYS 25 HD2 LYS 25 8.147 -11.671 2.967 194 HD3 LYS 25 HD1 LYS 25 8.231 -12.142 1.270 195 HE2 LYS 25 HE2 LYS 25 10.436 -10.484 1.659 196 HE3 LYS 25 HE1 LYS 25 10.361 -11.480 3.113 197 HZ1 LYS 25 HZ1 LYS 25 9.926 -13.251 1.095 198 HZ2 LYS 25 HZ2 LYS 25 11.396 -13.012 1.897 199 HZ3 LYS 25 HZ3 LYS 25 11.090 -12.210 0.440 200 H VAL 26 HN VAL 26 3.934 -10.514 -0.434 201 HA VAL 26 HA VAL 26 1.716 -10.001 1.284 202 HB VAL 26 HB VAL 26 1.144 -11.952 -0.776 203 HG11 VAL 26 HG11 VAL 26 -0.368 -10.572 0.596 204 HG12 VAL 26 HG12 VAL 26 -0.651 -10.447 -1.145 205 HG13 VAL 26 HG13 VAL 26 0.208 -9.166 -0.291 206 HG21 VAL 26 HG21 VAL 26 2.320 -11.097 -2.458 207 HG22 VAL 26 HG22 VAL 26 2.891 -9.771 -1.450 208 HG23 VAL 26 HG23 VAL 26 1.352 -9.636 -2.290 209 H ASP 27 HN ASP 27 2.446 -10.940 3.051 210 HA ASP 27 HA ASP 27 2.945 -13.760 3.230 211 HB2 ASP 27 HB2 ASP 27 2.997 -11.510 5.184 212 HB3 ASP 27 HB1 ASP 27 3.003 -13.149 5.799 213 H ASP 28 HN ASP 28 0.233 -11.678 3.723 214 HA ASP 28 HA ASP 28 -1.556 -13.855 3.787 215 HB2 ASP 28 HB2 ASP 28 -0.384 -13.830 6.130 216 HB3 ASP 28 HB1 ASP 28 -1.499 -12.507 6.453 217 H LEU 29 HN LEU 29 -3.295 -13.053 2.823 218 HA LEU 29 HA LEU 29 -4.307 -10.488 3.707 219 HB2 LEU 29 HB2 LEU 29 -3.788 -9.533 1.816 220 HB3 LEU 29 HB1 LEU 29 -3.329 -11.049 1.132 221 HG LEU 29 HG LEU 29 -6.211 -10.619 1.342 222 HD11 LEU 29 HD11 LEU 29 -4.438 -8.852 -0.254 223 HD12 LEU 29 HD12 LEU 29 -5.867 -8.462 0.712 224 HD13 LEU 29 HD13 LEU 29 -6.043 -9.282 -0.846 225 HD21 LEU 29 HD21 LEU 29 -6.272 -11.925 -0.524 226 HD22 LEU 29 HD22 LEU 29 -4.812 -12.487 0.291 227 HD23 LEU 29 HD23 LEU 29 -4.684 -11.387 -1.081 228 H GLN 30 HN GLN 30 -6.409 -10.346 3.951 229 HA GLN 30 HA GLN 30 -8.077 -12.672 3.298 230 HB2 GLN 30 HB2 GLN 30 -7.416 -11.487 5.875 231 HB3 GLN 30 HB1 GLN 30 -9.145 -11.521 5.594 232 HG2 GLN 30 HG2 GLN 30 -8.478 -13.498 6.761 233 HG3 GLN 30 HG1 GLN 30 -8.993 -13.927 5.128 234 HE21 GLN 30 HE21 GLN 30 -7.195 -13.822 3.516 235 HE22 GLN 30 HE22 GLN 30 -5.683 -14.500 3.984 236 H LYS 31 HN LYS 31 -10.386 -12.323 3.290 237 HA LYS 31 HA LYS 31 -11.042 -9.839 2.037 238 HB2 LYS 31 HB2 LYS 31 -12.193 -12.247 1.825 239 HB3 LYS 31 HB1 LYS 31 -13.151 -11.645 3.166 240 HG2 LYS 31 HG2 LYS 31 -13.756 -11.333 0.536 241 HG3 LYS 31 HG1 LYS 31 -14.380 -10.340 1.850 242 HD2 LYS 31 HD2 LYS 31 -12.803 -8.625 1.419 243 HD3 LYS 31 HD1 LYS 31 -11.871 -9.664 0.342 244 HE2 LYS 31 HE2 LYS 31 -13.735 -9.715 -1.235 245 HE3 LYS 31 HE1 LYS 31 -14.679 -8.689 -0.155 246 HZ1 LYS 31 HZ1 LYS 31 -13.389 -6.862 -0.619 247 HZ2 LYS 31 HZ2 LYS 31 -13.398 -7.641 -2.121 248 HZ3 LYS 31 HZ3 LYS 31 -12.050 -7.775 -1.108 249 H ILE 32 HN ILE 32 -10.771 -8.168 3.383 250 HA ILE 32 HA ILE 32 -11.727 -8.434 6.150 251 HB ILE 32 HB ILE 32 -9.412 -6.822 5.083 252 HG12 ILE 32 HG12 ILE 32 -9.697 -9.606 5.338 253 HG13 ILE 32 HG11 ILE 32 -8.247 -8.701 4.951 254 HG21 ILE 32 HG21 ILE 32 -8.609 -7.000 7.463 255 HG22 ILE 32 HG22 ILE 32 -10.284 -7.430 7.874 256 HG23 ILE 32 HG23 ILE 32 -9.933 -5.864 7.139 257 HD11 ILE 32 HD11 ILE 32 -7.493 -9.779 6.749 258 HD12 ILE 32 HD12 ILE 32 -9.102 -9.962 7.438 259 HD13 ILE 32 HD13 ILE 32 -8.253 -8.428 7.581 260 H ASN 33 HN ASN 33 -13.329 -7.214 6.739 261 HA ASN 33 HA ASN 33 -14.963 -5.644 6.746 262 HB2 ASN 33 HB2 ASN 33 -14.150 -3.263 6.683 263 HB3 ASN 33 HB1 ASN 33 -13.352 -4.293 7.864 264 HD21 ASN 33 HD21 ASN 33 -13.012 -2.512 4.917 265 HD22 ASN 33 HD22 ASN 33 -11.290 -2.610 4.820 266 H GLY 34 HN GLY 34 -14.985 -6.938 4.414 267 HA2 GLY 34 HA2 GLY 34 -16.016 -6.786 2.380 268 HA3 GLY 34 HA1 GLY 34 -16.237 -5.080 2.694 269 H ILE 35 HN ILE 35 -13.012 -5.722 3.066 270 HA ILE 35 HA ILE 35 -12.385 -5.370 0.227 271 HB ILE 35 HB ILE 35 -10.815 -3.752 2.168 272 HG12 ILE 35 HG12 ILE 35 -13.181 -3.278 2.759 273 HG13 ILE 35 HG11 ILE 35 -12.358 -1.883 2.076 274 HG21 ILE 35 HG21 ILE 35 -11.755 -3.178 -0.636 275 HG22 ILE 35 HG22 ILE 35 -10.220 -3.941 -0.223 276 HG23 ILE 35 HG23 ILE 35 -10.544 -2.283 0.282 277 HD11 ILE 35 HD11 ILE 35 -13.561 -3.266 -0.065 278 HD12 ILE 35 HD12 ILE 35 -13.981 -1.685 0.594 279 HD13 ILE 35 HD13 ILE 35 -14.758 -3.137 1.224 280 H TRP 36 HN TRP 36 -10.566 -6.452 -0.416 281 HA TRP 36 HA TRP 36 -9.462 -8.425 1.247 282 HB2 TRP 36 HB2 TRP 36 -8.402 -7.185 -1.309 283 HB3 TRP 36 HB1 TRP 36 -7.691 -8.597 -0.538 284 HD1 TRP 36 HD1 TRP 36 -10.092 -7.729 -3.142 285 HE1 TRP 36 HE1 TRP 36 -11.599 -9.730 -3.734 286 HE3 TRP 36 HE3 TRP 36 -9.022 -10.758 0.836 287 HZ2 TRP 36 HZ2 TRP 36 -12.252 -12.254 -2.655 288 HZ3 TRP 36 HZ3 TRP 36 -10.134 -12.948 0.982 289 HH2 TRP 36 HH2 TRP 36 -11.715 -13.679 -0.729 290 H GLN 37 HN GLN 37 -7.779 -8.362 2.715 291 HA GLN 37 HA GLN 37 -6.275 -5.833 2.842 292 HB2 GLN 37 HB2 GLN 37 -7.572 -5.915 4.789 293 HB3 GLN 37 HB1 GLN 37 -7.261 -7.621 5.028 294 HG2 GLN 37 HG2 GLN 37 -4.760 -6.532 5.160 295 HG3 GLN 37 HG1 GLN 37 -5.775 -5.314 5.888 296 HE21 GLN 37 HE21 GLN 37 -5.705 -8.870 5.983 297 HE22 GLN 37 HE22 GLN 37 -5.641 -8.970 7.729 298 H VAL 38 HN VAL 38 -4.101 -5.871 3.266 299 HA VAL 38 HA VAL 38 -2.875 -8.513 2.812 300 HB VAL 38 HB VAL 38 -1.697 -5.782 2.188 301 HG11 VAL 38 HG11 VAL 38 -0.874 -8.648 1.716 302 HG12 VAL 38 HG12 VAL 38 0.086 -7.292 2.303 303 HG13 VAL 38 HG13 VAL 38 -0.356 -7.388 0.596 304 HG21 VAL 38 HG21 VAL 38 -3.619 -7.489 0.743 305 HG22 VAL 38 HG22 VAL 38 -2.243 -6.948 -0.220 306 HG23 VAL 38 HG23 VAL 38 -3.279 -5.767 0.584 307 H ARG 39 HN ARG 39 -0.963 -9.117 3.743 308 HA ARG 39 HA ARG 39 0.132 -7.511 5.915 309 HB2 ARG 39 HB2 ARG 39 -0.857 -10.349 6.299 310 HB3 ARG 39 HB1 ARG 39 0.073 -9.429 7.460 311 HG2 ARG 39 HG2 ARG 39 -1.669 -8.238 8.127 312 HG3 ARG 39 HG1 ARG 39 -2.337 -8.092 6.514 313 HD2 ARG 39 HD2 ARG 39 -3.767 -9.386 8.077 314 HD3 ARG 39 HD1 ARG 39 -3.301 -10.274 6.632 315 HE ARG 39 HE ARG 39 -1.596 -11.380 8.054 316 HH11 ARG 39 HH11 ARG 39 -4.397 -9.927 9.570 317 HH12 ARG 39 HH12 ARG 39 -4.348 -10.981 10.939 318 HH21 ARG 39 HH21 ARG 39 -1.549 -12.764 9.853 319 HH22 ARG 39 HH22 ARG 39 -2.739 -12.591 11.098 320 H ASN 40 HN ASN 40 2.341 -7.902 6.285 321 HA ASN 40 HA ASN 40 3.535 -10.155 4.903 322 HB2 ASN 40 HB2 ASN 40 5.451 -8.008 5.051 323 HB3 ASN 40 HB1 ASN 40 5.042 -9.055 3.727 324 HD21 ASN 40 HD21 ASN 40 5.710 -6.238 3.842 325 HD22 ASN 40 HD22 ASN 40 4.462 -5.489 2.925 326 H ASN 41 HN ASN 41 5.321 -10.897 5.847 327 HA ASN 41 HA ASN 41 5.319 -10.947 8.595 328 HB2 ASN 41 HB2 ASN 41 7.623 -12.057 8.281 329 HB3 ASN 41 HB1 ASN 41 6.243 -12.822 7.502 330 HD21 ASN 41 HD21 ASN 41 6.855 -10.035 5.838 331 HD22 ASN 41 HD22 ASN 41 7.810 -10.654 4.577 332 H ILE 42 HN ILE 42 6.788 -8.597 6.509 333 HA ILE 42 HA ILE 42 8.855 -7.821 8.262 334 HB ILE 42 HB ILE 42 7.727 -6.327 5.935 335 HG12 ILE 42 HG12 ILE 42 10.013 -7.473 5.048 336 HG13 ILE 42 HG11 ILE 42 9.388 -8.736 6.099 337 HG21 ILE 42 HG21 ILE 42 9.085 -4.952 7.254 338 HG22 ILE 42 HG22 ILE 42 10.046 -5.441 5.862 339 HG23 ILE 42 HG23 ILE 42 10.303 -6.210 7.427 340 HD11 ILE 42 HD11 ILE 42 7.200 -8.467 4.938 341 HD12 ILE 42 HD12 ILE 42 8.507 -9.154 3.966 342 HD13 ILE 42 HD13 ILE 42 8.040 -7.469 3.753 343 H LEU 43 HN LEU 43 5.840 -6.452 7.073 344 HA LEU 43 HA LEU 43 5.849 -4.518 9.232 345 HB2 LEU 43 HB2 LEU 43 3.975 -4.656 6.893 346 HB3 LEU 43 HB1 LEU 43 4.132 -3.344 8.035 347 HG LEU 43 HG LEU 43 5.281 -2.469 6.317 348 HD11 LEU 43 HD11 LEU 43 7.420 -4.139 7.602 349 HD12 LEU 43 HD12 LEU 43 6.856 -2.568 8.155 350 HD13 LEU 43 HD13 LEU 43 7.696 -2.709 6.612 351 HD21 LEU 43 HD21 LEU 43 5.485 -5.217 5.448 352 HD22 LEU 43 HD22 LEU 43 6.929 -4.273 5.078 353 HD23 LEU 43 HD23 LEU 43 5.347 -3.731 4.505 354 H VAL 44 HN VAL 44 4.560 -7.534 8.383 355 HA VAL 44 HA VAL 44 2.692 -7.313 10.579 356 HB VAL 44 HB VAL 44 1.596 -8.438 8.104 357 HG11 VAL 44 HG11 VAL 44 -0.326 -8.577 9.264 358 HG12 VAL 44 HG12 VAL 44 -0.074 -7.019 10.048 359 HG13 VAL 44 HG13 VAL 44 0.737 -8.456 10.662 360 HG21 VAL 44 HG21 VAL 44 2.393 -6.039 7.769 361 HG22 VAL 44 HG22 VAL 44 1.120 -5.595 8.902 362 HG23 VAL 44 HG23 VAL 44 0.713 -6.395 7.383 363 HA PRO 45 HA PRO 45 5.110 -11.263 10.495 364 HB2 PRO 45 HB2 PRO 45 4.482 -10.534 13.313 365 HB3 PRO 45 HB1 PRO 45 5.942 -11.312 12.695 366 HG2 PRO 45 HG2 PRO 45 6.009 -8.792 13.324 367 HG3 PRO 45 HG1 PRO 45 6.686 -9.275 11.751 368 HD2 PRO 45 HD2 PRO 45 4.040 -8.021 12.373 369 HD3 PRO 45 HD1 PRO 45 5.155 -7.688 11.064 370 H THR 46 HN THR 46 2.325 -9.990 12.062 371 HA THR 46 HA THR 46 0.434 -11.763 11.220 372 HB THR 46 HB THR 46 1.794 -13.452 12.481 373 HG1 THR 46 HG1 THR 46 -0.799 -13.058 13.545 374 HG21 THR 46 HG21 THR 46 1.141 -13.397 15.026 375 HG22 THR 46 HG22 THR 46 1.161 -11.656 14.751 376 HG23 THR 46 HG23 THR 46 2.604 -12.616 14.426 377 H ASP 47 HN ASP 47 -1.638 -11.467 12.236 378 HA ASP 47 HA ASP 47 -3.242 -10.380 13.474 379 HB2 ASP 47 HB2 ASP 47 -1.243 -8.983 15.082 380 HB3 ASP 47 HB1 ASP 47 -2.788 -9.639 15.584 381 H PHE 48 HN PHE 48 -2.855 -9.061 11.181 382 HA PHE 48 HA PHE 48 -2.220 -6.328 11.652 383 HB2 PHE 48 HB2 PHE 48 -2.143 -7.925 9.450 384 HB3 PHE 48 HB1 PHE 48 -3.646 -7.065 9.188 385 HD1 PHE 48 HD1 PHE 48 -1.521 -4.868 10.970 386 HD2 PHE 48 HD2 PHE 48 -2.122 -6.584 7.124 387 HE1 PHE 48 HE1 PHE 48 -0.262 -3.033 9.921 388 HE2 PHE 48 HE2 PHE 48 -0.840 -4.774 6.102 389 HZ PHE 48 HZ PHE 48 0.086 -2.993 7.496 390 H THR 49 HN THR 49 -3.732 -5.171 12.680 391 HA THR 49 HA THR 49 -6.295 -5.889 13.267 392 HB THR 49 HB THR 49 -6.027 -3.035 12.643 393 HG1 THR 49 HG1 THR 49 -4.404 -4.228 14.649 394 HG21 THR 49 HG21 THR 49 -6.813 -4.600 15.057 395 HG22 THR 49 HG22 THR 49 -7.828 -3.646 13.965 396 HG23 THR 49 HG23 THR 49 -6.674 -2.840 15.031 397 H TRP 50 HN TRP 50 -7.289 -6.862 11.613 398 HA TRP 50 HA TRP 50 -7.628 -6.197 8.983 399 HB2 TRP 50 HB2 TRP 50 -9.542 -7.339 10.995 400 HB3 TRP 50 HB1 TRP 50 -9.964 -7.192 9.349 401 HD1 TRP 50 HD1 TRP 50 -6.415 -8.186 9.585 402 HE1 TRP 50 HE1 TRP 50 -6.153 -10.721 9.228 403 HE3 TRP 50 HE3 TRP 50 -11.314 -9.577 10.007 404 HZ2 TRP 50 HZ2 TRP 50 -7.802 -13.010 9.143 405 HZ3 TRP 50 HZ3 TRP 50 -11.888 -11.957 9.778 406 HH2 TRP 50 HH2 TRP 50 -10.168 -13.638 9.354 407 H VAL 51 HN VAL 51 -9.016 -4.712 11.784 408 HA VAL 51 HA VAL 51 -11.217 -3.405 10.796 409 HB VAL 51 HB VAL 51 -10.534 -3.484 13.197 410 HG11 VAL 51 HG11 VAL 51 -8.934 -1.017 12.712 411 HG12 VAL 51 HG12 VAL 51 -8.182 -2.611 12.649 412 HG13 VAL 51 HG13 VAL 51 -8.969 -2.063 14.131 413 HG21 VAL 51 HG21 VAL 51 -12.042 -1.609 11.838 414 HG22 VAL 51 HG22 VAL 51 -11.016 -0.647 12.904 415 HG23 VAL 51 HG23 VAL 51 -12.059 -1.901 13.577 416 H ASP 52 HN ASP 52 -8.031 -2.126 11.199 417 HA ASP 52 HA ASP 52 -8.388 -0.468 8.851 418 HB2 ASP 52 HB2 ASP 52 -9.251 0.816 10.733 419 HB3 ASP 52 HB1 ASP 52 -7.712 0.639 11.550 420 H ASN 53 HN ASN 53 -6.355 -2.155 10.932 421 HA ASN 53 HA ASN 53 -3.968 -0.868 9.954 422 HB2 ASN 53 HB2 ASN 53 -4.245 -3.244 11.775 423 HB3 ASN 53 HB1 ASN 53 -2.740 -2.448 11.378 424 HD21 ASN 53 HD21 ASN 53 -5.377 -0.279 11.744 425 HD22 ASN 53 HD22 ASN 53 -5.039 0.224 13.350 426 H GLY 54 HN GLY 54 -5.964 -3.261 8.993 427 HA2 GLY 54 HA2 GLY 54 -4.021 -4.799 7.629 428 HA3 GLY 54 HA1 GLY 54 -5.778 -4.909 7.519 429 H ILE 55 HN ILE 55 -3.516 -4.539 5.538 430 HA ILE 55 HA ILE 55 -4.143 -2.004 4.366 431 HB ILE 55 HB ILE 55 -2.042 -2.370 3.669 432 HG12 ILE 55 HG12 ILE 55 -2.048 -3.909 1.527 433 HG13 ILE 55 HG11 ILE 55 -3.773 -3.648 1.701 434 HG21 ILE 55 HG21 ILE 55 -1.661 -4.275 4.949 435 HG22 ILE 55 HG22 ILE 55 -0.976 -4.475 3.340 436 HG23 ILE 55 HG23 ILE 55 -2.495 -5.257 3.762 437 HD11 ILE 55 HD11 ILE 55 -3.200 -1.203 1.949 438 HD12 ILE 55 HD12 ILE 55 -3.144 -1.932 0.350 439 HD13 ILE 55 HD13 ILE 55 -1.651 -1.654 1.253 440 H ALA 56 HN ALA 56 -5.894 -1.653 3.105 441 HA ALA 56 HA ALA 56 -7.354 -3.844 2.074 442 HB1 ALA 56 HB1 ALA 56 -7.792 -1.025 2.335 443 HB2 ALA 56 HB2 ALA 56 -8.973 -2.303 2.049 444 HB3 ALA 56 HB3 ALA 56 -8.160 -1.532 0.687 445 H ALA 57 HN ALA 57 -5.939 -5.006 0.950 446 HA ALA 57 HA ALA 57 -4.065 -4.420 -0.733 447 HB1 ALA 57 HB1 ALA 57 -5.964 -6.443 -1.768 448 HB2 ALA 57 HB2 ALA 57 -5.183 -6.696 -0.205 449 HB3 ALA 57 HB3 ALA 57 -4.203 -6.499 -1.661 450 H ASP 58 HN ASP 58 -7.428 -3.992 -1.591 451 HA ASP 58 HA ASP 58 -7.208 -3.638 -4.324 452 HB2 ASP 58 HB2 ASP 58 -9.331 -3.692 -2.982 453 HB3 ASP 58 HB1 ASP 58 -8.992 -2.022 -2.587 454 H ASP 59 HN ASP 59 -6.522 -1.465 -1.706 455 HA ASP 59 HA ASP 59 -6.152 0.882 -3.191 456 HB2 ASP 59 HB2 ASP 59 -4.658 0.321 -0.660 457 HB3 ASP 59 HB1 ASP 59 -5.432 1.792 -1.189 458 H VAL 60 HN VAL 60 -4.047 -1.875 -2.554 459 HA VAL 60 HA VAL 60 -1.797 -0.383 -3.562 460 HB VAL 60 HB VAL 60 -0.435 -2.168 -2.834 461 HG11 VAL 60 HG11 VAL 60 -0.960 -2.008 -0.407 462 HG12 VAL 60 HG12 VAL 60 -2.428 -1.145 -0.882 463 HG13 VAL 60 HG13 VAL 60 -0.850 -0.476 -1.270 464 HG21 VAL 60 HG21 VAL 60 -2.681 -3.682 -3.125 465 HG22 VAL 60 HG22 VAL 60 -2.429 -3.645 -1.385 466 HG23 VAL 60 HG23 VAL 60 -1.147 -4.225 -2.455 467 H ILE 61 HN ILE 61 -0.221 -2.150 -4.691 468 HA ILE 61 HA ILE 61 -1.685 -3.398 -6.839 469 HB ILE 61 HB ILE 61 0.304 -2.158 -8.164 470 HG12 ILE 61 HG12 ILE 61 -0.822 0.007 -6.592 471 HG13 ILE 61 HG11 ILE 61 0.339 -0.950 -5.750 472 HG21 ILE 61 HG21 ILE 61 -1.450 -0.983 -9.130 473 HG22 ILE 61 HG22 ILE 61 -2.225 -0.754 -7.553 474 HG23 ILE 61 HG23 ILE 61 -2.296 -2.339 -8.361 475 HD11 ILE 61 HD11 ILE 61 1.395 -0.355 -8.278 476 HD12 ILE 61 HD12 ILE 61 1.967 0.140 -6.685 477 HD13 ILE 61 HD13 ILE 61 0.790 1.131 -7.543 478 H GLU 62 HN GLU 62 -0.968 -5.409 -6.835 479 HA GLU 62 HA GLU 62 1.477 -6.255 -5.722 480 HB2 GLU 62 HB2 GLU 62 -0.811 -7.481 -6.974 481 HB3 GLU 62 HB1 GLU 62 0.676 -8.235 -7.526 482 HG2 GLU 62 HG2 GLU 62 1.258 -8.273 -4.988 483 HG3 GLU 62 HG1 GLU 62 -0.482 -8.125 -4.788 484 H VAL 63 HN VAL 63 3.430 -6.387 -6.436 485 HA VAL 63 HA VAL 63 3.938 -5.927 -9.297 486 HB VAL 63 HB VAL 63 6.329 -5.479 -8.363 487 HG11 VAL 63 HG11 VAL 63 5.453 -3.603 -9.282 488 HG12 VAL 63 HG12 VAL 63 5.440 -3.103 -7.600 489 HG13 VAL 63 HG13 VAL 63 3.963 -3.706 -8.349 490 HG21 VAL 63 HG21 VAL 63 6.408 -4.618 -6.103 491 HG22 VAL 63 HG22 VAL 63 5.854 -6.293 -6.101 492 HG23 VAL 63 HG23 VAL 63 4.697 -4.980 -5.889 493 H THR 64 HN THR 64 5.869 -7.119 -10.185 494 HA THR 64 HA THR 64 5.813 -9.871 -9.237 495 HB THR 64 HB THR 64 6.722 -10.528 -11.261 496 HG1 THR 64 HG1 THR 64 8.091 -8.119 -11.145 497 HG21 THR 64 HG21 THR 64 4.999 -8.181 -11.605 498 HG22 THR 64 HG22 THR 64 4.858 -9.811 -12.258 499 HG23 THR 64 HG23 THR 64 5.949 -8.651 -13.013 500 H SER 65 HN SER 65 7.840 -11.055 -8.882 501 HA SER 65 HA SER 65 9.322 -10.243 -6.819 502 HB2 SER 65 HB2 SER 65 9.493 -12.341 -8.675 503 HB3 SER 65 HB1 SER 65 11.113 -11.646 -8.602 504 HG SER 65 HG SER 65 9.615 -12.299 -6.291 505 H ASN 66 HN ASN 66 9.983 -9.257 -10.150 506 HA ASN 66 HA ASN 66 12.472 -8.061 -9.484 507 HB2 ASN 66 HB2 ASN 66 11.339 -8.876 -11.810 508 HB3 ASN 66 HB1 ASN 66 11.164 -7.131 -11.882 509 HD21 ASN 66 HD21 ASN 66 13.455 -9.752 -11.585 510 HD22 ASN 66 HD22 ASN 66 14.835 -8.866 -12.131 511 H GLY 67 HN GLY 67 9.332 -7.222 -8.988 512 HA2 GLY 67 HA2 GLY 67 8.606 -5.322 -7.810 513 HA3 GLY 67 HA1 GLY 67 10.016 -4.449 -8.394 514 H THR 68 HN THR 68 8.186 -6.354 -10.608 515 HA THR 68 HA THR 68 7.640 -4.082 -12.202 516 HB THR 68 HB THR 68 7.504 -6.969 -12.485 517 HG1 THR 68 HG1 THR 68 7.806 -4.862 -14.352 518 HG21 THR 68 HG21 THR 68 5.175 -6.690 -12.820 519 HG22 THR 68 HG22 THR 68 5.938 -6.900 -14.396 520 HG23 THR 68 HG23 THR 68 5.441 -5.294 -13.857 521 H ARG 69 HN ARG 69 6.040 -2.718 -11.903 522 HA ARG 69 HA ARG 69 3.817 -3.317 -10.210 523 HB2 ARG 69 HB2 ARG 69 4.928 -0.969 -11.507 524 HB3 ARG 69 HB1 ARG 69 3.171 -0.992 -11.598 525 HG2 ARG 69 HG2 ARG 69 3.219 -1.460 -9.091 526 HG3 ARG 69 HG1 ARG 69 4.916 -0.979 -9.162 527 HD2 ARG 69 HD2 ARG 69 3.504 0.901 -8.536 528 HD3 ARG 69 HD1 ARG 69 4.269 1.178 -10.099 529 HE ARG 69 HE ARG 69 1.623 0.044 -10.249 530 HH11 ARG 69 HH11 ARG 69 3.491 2.991 -10.112 531 HH12 ARG 69 HH12 ARG 69 2.258 3.953 -10.854 532 HH21 ARG 69 HH21 ARG 69 0.000 1.312 -11.223 533 HH22 ARG 69 HH22 ARG 69 0.277 3.002 -11.483 534 H THR 70 HN THR 70 1.746 -3.792 -10.684 535 HA THR 70 HA THR 70 0.697 -3.620 -13.345 536 HB THR 70 HB THR 70 1.867 -5.621 -13.780 537 HG1 THR 70 HG1 THR 70 -0.671 -6.501 -12.882 538 HG21 THR 70 HG21 THR 70 0.837 -6.849 -11.240 539 HG22 THR 70 HG22 THR 70 2.438 -6.128 -11.402 540 HG23 THR 70 HG23 THR 70 1.997 -7.528 -12.381 541 H SER 71 HN SER 71 -1.086 -2.592 -12.619 542 HA SER 71 HA SER 71 -2.573 -3.623 -10.341 543 HB2 SER 71 HB2 SER 71 -2.168 -1.136 -10.851 544 HB3 SER 71 HB1 SER 71 -3.400 -1.316 -12.098 545 HG SER 71 HG SER 71 -4.631 -2.303 -10.187 546 H ASP 72 HN ASP 72 -2.721 -3.642 -13.808 547 HA ASP 72 HA ASP 72 -5.384 -4.039 -14.338 548 HB2 ASP 72 HB2 ASP 72 -4.565 -5.469 -16.276 549 HB3 ASP 72 HB1 ASP 72 -3.896 -3.844 -16.171 550 H GLN 73 HN GLN 73 -3.128 -6.269 -12.880 551 HA GLN 73 HA GLN 73 -4.879 -8.554 -13.168 552 HB2 GLN 73 HB2 GLN 73 -3.181 -9.773 -11.939 553 HB3 GLN 73 HB1 GLN 73 -2.432 -8.810 -13.206 554 HG2 GLN 73 HG2 GLN 73 -1.012 -8.261 -11.557 555 HG3 GLN 73 HG1 GLN 73 -2.260 -7.077 -11.172 556 HE21 GLN 73 HE21 GLN 73 -2.337 -6.938 -9.045 557 HE22 GLN 73 HE22 GLN 73 -2.436 -8.266 -7.946 558 H VAL 74 HN VAL 74 -5.004 -9.904 -10.964 559 HA VAL 74 HA VAL 74 -6.400 -8.160 -9.039 560 HB VAL 74 HB VAL 74 -6.780 -11.137 -9.343 561 HG11 VAL 74 HG11 VAL 74 -8.442 -8.982 -8.041 562 HG12 VAL 74 HG12 VAL 74 -7.501 -10.227 -7.216 563 HG13 VAL 74 HG13 VAL 74 -8.905 -10.678 -8.186 564 HG21 VAL 74 HG21 VAL 74 -8.695 -9.126 -10.459 565 HG22 VAL 74 HG22 VAL 74 -8.515 -10.836 -10.849 566 HG23 VAL 74 HG23 VAL 74 -7.319 -9.672 -11.416 567 H LEU 75 HN LEU 75 -5.522 -7.927 -7.085 568 HA LEU 75 HA LEU 75 -3.094 -9.042 -6.324 569 HB2 LEU 75 HB2 LEU 75 -4.738 -7.107 -5.342 570 HB3 LEU 75 HB1 LEU 75 -4.816 -8.315 -4.081 571 HG LEU 75 HG LEU 75 -2.151 -7.479 -5.122 572 HD11 LEU 75 HD11 LEU 75 -2.702 -5.920 -2.846 573 HD12 LEU 75 HD12 LEU 75 -4.037 -5.668 -3.972 574 HD13 LEU 75 HD13 LEU 75 -2.378 -5.371 -4.490 575 HD21 LEU 75 HD21 LEU 75 -3.295 -8.726 -2.680 576 HD22 LEU 75 HD22 LEU 75 -1.823 -7.767 -2.519 577 HD23 LEU 75 HD23 LEU 75 -1.856 -9.157 -3.603 578 H GLN 76 HN GLN 76 -2.483 -10.546 -4.867 579 HA GLN 76 HA GLN 76 -4.331 -12.300 -3.558 580 HB2 GLN 76 HB2 GLN 76 -2.485 -13.472 -5.643 581 HB3 GLN 76 HB1 GLN 76 -3.619 -14.351 -4.629 582 HG2 GLN 76 HG2 GLN 76 -5.401 -12.854 -5.769 583 HG3 GLN 76 HG1 GLN 76 -4.154 -12.610 -6.991 584 HE21 GLN 76 HE21 GLN 76 -5.745 -15.197 -5.166 585 HE22 GLN 76 HE22 GLN 76 -5.801 -16.323 -6.475 586 H LYS 77 HN LYS 77 -3.424 -13.063 -1.746 587 HA LYS 77 HA LYS 77 -0.788 -12.219 -1.076 588 HB2 LYS 77 HB2 LYS 77 -1.176 -12.783 1.085 589 HB3 LYS 77 HB1 LYS 77 -2.797 -12.418 0.510 590 HG2 LYS 77 HG2 LYS 77 -1.948 -15.242 0.324 591 HG3 LYS 77 HG1 LYS 77 -2.190 -14.596 1.945 592 HD2 LYS 77 HD2 LYS 77 -4.441 -13.988 1.434 593 HD3 LYS 77 HD1 LYS 77 -4.222 -14.384 -0.269 594 HE2 LYS 77 HE2 LYS 77 -3.523 -16.661 1.293 595 HE3 LYS 77 HE1 LYS 77 -5.088 -16.065 1.845 596 HZ1 LYS 77 HZ1 LYS 77 -5.316 -15.959 -0.847 597 HZ2 LYS 77 HZ2 LYS 77 -5.895 -17.213 0.130 598 HZ3 LYS 77 HZ3 LYS 77 -4.389 -17.358 -0.625 599 H GLY 78 HN GLY 78 0.951 -13.413 -0.351 600 HA2 GLY 78 HA2 GLY 78 1.901 -15.651 0.002 601 HA3 GLY 78 HA1 GLY 78 1.032 -16.152 -1.445 602 H GLY 79 HN GLY 79 2.359 -12.968 -1.516 603 HA2 GLY 79 HA2 GLY 79 4.855 -13.945 -2.695 604 HA3 GLY 79 HA1 GLY 79 3.744 -13.159 -3.800 605 H TYR 80 HN TYR 80 3.834 -11.061 -4.009 606 HA TYR 80 HA TYR 80 4.890 -9.340 -1.955 607 HB2 TYR 80 HB2 TYR 80 6.162 -9.116 -4.660 608 HB3 TYR 80 HB1 TYR 80 6.743 -8.515 -3.119 609 HD1 TYR 80 HD1 TYR 80 6.426 -11.506 -5.242 610 HD2 TYR 80 HD2 TYR 80 8.094 -9.873 -1.684 611 HE1 TYR 80 HE1 TYR 80 7.891 -13.472 -5.033 612 HE2 TYR 80 HE2 TYR 80 9.562 -11.833 -1.464 613 HH TYR 80 HH TYR 80 10.534 -13.626 -3.348 614 H PHE 81 HN PHE 81 4.604 -7.057 -2.543 615 HA PHE 81 HA PHE 81 3.040 -6.494 -4.888 616 HB2 PHE 81 HB2 PHE 81 1.189 -5.365 -3.644 617 HB3 PHE 81 HB1 PHE 81 1.185 -7.115 -3.529 618 HD1 PHE 81 HD2 PHE 81 2.710 -7.968 -1.472 619 HD2 PHE 81 HD1 PHE 81 0.677 -4.217 -1.721 620 HE1 PHE 81 HE2 PHE 81 2.607 -7.840 0.994 621 HE2 PHE 81 HE1 PHE 81 0.577 -4.092 0.703 622 HZ PHE 81 HZ PHE 81 1.544 -5.899 2.083 623 H VAL 82 HN VAL 82 2.310 -4.166 -4.809 624 HA VAL 82 HA VAL 82 4.264 -2.559 -3.353 625 HB VAL 82 HB VAL 82 4.190 -3.028 -6.226 626 HG11 VAL 82 HG11 VAL 82 3.471 -1.018 -6.923 627 HG12 VAL 82 HG12 VAL 82 5.005 -0.396 -6.321 628 HG13 VAL 82 HG13 VAL 82 3.569 -0.316 -5.308 629 HG21 VAL 82 HG21 VAL 82 6.264 -1.442 -4.773 630 HG22 VAL 82 HG22 VAL 82 6.455 -2.608 -6.082 631 HG23 VAL 82 HG23 VAL 82 6.082 -3.166 -4.452 632 H ILE 83 HN ILE 83 3.279 -0.943 -2.382 633 HA ILE 83 HA ILE 83 0.487 -0.550 -2.707 634 HB ILE 83 HB ILE 83 2.587 0.904 -1.199 635 HG12 ILE 83 HG12 ILE 83 1.945 -0.261 0.670 636 HG13 ILE 83 HG11 ILE 83 0.279 -0.391 0.133 637 HG21 ILE 83 HG21 ILE 83 -0.248 1.641 -1.578 638 HG22 ILE 83 HG22 ILE 83 1.182 2.666 -1.493 639 HG23 ILE 83 HG23 ILE 83 0.519 1.956 -0.023 640 HD11 ILE 83 HD11 ILE 83 2.560 -1.991 -0.987 641 HD12 ILE 83 HD12 ILE 83 0.847 -2.202 -1.327 642 HD13 ILE 83 HD13 ILE 83 1.476 -2.539 0.284 643 H ASN 84 HN ASN 84 -0.354 0.497 -4.374 644 HA ASN 84 HA ASN 84 0.999 2.199 -6.079 645 HB2 ASN 84 HB2 ASN 84 -1.601 1.217 -5.865 646 HB3 ASN 84 HB1 ASN 84 -1.780 2.957 -5.793 647 HD21 ASN 84 HD21 ASN 84 0.166 3.832 -7.448 648 HD22 ASN 84 HD22 ASN 84 -0.152 3.297 -9.055 649 HA PRO 85 HA PRO 85 1.509 5.665 -3.178 650 HB2 PRO 85 HB2 PRO 85 2.741 7.308 -4.929 651 HB3 PRO 85 HB1 PRO 85 3.596 5.934 -4.203 652 HG2 PRO 85 HG2 PRO 85 2.112 6.025 -6.827 653 HG3 PRO 85 HG1 PRO 85 3.783 5.563 -6.543 654 HD2 PRO 85 HD2 PRO 85 2.007 3.666 -6.731 655 HD3 PRO 85 HD1 PRO 85 3.174 3.594 -5.387 656 H ASN 86 HN ASN 86 0.209 5.580 -6.315 657 HA ASN 86 HA ASN 86 -1.014 8.110 -6.230 658 HB2 ASN 86 HB2 ASN 86 -0.903 5.856 -8.102 659 HB3 ASN 86 HB1 ASN 86 -2.427 6.724 -8.126 660 HD21 ASN 86 HD21 ASN 86 0.973 7.656 -7.769 661 HD22 ASN 86 HD22 ASN 86 0.955 8.851 -9.018 662 H ASN 87 HN ASN 87 -1.861 4.949 -5.168 663 HA ASN 87 HA ASN 87 -4.645 5.576 -4.674 664 HB2 ASN 87 HB2 ASN 87 -3.309 3.219 -4.927 665 HB3 ASN 87 HB1 ASN 87 -3.352 3.458 -3.182 666 HD21 ASN 87 HD21 ASN 87 -5.040 2.478 -5.910 667 HD22 ASN 87 HD22 ASN 87 -6.585 2.215 -5.179 668 H VAL 88 HN VAL 88 -1.759 6.442 -3.482 669 HA VAL 88 HA VAL 88 -2.463 6.442 -0.739 670 HB VAL 88 HB VAL 88 0.074 6.885 -2.249 671 HG11 VAL 88 HG11 VAL 88 0.724 6.797 0.399 672 HG12 VAL 88 HG12 VAL 88 -0.828 7.652 0.440 673 HG13 VAL 88 HG13 VAL 88 0.507 8.284 -0.530 674 HG21 VAL 88 HG21 VAL 88 0.115 4.939 -0.165 675 HG22 VAL 88 HG22 VAL 88 0.281 4.700 -1.922 676 HG23 VAL 88 HG23 VAL 88 -1.322 4.686 -1.166 677 H LYS 89 HN LYS 89 -2.947 8.050 0.222 678 HA LYS 89 HA LYS 89 -2.972 10.690 -0.972 679 HB2 LYS 89 HB2 LYS 89 -4.146 9.776 1.627 680 HB3 LYS 89 HB1 LYS 89 -4.413 11.330 0.866 681 HG2 LYS 89 HG2 LYS 89 -6.279 9.795 0.625 682 HG3 LYS 89 HG1 LYS 89 -5.604 10.283 -0.915 683 HD2 LYS 89 HD2 LYS 89 -4.510 7.832 0.227 684 HD3 LYS 89 HD1 LYS 89 -6.212 7.773 -0.204 685 HE2 LYS 89 HE2 LYS 89 -3.864 7.733 -1.878 686 HE3 LYS 89 HE1 LYS 89 -5.512 7.267 -2.247 687 HZ1 LYS 89 HZ1 LYS 89 -6.012 9.666 -2.572 688 HZ2 LYS 89 HZ2 LYS 89 -4.920 9.031 -3.695 689 HZ3 LYS 89 HZ3 LYS 89 -4.357 9.991 -2.422 690 H SER 90 HN SER 90 -1.777 8.822 1.657 691 HA SER 90 HA SER 90 0.612 10.301 1.962 692 HB2 SER 90 HB2 SER 90 0.267 11.844 3.658 693 HB3 SER 90 HB1 SER 90 -1.237 11.969 2.748 694 HG SER 90 HG SER 90 -0.776 10.611 5.182 695 H VAL 91 HN VAL 91 1.668 9.985 4.164 696 HA VAL 91 HA VAL 91 1.016 7.361 5.249 697 HB VAL 91 HB VAL 91 3.562 7.938 6.109 698 HG11 VAL 91 HG11 VAL 91 3.321 5.779 5.484 699 HG12 VAL 91 HG12 VAL 91 4.084 6.358 4.001 700 HG13 VAL 91 HG13 VAL 91 2.327 6.189 4.087 701 HG21 VAL 91 HG21 VAL 91 3.261 8.922 3.283 702 HG22 VAL 91 HG22 VAL 91 4.807 8.457 3.993 703 HG23 VAL 91 HG23 VAL 91 3.896 9.805 4.672 704 H GLY 92 HN GLY 92 0.232 7.446 7.263 705 HA2 GLY 92 HA2 GLY 92 0.261 9.937 8.680 706 HA3 GLY 92 HA1 GLY 92 -0.764 8.555 9.010 707 H THR 93 HN THR 93 -0.013 9.585 11.035 708 HA THR 93 HA THR 93 2.529 9.024 12.194 709 HB THR 93 HB THR 93 -0.035 10.167 13.002 710 HG1 THR 93 HG1 THR 93 1.363 11.477 14.188 711 HG21 THR 93 HG21 THR 93 0.431 9.843 15.440 712 HG22 THR 93 HG22 THR 93 1.478 8.502 14.968 713 HG23 THR 93 HG23 THR 93 -0.243 8.455 14.586 714 HA PRO 94 HA PRO 94 2.219 4.821 13.092 715 HB2 PRO 94 HB2 PRO 94 4.472 4.614 14.394 716 HB3 PRO 94 HB1 PRO 94 4.474 5.209 12.725 717 HG2 PRO 94 HG2 PRO 94 4.464 6.840 15.229 718 HG3 PRO 94 HG1 PRO 94 5.628 6.899 13.897 719 HD2 PRO 94 HD2 PRO 94 3.552 8.570 14.030 720 HD3 PRO 94 HD1 PRO 94 4.153 7.932 12.483 721 H MET 95 HN MET 95 2.001 3.375 14.764 722 HA MET 95 HA MET 95 1.736 4.305 17.495 723 HB2 MET 95 HB2 MET 95 -0.609 3.118 16.002 724 HB3 MET 95 HB1 MET 95 -0.548 3.353 17.744 725 HG2 MET 95 HG2 MET 95 -0.288 5.775 17.379 726 HG3 MET 95 HG1 MET 95 -0.444 5.506 15.644 727 HE1 MET 95 HE1 MET 95 -3.660 4.502 18.725 728 HE2 MET 95 HE2 MET 95 -2.770 5.997 19.011 729 HE3 MET 95 HE3 MET 95 -1.908 4.460 18.931 730 H LYS 96 HN LYS 96 2.193 2.699 18.963 731 HA LYS 96 HA LYS 96 3.095 0.183 17.845 732 HB2 LYS 96 HB2 LYS 96 3.196 1.321 20.640 733 HB3 LYS 96 HB1 LYS 96 3.793 -0.280 20.232 734 HG2 LYS 96 HG2 LYS 96 5.733 0.577 19.609 735 HG3 LYS 96 HG1 LYS 96 4.924 1.590 18.412 736 HD2 LYS 96 HD2 LYS 96 4.368 3.036 20.567 737 HD3 LYS 96 HD1 LYS 96 5.829 2.246 21.165 738 HE2 LYS 96 HE2 LYS 96 7.181 3.307 19.666 739 HE3 LYS 96 HE1 LYS 96 5.917 3.423 18.443 740 HZ1 LYS 96 HZ1 LYS 96 6.535 5.583 19.408 741 HZ2 LYS 96 HZ2 LYS 96 6.010 5.050 20.925 742 HZ3 LYS 96 HZ3 LYS 96 4.903 5.209 19.657 743 H GLY 97 HN GLY 97 1.899 -1.650 17.759 744 HA2 GLY 97 HA2 GLY 97 0.120 -2.370 19.868 745 HA3 GLY 97 HA1 GLY 97 -0.776 -1.738 18.500 746 H SER 98 HN SER 98 0.156 -2.789 16.315 747 HA SER 98 HA SER 98 -0.677 -5.455 16.363 748 HB2 SER 98 HB2 SER 98 0.585 -3.671 14.358 749 HB3 SER 98 HB1 SER 98 0.718 -5.382 14.046 750 HG SER 98 HG SER 98 -1.653 -3.884 14.433 751 H GLY 99 HN GLY 99 0.716 -6.147 18.235 752 HA2 GLY 99 HA2 GLY 99 2.242 -7.984 18.515 753 HA3 GLY 99 HA1 GLY 99 3.199 -7.338 17.194 754 H GLY 100 HN GLY 100 3.610 -4.732 17.918 755 HA2 GLY 100 HA2 GLY 100 4.157 -3.920 20.411 756 HA3 GLY 100 HA1 GLY 100 5.443 -5.065 20.096 757 H LEU 101 HN LEU 101 5.181 -4.126 17.161 758 HA LEU 101 HA LEU 101 7.307 -2.272 17.185 759 HB2 LEU 101 HB2 LEU 101 5.670 -2.773 14.812 760 HB3 LEU 101 HB1 LEU 101 7.392 -2.637 14.988 761 HG LEU 101 HG LEU 101 7.216 -4.947 16.161 762 HD11 LEU 101 HD11 LEU 101 4.650 -4.903 16.055 763 HD12 LEU 101 HD12 LEU 101 5.442 -6.340 15.418 764 HD13 LEU 101 HD13 LEU 101 4.857 -5.092 14.322 765 HD21 LEU 101 HD21 LEU 101 6.655 -4.882 13.275 766 HD22 LEU 101 HD22 LEU 101 7.869 -5.812 14.166 767 HD23 LEU 101 HD23 LEU 101 8.083 -4.072 13.920 768 H SER 102 HN SER 102 6.511 -0.946 14.875 769 HA SER 102 HA SER 102 4.585 1.007 15.878 770 HB2 SER 102 HB2 SER 102 7.258 1.268 14.691 771 HB3 SER 102 HB1 SER 102 6.034 2.403 14.096 772 HG SER 102 HG SER 102 6.063 2.116 16.828 773 H TRP 103 HN TRP 103 2.829 1.024 14.745 774 HA TRP 103 HA TRP 103 2.822 0.276 11.934 775 HB2 TRP 103 HB2 TRP 103 0.713 -0.173 14.024 776 HB3 TRP 103 HB1 TRP 103 0.632 -0.650 12.357 777 HD1 TRP 103 HD1 TRP 103 3.345 -1.106 15.027 778 HE1 TRP 103 HE1 TRP 103 4.210 -3.467 14.915 779 HE3 TRP 103 HE3 TRP 103 0.229 -3.021 11.462 780 HZ2 TRP 103 HZ2 TRP 103 3.662 -5.893 13.570 781 HZ3 TRP 103 HZ3 TRP 103 0.484 -5.369 10.827 782 HH2 TRP 103 HH2 TRP 103 2.152 -6.777 11.876 783 H ALA 104 HN ALA 104 2.334 1.953 10.754 784 HA ALA 104 HA ALA 104 0.972 4.221 11.956 785 HB1 ALA 104 HB1 ALA 104 3.199 4.722 11.224 786 HB2 ALA 104 HB2 ALA 104 2.014 5.633 10.288 787 HB3 ALA 104 HB3 ALA 104 2.787 4.213 9.586 788 H GLN 105 HN GLN 105 -0.511 5.408 11.073 789 HA GLN 105 HA GLN 105 -2.383 4.076 9.444 790 HB2 GLN 105 HB2 GLN 105 -2.699 5.748 11.431 791 HB3 GLN 105 HB1 GLN 105 -2.575 6.953 10.165 792 HG2 GLN 105 HG2 GLN 105 -4.426 6.148 9.055 793 HG3 GLN 105 HG1 GLN 105 -4.413 4.645 9.965 794 HE21 GLN 105 HE21 GLN 105 -6.689 5.128 10.324 795 HE22 GLN 105 HE22 GLN 105 -7.136 6.202 11.601 796 H VAL 106 HN VAL 106 -1.852 3.980 7.222 797 HA VAL 106 HA VAL 106 -0.879 6.460 6.062 798 HB VAL 106 HB VAL 106 -0.767 3.592 5.184 799 HG11 VAL 106 HG11 VAL 106 -1.448 4.653 3.199 800 HG12 VAL 106 HG12 VAL 106 0.304 4.465 3.085 801 HG13 VAL 106 HG13 VAL 106 -0.401 6.033 3.479 802 HG21 VAL 106 HG21 VAL 106 1.650 4.318 4.879 803 HG22 VAL 106 HG22 VAL 106 1.047 4.232 6.538 804 HG23 VAL 106 HG23 VAL 106 1.198 5.803 5.725 805 H ASN 107 HN ASN 107 -2.014 7.550 4.611 806 HA ASN 107 HA ASN 107 -4.848 7.061 4.523 807 HB2 ASN 107 HB2 ASN 107 -3.257 9.319 4.630 808 HB3 ASN 107 HB1 ASN 107 -3.770 9.306 2.952 809 HD21 ASN 107 HD21 ASN 107 -5.376 8.387 5.979 810 HD22 ASN 107 HD22 ASN 107 -6.745 9.418 5.762 811 H PHE 108 HN PHE 108 -5.350 5.528 3.056 812 HA PHE 108 HA PHE 108 -4.271 5.678 0.419 813 HB2 PHE 108 HB2 PHE 108 -5.663 3.525 1.997 814 HB3 PHE 108 HB1 PHE 108 -5.586 3.442 0.259 815 HD1 PHE 108 HD2 PHE 108 -3.456 3.662 3.273 816 HD2 PHE 108 HD1 PHE 108 -3.773 2.424 -0.780 817 HE1 PHE 108 HE2 PHE 108 -1.313 2.470 3.472 818 HE2 PHE 108 HE1 PHE 108 -1.648 1.213 -0.583 819 HZ PHE 108 HZ PHE 108 -0.408 1.241 1.544 820 H THR 109 HN THR 109 -5.676 5.384 -1.269 821 HA THR 109 HA THR 109 -7.812 7.103 -1.411 822 HB THR 109 HB THR 109 -6.252 5.676 -3.160 823 HG1 THR 109 HG1 THR 109 -6.705 7.410 -4.220 824 HG21 THR 109 HG21 THR 109 -7.466 4.340 -4.442 825 HG22 THR 109 HG22 THR 109 -8.912 5.341 -4.282 826 HG23 THR 109 HG23 THR 109 -8.482 4.206 -3.007 827 H THR 110 HN THR 110 -8.020 3.631 -1.775 828 HA THR 110 HA THR 110 -10.888 3.672 -1.421 829 HB THR 110 HB THR 110 -9.740 1.041 -1.489 830 HG1 THR 110 HG1 THR 110 -9.139 2.571 -3.773 831 HG21 THR 110 HG21 THR 110 -10.963 1.310 -3.867 832 HG22 THR 110 HG22 THR 110 -11.763 2.580 -2.942 833 HG23 THR 110 HG23 THR 110 -11.795 0.914 -2.363 834 H GLY 111 HN GLY 111 -8.061 2.449 0.151 835 HA2 GLY 111 HA2 GLY 111 -9.528 1.326 2.321 836 HA3 GLY 111 HA1 GLY 111 -7.787 1.455 2.212 837 H GLY 112 HN GLY 112 -8.933 4.489 1.529 838 HA2 GLY 112 HA2 GLY 112 -8.723 6.441 2.752 839 HA3 GLY 112 HA1 GLY 112 -9.813 5.616 3.856 840 H ASN 113 HN ASN 113 -8.973 4.578 5.673 841 HA ASN 113 HA ASN 113 -6.246 5.377 6.360 842 HB2 ASN 113 HB2 ASN 113 -7.053 4.272 8.607 843 HB3 ASN 113 HB1 ASN 113 -7.596 5.890 8.205 844 HD21 ASN 113 HD21 ASN 113 -8.567 2.679 7.134 845 HD22 ASN 113 HD22 ASN 113 -10.233 2.826 7.582 846 H VAL 114 HN VAL 114 -4.646 3.868 6.411 847 HA VAL 114 HA VAL 114 -5.299 1.033 6.514 848 HB VAL 114 HB VAL 114 -3.425 2.004 4.396 849 HG11 VAL 114 HG11 VAL 114 -4.899 -0.577 4.808 850 HG12 VAL 114 HG12 VAL 114 -3.187 -0.290 5.126 851 HG13 VAL 114 HG13 VAL 114 -3.800 -0.238 3.471 852 HG21 VAL 114 HG21 VAL 114 -5.648 2.951 3.912 853 HG22 VAL 114 HG22 VAL 114 -6.337 1.331 4.002 854 HG23 VAL 114 HG23 VAL 114 -5.181 1.728 2.730 855 H TRP 115 HN TRP 115 -4.043 0.334 8.105 856 HA TRP 115 HA TRP 115 -1.647 1.845 8.668 857 HB2 TRP 115 HB2 TRP 115 -2.989 -0.293 10.262 858 HB3 TRP 115 HB1 TRP 115 -1.534 0.543 10.755 859 HD1 TRP 115 HD1 TRP 115 -5.124 1.411 9.712 860 HE1 TRP 115 HE1 TRP 115 -5.838 3.366 11.150 861 HE3 TRP 115 HE3 TRP 115 -0.762 2.251 12.158 862 HZ2 TRP 115 HZ2 TRP 115 -4.721 5.094 12.983 863 HZ3 TRP 115 HZ3 TRP 115 -0.657 4.130 13.766 864 HH2 TRP 115 HH2 TRP 115 -2.621 5.533 14.175 865 H LEU 116 HN LEU 116 0.308 0.934 9.180 866 HA LEU 116 HA LEU 116 0.913 -1.718 8.215 867 HB2 LEU 116 HB2 LEU 116 1.044 0.406 6.472 868 HB3 LEU 116 HB1 LEU 116 2.686 0.323 7.105 869 HG LEU 116 HG LEU 116 2.194 -2.300 6.513 870 HD11 LEU 116 HD11 LEU 116 0.797 -2.603 4.765 871 HD12 LEU 116 HD12 LEU 116 1.147 -1.019 4.071 872 HD13 LEU 116 HD13 LEU 116 0.025 -1.161 5.427 873 HD21 LEU 116 HD21 LEU 116 4.114 -0.767 5.933 874 HD22 LEU 116 HD22 LEU 116 3.209 -0.337 4.491 875 HD23 LEU 116 HD23 LEU 116 3.719 -2.006 4.745 876 H ASN 117 HN ASN 117 2.848 -2.464 9.150 877 HA ASN 117 HA ASN 117 3.658 -0.948 11.387 878 HB2 ASN 117 HB2 ASN 117 4.146 -2.930 11.941 879 HB3 ASN 117 HB1 ASN 117 4.429 -3.503 10.315 880 HD21 ASN 117 HD21 ASN 117 5.756 -2.527 13.246 881 HD22 ASN 117 HD22 ASN 117 7.429 -2.621 12.825 882 H THR 118 HN THR 118 4.230 0.685 11.101 883 HA THR 118 HA THR 118 5.660 1.809 8.941 884 HB THR 118 HB THR 118 3.824 2.790 10.302 885 HG1 THR 118 HG1 THR 118 4.776 4.912 10.168 886 HG21 THR 118 HG21 THR 118 5.664 4.030 12.173 887 HG22 THR 118 HG22 THR 118 5.443 2.301 12.428 888 HG23 THR 118 HG23 THR 118 4.044 3.372 12.424 889 H THR 119 HN THR 119 6.983 -0.091 11.017 890 HA THR 119 HA THR 119 9.027 1.436 12.234 891 HB THR 119 HB THR 119 8.465 -0.966 12.746 892 HG1 THR 119 HG1 THR 119 10.578 -1.451 13.289 893 HG21 THR 119 HG21 THR 119 8.769 -1.540 10.173 894 HG22 THR 119 HG22 THR 119 9.061 -2.719 11.451 895 HG23 THR 119 HG23 THR 119 10.415 -1.861 10.716 896 H SER 120 HN SER 120 8.492 1.956 9.259 897 HA SER 120 HA SER 120 11.028 2.721 8.507 898 HB2 SER 120 HB2 SER 120 10.147 0.044 7.586 899 HB3 SER 120 HB1 SER 120 10.753 1.123 6.328 900 HG SER 120 HG SER 120 12.255 -0.326 7.697 901 H LYS 121 HN LYS 121 10.600 4.445 7.259 902 HA LYS 121 HA LYS 121 7.921 4.970 6.427 903 HB2 LYS 121 HB2 LYS 121 8.639 7.124 6.067 904 HB3 LYS 121 HB1 LYS 121 9.775 6.552 7.279 905 HG2 LYS 121 HG2 LYS 121 11.546 6.620 5.858 906 HG3 LYS 121 HG1 LYS 121 10.571 6.256 4.436 907 HD2 LYS 121 HD2 LYS 121 9.556 8.637 4.956 908 HD3 LYS 121 HD1 LYS 121 11.118 8.865 5.745 909 HE2 LYS 121 HE2 LYS 121 12.262 8.839 3.789 910 HE3 LYS 121 HE1 LYS 121 11.178 7.663 3.048 911 HZ1 LYS 121 HZ1 LYS 121 9.812 9.270 2.269 912 HZ2 LYS 121 HZ2 LYS 121 11.233 10.187 2.315 913 HZ3 LYS 121 HZ3 LYS 121 10.098 10.323 3.563 914 H ASP 122 HN ASP 122 10.958 4.099 4.933 915 HA ASP 122 HA ASP 122 10.016 4.125 2.261 916 HB2 ASP 122 HB2 ASP 122 12.306 2.735 3.622 917 HB3 ASP 122 HB1 ASP 122 11.999 2.601 1.896 918 H ASN 123 HN ASN 123 9.118 2.369 4.930 919 HA ASN 123 HA ASN 123 8.913 -0.236 3.951 920 HB2 ASN 123 HB2 ASN 123 8.632 0.004 6.317 921 HB3 ASN 123 HB1 ASN 123 7.508 1.333 6.087 922 HD21 ASN 123 HD21 ASN 123 7.359 -1.463 4.124 923 HD22 ASN 123 HD22 ASN 123 5.846 -1.961 4.684 924 H LEU 124 HN LEU 124 6.423 2.197 4.188 925 HA LEU 124 HA LEU 124 4.622 0.753 2.595 926 HB2 LEU 124 HB2 LEU 124 4.391 3.662 2.466 927 HB3 LEU 124 HB1 LEU 124 3.176 2.462 2.861 928 HG LEU 124 HG LEU 124 3.521 3.857 4.736 929 HD11 LEU 124 HD11 LEU 124 4.567 2.115 6.367 930 HD12 LEU 124 HD12 LEU 124 4.642 1.073 4.943 931 HD13 LEU 124 HD13 LEU 124 3.089 1.694 5.506 932 HD21 LEU 124 HD21 LEU 124 6.116 3.408 5.615 933 HD22 LEU 124 HD22 LEU 124 5.485 4.896 4.906 934 HD23 LEU 124 HD23 LEU 124 6.277 3.690 3.876 935 H LEU 125 HN LEU 125 6.557 3.580 1.907 936 HA LEU 125 HA LEU 125 6.051 3.712 -0.813 937 HB2 LEU 125 HB2 LEU 125 8.417 4.547 0.837 938 HB3 LEU 125 HB1 LEU 125 8.246 4.938 -0.845 939 HG LEU 125 HG LEU 125 6.011 6.033 -0.161 940 HD11 LEU 125 HD11 LEU 125 7.034 5.053 2.330 941 HD12 LEU 125 HD12 LEU 125 5.466 5.787 1.975 942 HD13 LEU 125 HD13 LEU 125 6.842 6.809 2.397 943 HD21 LEU 125 HD21 LEU 125 8.744 7.102 0.501 944 HD22 LEU 125 HD22 LEU 125 7.287 8.085 0.655 945 HD23 LEU 125 HD23 LEU 125 7.750 7.433 -0.917 946 H TYR 126 HN TYR 126 8.696 2.083 0.925 947 HA TYR 126 HA TYR 126 9.485 0.878 -1.655 948 HB2 TYR 126 HB2 TYR 126 10.957 1.997 0.598 949 HB3 TYR 126 HB1 TYR 126 11.544 0.417 0.125 950 HD1 TYR 126 HD2 TYR 126 10.602 3.700 -1.339 951 HD2 TYR 126 HD1 TYR 126 13.143 0.299 -1.560 952 HE1 TYR 126 HE2 TYR 126 11.872 4.773 -3.151 953 HE2 TYR 126 HE1 TYR 126 14.424 1.362 -3.371 954 HH TYR 126 HH TYR 126 14.388 4.511 -4.044 955 H GLY 127 HN GLY 127 8.647 0.213 1.699 956 HA2 GLY 127 HA2 GLY 127 7.644 -1.929 2.272 957 HA3 GLY 127 HA1 GLY 127 8.514 -2.658 0.933 958 H LYS 128 HN LYS 128 10.117 -0.408 2.998 959 HA LYS 128 HA LYS 128 12.071 -2.313 3.728 960 HB2 LYS 128 HB2 LYS 128 11.563 0.498 4.674 961 HB3 LYS 128 HB1 LYS 128 13.011 -0.425 4.978 962 HG2 LYS 128 HG2 LYS 128 13.168 -0.593 2.411 963 HG3 LYS 128 HG1 LYS 128 12.048 0.776 2.437 964 HD2 LYS 128 HD2 LYS 128 13.615 2.039 3.836 965 HD3 LYS 128 HD1 LYS 128 14.719 0.659 3.853 966 HE2 LYS 128 HE2 LYS 128 14.845 0.833 1.357 967 HE3 LYS 128 HE1 LYS 128 13.929 2.334 1.476 968 HZ1 LYS 128 HZ1 LYS 128 16.707 1.849 1.979 969 HZ2 LYS 128 HZ2 LYS 128 15.960 2.665 3.258 970 HZ3 LYS 128 HZ3 LYS 128 15.902 3.311 1.696 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 27.673 4.799 -32.277 2 H2 MET 1 HT2 MET 1 26.315 5.844 -32.338 3 H3 MET 1 HT3 MET 1 26.101 4.178 -31.996 4 HA MET 1 HA MET 1 26.161 6.043 -30.162 5 HB2 MET 1 HB2 MET 1 26.683 4.213 -28.598 6 HB3 MET 1 HB1 MET 1 25.572 3.693 -29.858 7 HG2 MET 1 HG2 MET 1 27.826 2.955 -31.028 8 HG3 MET 1 HG1 MET 1 28.383 2.904 -29.357 9 HE1 MET 1 HE1 MET 1 26.937 -0.065 -27.810 10 HE2 MET 1 HE2 MET 1 26.141 1.477 -27.497 11 HE3 MET 1 HE3 MET 1 27.890 1.416 -27.715 12 H ARG 2 HN ARG 2 28.398 6.718 -31.880 13 HA ARG 2 HA ARG 2 30.828 6.284 -30.434 14 HB2 ARG 2 HB2 ARG 2 30.213 7.090 -32.990 15 HB3 ARG 2 HB1 ARG 2 30.786 8.580 -32.254 16 HG2 ARG 2 HG2 ARG 2 32.766 7.090 -31.447 17 HG3 ARG 2 HG1 ARG 2 32.248 6.033 -32.761 18 HD2 ARG 2 HD2 ARG 2 32.438 7.920 -34.327 19 HD3 ARG 2 HD1 ARG 2 33.003 8.943 -33.007 20 HE ARG 2 HE ARG 2 34.543 7.069 -34.496 21 HH11 ARG 2 HH11 ARG 2 34.188 8.488 -31.328 22 HH12 ARG 2 HH12 ARG 2 35.846 8.240 -30.893 23 HH21 ARG 2 HH21 ARG 2 36.724 6.742 -33.927 24 HH22 ARG 2 HH22 ARG 2 37.286 7.249 -32.369 25 H GLY 3 HN GLY 3 31.833 7.550 -28.959 26 HA2 GLY 3 HA2 GLY 3 31.908 10.105 -28.373 27 HA3 GLY 3 HA1 GLY 3 30.260 9.767 -27.868 28 H SER 4 HN SER 4 29.931 9.063 -25.853 29 HA SER 4 HA SER 4 30.338 8.425 -23.709 30 HB2 SER 4 HB2 SER 4 32.752 6.898 -24.642 31 HB3 SER 4 HB1 SER 4 31.598 6.482 -23.375 32 HG SER 4 HG SER 4 31.109 6.494 -26.171 33 H HIS 5 HN HIS 5 30.922 10.247 -22.656 34 HA HIS 5 HA HIS 5 33.617 11.301 -22.904 35 HB2 HIS 5 HB2 HIS 5 31.201 12.229 -21.344 36 HB3 HIS 5 HB1 HIS 5 32.759 13.049 -21.307 37 HD1 HIS 5 HD1 HIS 5 33.282 12.694 -24.435 38 HD2 HIS 5 HD2 HIS 5 29.877 14.278 -22.657 39 HE1 HIS 5 HE1 HIS 5 32.227 14.156 -26.188 40 HE2 HIS 5 HE2 HIS 5 30.225 15.183 -25.056 41 H HIS 6 HN HIS 6 34.369 12.195 -20.549 42 HA HIS 6 HA HIS 6 34.031 10.288 -18.431 43 HB2 HIS 6 HB2 HIS 6 36.276 10.038 -20.297 44 HB3 HIS 6 HB1 HIS 6 36.777 10.143 -18.612 45 HD1 HIS 6 HD1 HIS 6 36.101 8.194 -17.049 46 HD2 HIS 6 HD2 HIS 6 34.928 7.693 -21.004 47 HE1 HIS 6 HE1 HIS 6 35.418 5.781 -17.248 48 HE2 HIS 6 HE2 HIS 6 34.748 5.491 -19.659 49 H HIS 7 HN HIS 7 33.848 11.626 -16.769 50 HA HIS 7 HA HIS 7 35.926 13.655 -16.359 51 HB2 HIS 7 HB2 HIS 7 32.996 14.211 -15.878 52 HB3 HIS 7 HB1 HIS 7 34.334 15.350 -15.771 53 HD1 HIS 7 HD1 HIS 7 35.708 15.356 -18.305 54 HD2 HIS 7 HD2 HIS 7 31.617 14.642 -18.148 55 HE1 HIS 7 HE1 HIS 7 34.843 15.890 -20.605 56 HE2 HIS 7 HE2 HIS 7 32.377 15.384 -20.506 57 H HIS 8 HN HIS 8 36.886 13.152 -14.510 58 HA HIS 8 HA HIS 8 35.431 11.698 -12.460 59 HB2 HIS 8 HB2 HIS 8 38.130 11.786 -13.328 60 HB3 HIS 8 HB1 HIS 8 38.107 12.337 -11.659 61 HD1 HIS 8 HD1 HIS 8 35.415 9.998 -11.986 62 HD2 HIS 8 HD2 HIS 8 39.537 9.694 -11.564 63 HE1 HIS 8 HE1 HIS 8 35.836 7.658 -11.177 64 HE2 HIS 8 HE2 HIS 8 38.339 7.481 -10.971 65 H HIS 9 HN HIS 9 34.024 13.458 -11.885 66 HA HIS 9 HA HIS 9 35.336 15.373 -10.072 67 HB2 HIS 9 HB2 HIS 9 33.676 15.923 -12.349 68 HB3 HIS 9 HB1 HIS 9 32.847 16.460 -10.891 69 HD1 HIS 9 HD1 HIS 9 36.346 16.796 -12.367 70 HD2 HIS 9 HD2 HIS 9 33.548 18.971 -10.199 71 HE1 HIS 9 HE1 HIS 9 37.366 19.072 -12.045 72 HE2 HIS 9 HE2 HIS 9 35.638 20.385 -10.765 73 H HIS 10 HN HIS 10 32.007 14.335 -10.816 74 HA HIS 10 HA HIS 10 31.306 14.315 -8.001 75 HB2 HIS 10 HB2 HIS 10 29.796 13.761 -10.553 76 HB3 HIS 10 HB1 HIS 10 29.084 13.458 -8.972 77 HD1 HIS 10 HD1 HIS 10 30.463 16.107 -7.714 78 HD2 HIS 10 HD2 HIS 10 28.038 15.865 -11.079 79 HE1 HIS 10 HE1 HIS 10 29.482 18.404 -8.003 80 HE2 HIS 10 HE2 HIS 10 27.933 18.201 -9.978 81 H GLY 11 HN GLY 11 33.347 12.385 -8.718 82 HA2 GLY 11 HA2 GLY 11 32.097 9.797 -8.896 83 HA3 GLY 11 HA1 GLY 11 33.808 10.117 -8.670 84 H SER 12 HN SER 12 32.101 11.872 -6.399 85 HA SER 12 HA SER 12 32.667 9.846 -4.357 86 HB2 SER 12 HB2 SER 12 32.669 12.817 -4.407 87 HB3 SER 12 HB1 SER 12 32.188 12.043 -2.897 88 HG SER 12 HG SER 12 34.309 12.066 -2.662 89 H GLU 13 HN GLU 13 30.069 11.336 -5.986 90 HA GLU 13 HA GLU 13 28.142 9.847 -4.524 91 HB2 GLU 13 HB2 GLU 13 28.775 12.420 -3.494 92 HB3 GLU 13 HB1 GLU 13 27.168 12.513 -4.201 93 HG2 GLU 13 HG2 GLU 13 26.343 10.809 -2.791 94 HG3 GLU 13 HG1 GLU 13 27.967 10.358 -2.270 95 HA PRO 14 HA PRO 14 26.824 10.791 -8.802 96 HB2 PRO 14 HB2 PRO 14 25.474 8.472 -9.163 97 HB3 PRO 14 HB1 PRO 14 27.227 8.595 -9.356 98 HG2 PRO 14 HG2 PRO 14 25.644 7.594 -7.017 99 HG3 PRO 14 HG1 PRO 14 27.102 6.906 -7.757 100 HD2 PRO 14 HD2 PRO 14 27.180 8.392 -5.495 101 HD3 PRO 14 HD1 PRO 14 28.502 8.388 -6.680 102 H THR 15 HN THR 15 25.083 12.002 -9.193 103 HA THR 15 HA THR 15 22.778 11.796 -7.410 104 HB THR 15 HB THR 15 23.456 13.884 -9.493 105 HG1 THR 15 HG1 THR 15 24.616 14.744 -7.994 106 HG21 THR 15 HG21 THR 15 21.806 15.065 -7.664 107 HG22 THR 15 HG22 THR 15 21.079 13.471 -7.869 108 HG23 THR 15 HG23 THR 15 21.335 14.510 -9.270 109 H THR 16 HN THR 16 22.742 9.624 -8.871 110 HA THR 16 HA THR 16 21.095 10.095 -11.244 111 HB THR 16 HB THR 16 21.849 7.342 -10.414 112 HG1 THR 16 HG1 THR 16 23.695 9.311 -11.243 113 HG21 THR 16 HG21 THR 16 21.709 8.825 -13.012 114 HG22 THR 16 HG22 THR 16 20.768 7.430 -12.484 115 HG23 THR 16 HG23 THR 16 22.480 7.246 -12.865 116 HA PRO 17 HA PRO 17 17.391 9.096 -9.029 117 HB2 PRO 17 HB2 PRO 17 15.790 8.409 -11.101 118 HB3 PRO 17 HB1 PRO 17 16.252 10.082 -10.766 119 HG2 PRO 17 HG2 PRO 17 17.399 8.164 -12.759 120 HG3 PRO 17 HG1 PRO 17 16.997 9.879 -12.962 121 HD2 PRO 17 HD2 PRO 17 19.527 9.018 -12.526 122 HD3 PRO 17 HD1 PRO 17 18.938 10.583 -11.934 123 H THR 18 HN THR 18 17.302 7.320 -7.824 124 HA THR 18 HA THR 18 17.169 4.713 -9.187 125 HB THR 18 HB THR 18 19.289 4.763 -8.107 126 HG1 THR 18 HG1 THR 18 17.561 3.444 -6.294 127 HG21 THR 18 HG21 THR 18 19.324 5.062 -5.546 128 HG22 THR 18 HG22 THR 18 17.831 5.966 -5.799 129 HG23 THR 18 HG23 THR 18 19.321 6.489 -6.582 130 H THR 19 HN THR 19 15.461 6.917 -7.448 131 HA THR 19 HA THR 19 14.171 5.524 -5.437 132 HB THR 19 HB THR 19 13.864 7.890 -5.656 133 HG1 THR 19 HG1 THR 19 11.959 7.658 -4.855 134 HG21 THR 19 HG21 THR 19 12.193 7.529 -8.111 135 HG22 THR 19 HG22 THR 19 13.923 7.863 -8.206 136 HG23 THR 19 HG23 THR 19 12.844 9.013 -7.416 137 H ASN 20 HN ASN 20 12.373 4.225 -5.321 138 HA ASN 20 HA ASN 20 10.553 3.675 -7.353 139 HB2 ASN 20 HB2 ASN 20 12.956 2.580 -8.055 140 HB3 ASN 20 HB1 ASN 20 12.195 1.235 -7.210 141 HD21 ASN 20 HD21 ASN 20 10.954 3.798 -9.327 142 HD22 ASN 20 HD22 ASN 20 10.192 2.732 -10.454 143 H LEU 21 HN LEU 21 8.847 2.769 -6.403 144 HA LEU 21 HA LEU 21 8.842 2.106 -3.690 145 HB2 LEU 21 HB2 LEU 21 6.732 1.101 -5.556 146 HB3 LEU 21 HB1 LEU 21 6.560 1.684 -3.913 147 HG LEU 21 HG LEU 21 7.459 3.679 -5.909 148 HD11 LEU 21 HD11 LEU 21 5.837 2.574 -7.262 149 HD12 LEU 21 HD12 LEU 21 5.103 4.047 -6.631 150 HD13 LEU 21 HD13 LEU 21 4.699 2.486 -5.918 151 HD21 LEU 21 HD21 LEU 21 5.174 4.073 -4.073 152 HD22 LEU 21 HD22 LEU 21 6.503 5.156 -4.487 153 HD23 LEU 21 HD23 LEU 21 6.763 3.839 -3.344 154 H LYS 22 HN LYS 22 10.430 0.530 -3.378 155 HA LYS 22 HA LYS 22 10.735 -1.868 -4.670 156 HB2 LYS 22 HB2 LYS 22 11.557 -0.737 -2.151 157 HB3 LYS 22 HB1 LYS 22 11.223 -2.450 -2.001 158 HG2 LYS 22 HG2 LYS 22 12.890 -3.058 -3.470 159 HG3 LYS 22 HG1 LYS 22 12.914 -1.475 -4.248 160 HD2 LYS 22 HD2 LYS 22 14.439 -0.688 -2.815 161 HD3 LYS 22 HD1 LYS 22 13.574 -1.334 -1.421 162 HE2 LYS 22 HE2 LYS 22 15.400 -2.648 -1.251 163 HE3 LYS 22 HE1 LYS 22 14.541 -3.616 -2.447 164 HZ1 LYS 22 HZ1 LYS 22 16.304 -3.364 -3.745 165 HZ2 LYS 22 HZ2 LYS 22 17.013 -2.244 -2.696 166 HZ3 LYS 22 HZ3 LYS 22 15.930 -1.720 -3.884 167 H ILE 23 HN ILE 23 10.303 -4.062 -3.699 168 HA ILE 23 HA ILE 23 7.532 -4.506 -3.742 169 HB ILE 23 HB ILE 23 9.936 -5.984 -4.034 170 HG12 ILE 23 HG12 ILE 23 7.441 -7.362 -4.614 171 HG13 ILE 23 HG11 ILE 23 7.471 -5.697 -5.179 172 HG21 ILE 23 HG21 ILE 23 7.943 -7.311 -2.213 173 HG22 ILE 23 HG22 ILE 23 9.629 -6.952 -1.859 174 HG23 ILE 23 HG23 ILE 23 9.221 -8.153 -3.083 175 HD11 ILE 23 HD11 ILE 23 9.717 -7.572 -5.768 176 HD12 ILE 23 HD12 ILE 23 9.300 -6.052 -6.567 177 HD13 ILE 23 HD13 ILE 23 8.281 -7.477 -6.783 178 H TYR 24 HN TYR 24 6.228 -5.627 -2.368 179 HA TYR 24 HA TYR 24 6.675 -5.317 0.524 180 HB2 TYR 24 HB2 TYR 24 4.360 -5.183 -1.280 181 HB3 TYR 24 HB1 TYR 24 4.096 -5.985 0.231 182 HD1 TYR 24 HD1 TYR 24 5.301 -2.761 -1.180 183 HD2 TYR 24 HD2 TYR 24 3.461 -4.778 2.064 184 HE1 TYR 24 HE1 TYR 24 4.767 -0.604 -0.144 185 HE2 TYR 24 HE2 TYR 24 2.932 -2.632 3.123 186 HH TYR 24 HH TYR 24 2.584 -0.293 2.414 187 H LYS 25 HN LYS 25 5.506 -7.257 1.697 188 HA LYS 25 HA LYS 25 5.873 -9.669 0.046 189 HB2 LYS 25 HB2 LYS 25 6.587 -9.150 2.888 190 HB3 LYS 25 HB1 LYS 25 6.205 -10.783 2.348 191 HG2 LYS 25 HG2 LYS 25 8.155 -9.275 0.720 192 HG3 LYS 25 HG1 LYS 25 8.685 -9.779 2.324 193 HD2 LYS 25 HD2 LYS 25 7.467 -11.637 0.288 194 HD3 LYS 25 HD1 LYS 25 9.204 -11.410 0.503 195 HE2 LYS 25 HE2 LYS 25 8.035 -11.913 3.049 196 HE3 LYS 25 HE1 LYS 25 7.453 -13.134 1.921 197 HZ1 LYS 25 HZ1 LYS 25 10.005 -13.163 1.296 198 HZ2 LYS 25 HZ2 LYS 25 9.380 -14.106 2.554 199 HZ3 LYS 25 HZ3 LYS 25 10.158 -12.645 2.900 200 H VAL 26 HN VAL 26 3.914 -10.481 -0.461 201 HA VAL 26 HA VAL 26 1.707 -9.977 1.276 202 HB VAL 26 HB VAL 26 1.115 -11.902 -0.799 203 HG11 VAL 26 HG11 VAL 26 -0.702 -10.451 -1.090 204 HG12 VAL 26 HG12 VAL 26 0.184 -9.108 -0.364 205 HG13 VAL 26 HG13 VAL 26 -0.333 -10.463 0.638 206 HG21 VAL 26 HG21 VAL 26 2.865 -9.717 -1.469 207 HG22 VAL 26 HG22 VAL 26 1.320 -9.576 -2.297 208 HG23 VAL 26 HG23 VAL 26 2.287 -11.036 -2.479 209 H ASP 27 HN ASP 27 2.490 -10.940 3.019 210 HA ASP 27 HA ASP 27 2.983 -13.761 3.148 211 HB2 ASP 27 HB2 ASP 27 3.043 -11.543 5.139 212 HB3 ASP 27 HB1 ASP 27 3.068 -13.192 5.726 213 H ASP 28 HN ASP 28 0.278 -11.692 3.669 214 HA ASP 28 HA ASP 28 -1.502 -13.877 3.740 215 HB2 ASP 28 HB2 ASP 28 -0.328 -13.828 6.083 216 HB3 ASP 28 HB1 ASP 28 -1.450 -12.510 6.398 217 H LEU 29 HN LEU 29 -3.248 -13.086 2.768 218 HA LEU 29 HA LEU 29 -4.277 -10.531 3.643 219 HB2 LEU 29 HB2 LEU 29 -3.704 -9.553 1.773 220 HB3 LEU 29 HB1 LEU 29 -3.287 -11.066 1.045 221 HG LEU 29 HG LEU 29 -6.155 -10.631 1.288 222 HD11 LEU 29 HD11 LEU 29 -5.800 -8.415 0.813 223 HD12 LEU 29 HD12 LEU 29 -6.055 -9.137 -0.781 224 HD13 LEU 29 HD13 LEU 29 -4.423 -8.755 -0.240 225 HD21 LEU 29 HD21 LEU 29 -4.847 -11.136 -1.276 226 HD22 LEU 29 HD22 LEU 29 -6.199 -11.959 -0.492 227 HD23 LEU 29 HD23 LEU 29 -4.546 -12.305 0.007 228 H GLN 30 HN GLN 30 -6.366 -10.412 3.896 229 HA GLN 30 HA GLN 30 -8.061 -12.677 3.155 230 HB2 GLN 30 HB2 GLN 30 -7.438 -11.535 5.797 231 HB3 GLN 30 HB1 GLN 30 -9.149 -11.700 5.475 232 HG2 GLN 30 HG2 GLN 30 -8.157 -13.632 6.643 233 HG3 GLN 30 HG1 GLN 30 -8.933 -14.048 5.114 234 HE21 GLN 30 HE21 GLN 30 -7.492 -14.029 3.222 235 HE22 GLN 30 HE22 GLN 30 -5.879 -14.600 3.420 236 H LYS 31 HN LYS 31 -10.378 -12.265 3.159 237 HA LYS 31 HA LYS 31 -10.972 -9.712 2.005 238 HB2 LYS 31 HB2 LYS 31 -12.182 -12.071 1.702 239 HB3 LYS 31 HB1 LYS 31 -13.104 -11.525 3.090 240 HG2 LYS 31 HG2 LYS 31 -13.786 -11.086 0.516 241 HG3 LYS 31 HG1 LYS 31 -14.316 -10.098 1.876 242 HD2 LYS 31 HD2 LYS 31 -12.733 -8.421 1.400 243 HD3 LYS 31 HD1 LYS 31 -11.825 -9.481 0.320 244 HE2 LYS 31 HE2 LYS 31 -13.491 -9.385 -1.345 245 HE3 LYS 31 HE1 LYS 31 -14.669 -8.690 -0.233 246 HZ1 LYS 31 HZ1 LYS 31 -13.687 -7.087 -1.831 247 HZ2 LYS 31 HZ2 LYS 31 -12.187 -7.302 -1.078 248 HZ3 LYS 31 HZ3 LYS 31 -13.483 -6.648 -0.210 249 H ILE 32 HN ILE 32 -10.633 -8.105 3.412 250 HA ILE 32 HA ILE 32 -11.631 -8.399 6.162 251 HB ILE 32 HB ILE 32 -9.181 -7.072 5.048 252 HG12 ILE 32 HG12 ILE 32 -9.848 -9.759 5.932 253 HG13 ILE 32 HG11 ILE 32 -8.524 -9.188 4.932 254 HG21 ILE 32 HG21 ILE 32 -10.081 -7.296 7.891 255 HG22 ILE 32 HG22 ILE 32 -9.645 -5.841 6.990 256 HG23 ILE 32 HG23 ILE 32 -8.392 -7.030 7.414 257 HD11 ILE 32 HD11 ILE 32 -8.343 -8.587 7.778 258 HD12 ILE 32 HD12 ILE 32 -7.117 -9.076 6.621 259 HD13 ILE 32 HD13 ILE 32 -8.193 -10.276 7.303 260 H ASN 33 HN ASN 33 -13.150 -7.027 6.764 261 HA ASN 33 HA ASN 33 -14.474 -5.196 6.952 262 HB2 ASN 33 HB2 ASN 33 -11.797 -4.087 6.294 263 HB3 ASN 33 HB1 ASN 33 -13.172 -3.003 6.129 264 HD21 ASN 33 HD21 ASN 33 -12.271 -5.553 8.417 265 HD22 ASN 33 HD22 ASN 33 -12.480 -4.591 9.835 266 H GLY 34 HN GLY 34 -14.583 -6.777 4.584 267 HA2 GLY 34 HA2 GLY 34 -15.811 -6.734 2.649 268 HA3 GLY 34 HA1 GLY 34 -16.068 -5.022 2.920 269 H ILE 35 HN ILE 35 -12.819 -5.596 3.135 270 HA ILE 35 HA ILE 35 -12.324 -5.231 0.278 271 HB ILE 35 HB ILE 35 -10.404 -3.720 1.702 272 HG12 ILE 35 HG12 ILE 35 -12.955 -2.365 2.288 273 HG13 ILE 35 HG11 ILE 35 -12.615 -3.761 3.293 274 HG21 ILE 35 HG21 ILE 35 -12.290 -2.020 0.412 275 HG22 ILE 35 HG22 ILE 35 -12.093 -3.484 -0.552 276 HG23 ILE 35 HG23 ILE 35 -10.685 -2.508 -0.134 277 HD11 ILE 35 HD11 ILE 35 -10.719 -2.818 4.202 278 HD12 ILE 35 HD12 ILE 35 -11.855 -1.472 4.108 279 HD13 ILE 35 HD13 ILE 35 -10.569 -1.627 2.909 280 H TRP 36 HN TRP 36 -10.507 -6.301 -0.450 281 HA TRP 36 HA TRP 36 -9.423 -8.358 1.121 282 HB2 TRP 36 HB2 TRP 36 -8.381 -7.051 -1.411 283 HB3 TRP 36 HB1 TRP 36 -7.707 -8.520 -0.713 284 HD1 TRP 36 HD1 TRP 36 -10.198 -7.439 -3.181 285 HE1 TRP 36 HE1 TRP 36 -11.782 -9.369 -3.806 286 HE3 TRP 36 HE3 TRP 36 -9.028 -10.705 0.576 287 HZ2 TRP 36 HZ2 TRP 36 -12.451 -11.931 -2.834 288 HZ3 TRP 36 HZ3 TRP 36 -10.192 -12.871 0.660 289 HH2 TRP 36 HH2 TRP 36 -11.869 -13.470 -1.011 290 H GLN 37 HN GLN 37 -7.772 -8.355 2.615 291 HA GLN 37 HA GLN 37 -6.219 -5.863 2.834 292 HB2 GLN 37 HB2 GLN 37 -7.687 -6.092 4.682 293 HB3 GLN 37 HB1 GLN 37 -7.175 -7.747 4.967 294 HG2 GLN 37 HG2 GLN 37 -4.856 -6.258 5.126 295 HG3 GLN 37 HG1 GLN 37 -6.085 -5.264 5.885 296 HE21 GLN 37 HE21 GLN 37 -5.444 -8.764 5.861 297 HE22 GLN 37 HE22 GLN 37 -5.386 -8.922 7.600 298 H VAL 38 HN VAL 38 -4.066 -5.927 3.281 299 HA VAL 38 HA VAL 38 -2.831 -8.561 2.812 300 HB VAL 38 HB VAL 38 -1.678 -5.814 2.225 301 HG11 VAL 38 HG11 VAL 38 -0.771 -8.647 1.753 302 HG12 VAL 38 HG12 VAL 38 0.139 -7.263 2.357 303 HG13 VAL 38 HG13 VAL 38 -0.276 -7.367 0.645 304 HG21 VAL 38 HG21 VAL 38 -2.156 -6.960 -0.200 305 HG22 VAL 38 HG22 VAL 38 -3.230 -5.810 0.598 306 HG23 VAL 38 HG23 VAL 38 -3.538 -7.541 0.729 307 H ARG 39 HN ARG 39 -0.922 -9.159 3.743 308 HA ARG 39 HA ARG 39 0.163 -7.558 5.920 309 HB2 ARG 39 HB2 ARG 39 -0.667 -10.440 6.331 310 HB3 ARG 39 HB1 ARG 39 0.130 -9.402 7.487 311 HG2 ARG 39 HG2 ARG 39 -1.754 -8.483 8.138 312 HG3 ARG 39 HG1 ARG 39 -2.323 -8.252 6.495 313 HD2 ARG 39 HD2 ARG 39 -3.855 -9.800 7.111 314 HD3 ARG 39 HD1 ARG 39 -2.572 -10.912 6.672 315 HE ARG 39 HE ARG 39 -2.196 -10.327 9.338 316 HH11 ARG 39 HH11 ARG 39 -4.692 -11.745 7.356 317 HH12 ARG 39 HH12 ARG 39 -5.283 -12.778 8.613 318 HH21 ARG 39 HH21 ARG 39 -2.971 -11.694 10.996 319 HH22 ARG 39 HH22 ARG 39 -4.305 -12.750 10.680 320 H ASN 40 HN ASN 40 2.353 -7.979 6.325 321 HA ASN 40 HA ASN 40 3.556 -10.190 4.900 322 HB2 ASN 40 HB2 ASN 40 5.468 -8.058 5.059 323 HB3 ASN 40 HB1 ASN 40 5.033 -9.074 3.718 324 HD21 ASN 40 HD21 ASN 40 5.721 -6.264 3.897 325 HD22 ASN 40 HD22 ASN 40 4.473 -5.493 2.995 326 H ASN 41 HN ASN 41 5.373 -10.905 5.816 327 HA ASN 41 HA ASN 41 5.355 -11.007 8.572 328 HB2 ASN 41 HB2 ASN 41 7.723 -12.073 8.164 329 HB3 ASN 41 HB1 ASN 41 6.279 -12.885 7.581 330 HD21 ASN 41 HD21 ASN 41 7.080 -10.063 5.896 331 HD22 ASN 41 HD22 ASN 41 7.721 -10.778 4.495 332 H ILE 42 HN ILE 42 6.816 -8.620 6.546 333 HA ILE 42 HA ILE 42 8.915 -7.906 8.294 334 HB ILE 42 HB ILE 42 7.772 -6.369 6.001 335 HG12 ILE 42 HG12 ILE 42 10.046 -7.511 5.076 336 HG13 ILE 42 HG11 ILE 42 9.432 -8.785 6.120 337 HG21 ILE 42 HG21 ILE 42 10.562 -6.307 7.033 338 HG22 ILE 42 HG22 ILE 42 9.293 -5.281 7.694 339 HG23 ILE 42 HG23 ILE 42 9.734 -5.150 5.993 340 HD11 ILE 42 HD11 ILE 42 7.208 -8.408 4.970 341 HD12 ILE 42 HD12 ILE 42 8.480 -9.235 4.065 342 HD13 ILE 42 HD13 ILE 42 8.132 -7.537 3.746 343 H LEU 43 HN LEU 43 5.914 -6.507 7.148 344 HA LEU 43 HA LEU 43 5.934 -4.604 9.332 345 HB2 LEU 43 HB2 LEU 43 4.059 -4.678 6.996 346 HB3 LEU 43 HB1 LEU 43 4.281 -3.367 8.133 347 HG LEU 43 HG LEU 43 5.453 -2.536 6.406 348 HD11 LEU 43 HD11 LEU 43 7.044 -2.870 8.284 349 HD12 LEU 43 HD12 LEU 43 7.810 -2.764 6.700 350 HD13 LEU 43 HD13 LEU 43 7.607 -4.331 7.477 351 HD21 LEU 43 HD21 LEU 43 6.961 -4.409 5.105 352 HD22 LEU 43 HD22 LEU 43 5.384 -3.800 4.593 353 HD23 LEU 43 HD23 LEU 43 5.494 -5.294 5.528 354 H VAL 44 HN VAL 44 4.615 -7.589 8.426 355 HA VAL 44 HA VAL 44 2.697 -7.371 10.589 356 HB VAL 44 HB VAL 44 1.706 -8.495 8.065 357 HG11 VAL 44 HG11 VAL 44 -0.341 -8.505 9.083 358 HG12 VAL 44 HG12 VAL 44 0.056 -7.147 10.130 359 HG13 VAL 44 HG13 VAL 44 0.711 -8.749 10.472 360 HG21 VAL 44 HG21 VAL 44 2.478 -5.985 7.977 361 HG22 VAL 44 HG22 VAL 44 0.958 -5.734 8.823 362 HG23 VAL 44 HG23 VAL 44 0.968 -6.497 7.235 363 HA PRO 45 HA PRO 45 5.136 -11.328 10.522 364 HB2 PRO 45 HB2 PRO 45 4.537 -10.589 13.344 365 HB3 PRO 45 HB1 PRO 45 5.990 -11.371 12.714 366 HG2 PRO 45 HG2 PRO 45 6.071 -8.850 13.334 367 HG3 PRO 45 HG1 PRO 45 6.727 -9.340 11.755 368 HD2 PRO 45 HD2 PRO 45 4.088 -8.081 12.406 369 HD3 PRO 45 HD1 PRO 45 5.195 -7.745 11.089 370 H THR 46 HN THR 46 2.366 -10.031 12.100 371 HA THR 46 HA THR 46 0.475 -11.825 11.289 372 HB THR 46 HB THR 46 1.813 -13.501 12.548 373 HG1 THR 46 HG1 THR 46 0.012 -14.348 13.684 374 HG21 THR 46 HG21 THR 46 2.637 -12.186 14.385 375 HG22 THR 46 HG22 THR 46 1.676 -13.533 14.994 376 HG23 THR 46 HG23 THR 46 0.994 -11.908 14.959 377 H ASP 47 HN ASP 47 -1.587 -11.525 12.276 378 HA ASP 47 HA ASP 47 -3.215 -10.447 13.494 379 HB2 ASP 47 HB2 ASP 47 -1.218 -9.030 15.093 380 HB3 ASP 47 HB1 ASP 47 -2.787 -9.628 15.591 381 H PHE 48 HN PHE 48 -2.787 -9.144 11.183 382 HA PHE 48 HA PHE 48 -2.192 -6.396 11.646 383 HB2 PHE 48 HB2 PHE 48 -2.105 -8.041 9.461 384 HB3 PHE 48 HB1 PHE 48 -3.596 -7.169 9.177 385 HD1 PHE 48 HD2 PHE 48 -1.514 -4.923 10.922 386 HD2 PHE 48 HD1 PHE 48 -1.998 -6.795 7.136 387 HE1 PHE 48 HE2 PHE 48 -0.246 -3.113 9.831 388 HE2 PHE 48 HE1 PHE 48 -0.712 -5.022 6.071 389 HZ PHE 48 HZ PHE 48 0.156 -3.166 7.409 390 H THR 49 HN THR 49 -3.749 -5.276 12.676 391 HA THR 49 HA THR 49 -6.299 -6.039 13.235 392 HB THR 49 HB THR 49 -6.072 -3.174 12.627 393 HG1 THR 49 HG1 THR 49 -4.532 -4.293 14.731 394 HG21 THR 49 HG21 THR 49 -6.975 -4.814 14.936 395 HG22 THR 49 HG22 THR 49 -7.894 -3.721 13.893 396 HG23 THR 49 HG23 THR 49 -6.738 -3.070 15.061 397 H TRP 50 HN TRP 50 -7.294 -7.013 11.592 398 HA TRP 50 HA TRP 50 -7.662 -6.367 8.970 399 HB2 TRP 50 HB2 TRP 50 -9.577 -7.460 11.011 400 HB3 TRP 50 HB1 TRP 50 -10.019 -7.333 9.369 401 HD1 TRP 50 HD1 TRP 50 -6.474 -8.450 10.011 402 HE1 TRP 50 HE1 TRP 50 -6.253 -10.966 9.541 403 HE3 TRP 50 HE3 TRP 50 -11.420 -9.604 9.457 404 HZ2 TRP 50 HZ2 TRP 50 -7.949 -13.155 9.003 405 HZ3 TRP 50 HZ3 TRP 50 -12.036 -11.934 8.964 406 HH2 TRP 50 HH2 TRP 50 -10.335 -13.671 8.740 407 H VAL 51 HN VAL 51 -9.038 -4.854 11.765 408 HA VAL 51 HA VAL 51 -11.215 -3.522 10.777 409 HB VAL 51 HB VAL 51 -10.449 -3.616 13.183 410 HG11 VAL 51 HG11 VAL 51 -8.991 -1.072 12.591 411 HG12 VAL 51 HG12 VAL 51 -8.168 -2.631 12.618 412 HG13 VAL 51 HG13 VAL 51 -8.978 -2.036 14.068 413 HG21 VAL 51 HG21 VAL 51 -12.163 -1.928 11.906 414 HG22 VAL 51 HG22 VAL 51 -11.118 -0.804 12.778 415 HG23 VAL 51 HG23 VAL 51 -11.992 -2.060 13.657 416 H ASP 52 HN ASP 52 -8.007 -2.283 11.139 417 HA ASP 52 HA ASP 52 -8.331 -0.667 8.769 418 HB2 ASP 52 HB2 ASP 52 -9.265 0.641 10.613 419 HB3 ASP 52 HB1 ASP 52 -7.731 0.521 11.448 420 H ASN 53 HN ASN 53 -6.342 -2.298 10.933 421 HA ASN 53 HA ASN 53 -3.956 -0.967 10.032 422 HB2 ASN 53 HB2 ASN 53 -4.237 -3.354 11.839 423 HB3 ASN 53 HB1 ASN 53 -2.733 -2.534 11.480 424 HD21 ASN 53 HD21 ASN 53 -5.403 -0.407 11.756 425 HD22 ASN 53 HD22 ASN 53 -5.121 0.117 13.366 426 H GLY 54 HN GLY 54 -5.870 -3.437 9.027 427 HA2 GLY 54 HA2 GLY 54 -3.833 -4.850 7.662 428 HA3 GLY 54 HA1 GLY 54 -5.578 -5.039 7.527 429 H ILE 55 HN ILE 55 -3.411 -4.609 5.546 430 HA ILE 55 HA ILE 55 -4.026 -2.061 4.410 431 HB ILE 55 HB ILE 55 -1.958 -2.414 3.635 432 HG12 ILE 55 HG12 ILE 55 -1.968 -4.016 1.548 433 HG13 ILE 55 HG11 ILE 55 -3.693 -3.784 1.732 434 HG21 ILE 55 HG21 ILE 55 -0.862 -4.512 3.359 435 HG22 ILE 55 HG22 ILE 55 -2.361 -5.304 3.832 436 HG23 ILE 55 HG23 ILE 55 -1.520 -4.269 4.973 437 HD11 ILE 55 HD11 ILE 55 -3.011 -2.125 0.282 438 HD12 ILE 55 HD12 ILE 55 -1.612 -1.728 1.286 439 HD13 ILE 55 HD13 ILE 55 -3.236 -1.338 1.840 440 H ALA 56 HN ALA 56 -5.779 -1.664 3.145 441 HA ALA 56 HA ALA 56 -7.273 -3.836 2.111 442 HB1 ALA 56 HB1 ALA 56 -7.616 -0.950 2.275 443 HB2 ALA 56 HB2 ALA 56 -8.834 -2.226 2.261 444 HB3 ALA 56 HB3 ALA 56 -8.176 -1.619 0.742 445 H ALA 57 HN ALA 57 -5.878 -4.994 0.948 446 HA ALA 57 HA ALA 57 -4.016 -4.374 -0.747 447 HB1 ALA 57 HB1 ALA 57 -5.088 -6.660 -0.250 448 HB2 ALA 57 HB2 ALA 57 -4.188 -6.428 -1.749 449 HB3 ALA 57 HB3 ALA 57 -5.953 -6.381 -1.761 450 H ASP 58 HN ASP 58 -7.392 -3.935 -1.552 451 HA ASP 58 HA ASP 58 -7.193 -3.506 -4.277 452 HB2 ASP 58 HB2 ASP 58 -9.292 -3.643 -2.869 453 HB3 ASP 58 HB1 ASP 58 -9.004 -1.954 -2.518 454 H ASP 59 HN ASP 59 -6.432 -1.443 -1.606 455 HA ASP 59 HA ASP 59 -6.153 0.977 -3.010 456 HB2 ASP 59 HB2 ASP 59 -4.684 0.217 -0.496 457 HB3 ASP 59 HB1 ASP 59 -5.267 1.785 -0.990 458 H VAL 60 HN VAL 60 -4.008 -1.770 -2.462 459 HA VAL 60 HA VAL 60 -1.780 -0.255 -3.512 460 HB VAL 60 HB VAL 60 -0.404 -2.058 -2.802 461 HG11 VAL 60 HG11 VAL 60 -0.712 -0.373 -1.239 462 HG12 VAL 60 HG12 VAL 60 -0.907 -1.884 -0.355 463 HG13 VAL 60 HG13 VAL 60 -2.324 -0.940 -0.830 464 HG21 VAL 60 HG21 VAL 60 -2.711 -3.528 -2.974 465 HG22 VAL 60 HG22 VAL 60 -2.335 -3.498 -1.257 466 HG23 VAL 60 HG23 VAL 60 -1.143 -4.100 -2.417 467 H ILE 61 HN ILE 61 -0.208 -1.949 -4.694 468 HA ILE 61 HA ILE 61 -1.715 -3.274 -6.766 469 HB ILE 61 HB ILE 61 0.186 -2.091 -8.199 470 HG12 ILE 61 HG12 ILE 61 -0.733 0.092 -6.493 471 HG13 ILE 61 HG11 ILE 61 0.523 -0.897 -5.845 472 HG21 ILE 61 HG21 ILE 61 -2.291 -0.700 -7.339 473 HG22 ILE 61 HG22 ILE 61 -2.363 -2.182 -8.323 474 HG23 ILE 61 HG23 ILE 61 -1.579 -0.721 -8.955 475 HD11 ILE 61 HD11 ILE 61 0.777 1.242 -7.565 476 HD12 ILE 61 HD12 ILE 61 1.160 -0.204 -8.505 477 HD13 ILE 61 HD13 ILE 61 2.034 0.136 -7.015 478 H GLU 62 HN GLU 62 -1.010 -5.267 -6.787 479 HA GLU 62 HA GLU 62 1.436 -6.127 -5.686 480 HB2 GLU 62 HB2 GLU 62 -0.889 -7.345 -6.835 481 HB3 GLU 62 HB1 GLU 62 0.557 -8.107 -7.481 482 HG2 GLU 62 HG2 GLU 62 1.310 -8.223 -5.024 483 HG3 GLU 62 HG1 GLU 62 -0.388 -7.961 -4.656 484 H VAL 63 HN VAL 63 3.372 -6.328 -6.407 485 HA VAL 63 HA VAL 63 3.863 -6.001 -9.288 486 HB VAL 63 HB VAL 63 6.238 -5.428 -8.432 487 HG11 VAL 63 HG11 VAL 63 3.834 -3.704 -8.405 488 HG12 VAL 63 HG12 VAL 63 5.284 -3.615 -9.405 489 HG13 VAL 63 HG13 VAL 63 5.327 -3.042 -7.742 490 HG21 VAL 63 HG21 VAL 63 5.799 -6.175 -6.121 491 HG22 VAL 63 HG22 VAL 63 4.684 -4.822 -5.933 492 HG23 VAL 63 HG23 VAL 63 6.398 -4.519 -6.217 493 H THR 64 HN THR 64 5.692 -7.262 -10.157 494 HA THR 64 HA THR 64 5.759 -9.906 -8.950 495 HB THR 64 HB THR 64 6.570 -10.736 -10.958 496 HG1 THR 64 HG1 THR 64 7.892 -8.326 -11.126 497 HG21 THR 64 HG21 THR 64 4.574 -10.173 -11.818 498 HG22 THR 64 HG22 THR 64 5.572 -9.128 -12.829 499 HG23 THR 64 HG23 THR 64 4.750 -8.465 -11.417 500 H SER 65 HN SER 65 7.832 -11.025 -8.647 501 HA SER 65 HA SER 65 9.431 -10.032 -6.762 502 HB2 SER 65 HB2 SER 65 10.711 -11.664 -8.938 503 HB3 SER 65 HB1 SER 65 10.955 -11.754 -7.194 504 HG SER 65 HG SER 65 9.633 -13.459 -8.128 505 H ASN 66 HN ASN 66 9.879 -9.353 -10.209 506 HA ASN 66 HA ASN 66 12.358 -8.041 -9.826 507 HB2 ASN 66 HB2 ASN 66 11.041 -9.044 -11.987 508 HB3 ASN 66 HB1 ASN 66 10.875 -7.308 -12.183 509 HD21 ASN 66 HD21 ASN 66 12.257 -6.910 -13.809 510 HD22 ASN 66 HD22 ASN 66 13.949 -7.255 -13.762 511 H GLY 67 HN GLY 67 9.223 -7.216 -9.200 512 HA2 GLY 67 HA2 GLY 67 8.543 -5.248 -8.108 513 HA3 GLY 67 HA1 GLY 67 9.897 -4.400 -8.836 514 H THR 68 HN THR 68 7.955 -6.476 -10.790 515 HA THR 68 HA THR 68 7.266 -4.316 -12.487 516 HB THR 68 HB THR 68 7.145 -7.221 -12.575 517 HG1 THR 68 HG1 THR 68 8.439 -5.634 -13.848 518 HG21 THR 68 HG21 THR 68 4.961 -5.634 -13.860 519 HG22 THR 68 HG22 THR 68 4.808 -7.012 -12.771 520 HG23 THR 68 HG23 THR 68 5.448 -7.241 -14.399 521 H ARG 69 HN ARG 69 5.655 -2.962 -12.172 522 HA ARG 69 HA ARG 69 3.573 -3.501 -10.288 523 HB2 ARG 69 HB2 ARG 69 4.504 -1.205 -11.840 524 HB3 ARG 69 HB1 ARG 69 2.757 -1.252 -11.637 525 HG2 ARG 69 HG2 ARG 69 3.305 -1.667 -9.140 526 HG3 ARG 69 HG1 ARG 69 4.895 -1.028 -9.562 527 HD2 ARG 69 HD2 ARG 69 2.267 0.375 -10.034 528 HD3 ARG 69 HD1 ARG 69 3.370 0.704 -8.697 529 HE ARG 69 HE ARG 69 3.591 1.663 -11.363 530 HH11 ARG 69 HH11 ARG 69 5.485 0.622 -8.621 531 HH12 ARG 69 HH12 ARG 69 6.872 1.557 -9.066 532 HH21 ARG 69 HH21 ARG 69 5.415 2.892 -11.949 533 HH22 ARG 69 HH22 ARG 69 6.832 2.847 -10.956 534 H THR 70 HN THR 70 1.490 -4.036 -10.576 535 HA THR 70 HA THR 70 0.309 -4.136 -13.230 536 HB THR 70 HB THR 70 -0.342 -6.527 -12.981 537 HG1 THR 70 HG1 THR 70 -0.128 -7.174 -10.985 538 HG21 THR 70 HG21 THR 70 2.111 -7.478 -13.095 539 HG22 THR 70 HG22 THR 70 2.508 -5.774 -13.276 540 HG23 THR 70 HG23 THR 70 1.412 -6.546 -14.418 541 H SER 71 HN SER 71 -1.212 -2.678 -12.451 542 HA SER 71 HA SER 71 -2.748 -3.311 -10.069 543 HB2 SER 71 HB2 SER 71 -3.818 -1.140 -10.441 544 HB3 SER 71 HB1 SER 71 -2.064 -0.988 -10.524 545 HG SER 71 HG SER 71 -3.581 -1.394 -12.861 546 H ASP 72 HN ASP 72 -3.106 -3.456 -13.535 547 HA ASP 72 HA ASP 72 -5.859 -3.530 -13.807 548 HB2 ASP 72 HB2 ASP 72 -3.703 -3.882 -15.482 549 HB3 ASP 72 HB1 ASP 72 -4.477 -5.463 -15.518 550 H GLN 73 HN GLN 73 -3.662 -6.076 -12.787 551 HA GLN 73 HA GLN 73 -5.648 -8.149 -12.854 552 HB2 GLN 73 HB2 GLN 73 -2.872 -7.984 -11.689 553 HB3 GLN 73 HB1 GLN 73 -3.877 -9.420 -11.548 554 HG2 GLN 73 HG2 GLN 73 -3.836 -8.585 -14.273 555 HG3 GLN 73 HG1 GLN 73 -2.182 -8.671 -13.669 556 HE21 GLN 73 HE21 GLN 73 -5.011 -10.432 -14.525 557 HE22 GLN 73 HE22 GLN 73 -4.347 -12.016 -14.339 558 H VAL 74 HN VAL 74 -5.619 -9.533 -10.633 559 HA VAL 74 HA VAL 74 -6.679 -7.705 -8.575 560 HB VAL 74 HB VAL 74 -8.356 -9.233 -9.480 561 HG11 VAL 74 HG11 VAL 74 -8.148 -11.676 -9.041 562 HG12 VAL 74 HG12 VAL 74 -6.467 -11.403 -8.589 563 HG13 VAL 74 HG13 VAL 74 -7.005 -11.057 -10.232 564 HG21 VAL 74 HG21 VAL 74 -7.483 -9.727 -6.647 565 HG22 VAL 74 HG22 VAL 74 -8.978 -10.387 -7.306 566 HG23 VAL 74 HG23 VAL 74 -8.742 -8.641 -7.234 567 H LEU 75 HN LEU 75 -5.728 -7.645 -6.626 568 HA LEU 75 HA LEU 75 -3.245 -8.841 -6.159 569 HB2 LEU 75 HB2 LEU 75 -4.775 -6.902 -4.956 570 HB3 LEU 75 HB1 LEU 75 -4.649 -8.131 -3.719 571 HG LEU 75 HG LEU 75 -2.136 -7.397 -5.091 572 HD11 LEU 75 HD11 LEU 75 -3.699 -5.296 -4.433 573 HD12 LEU 75 HD12 LEU 75 -1.935 -5.274 -4.390 574 HD13 LEU 75 HD13 LEU 75 -2.851 -5.565 -2.912 575 HD21 LEU 75 HD21 LEU 75 -2.154 -9.031 -3.316 576 HD22 LEU 75 HD22 LEU 75 -2.931 -7.882 -2.225 577 HD23 LEU 75 HD23 LEU 75 -1.285 -7.589 -2.788 578 H GLN 76 HN GLN 76 -2.564 -10.388 -4.718 579 HA GLN 76 HA GLN 76 -4.401 -12.146 -3.388 580 HB2 GLN 76 HB2 GLN 76 -2.633 -13.312 -5.540 581 HB3 GLN 76 HB1 GLN 76 -3.825 -14.159 -4.565 582 HG2 GLN 76 HG2 GLN 76 -5.602 -12.828 -5.641 583 HG3 GLN 76 HG1 GLN 76 -4.380 -12.079 -6.667 584 HE21 GLN 76 HE21 GLN 76 -2.972 -13.708 -7.851 585 HE22 GLN 76 HE22 GLN 76 -3.795 -15.045 -8.573 586 H LYS 77 HN LYS 77 -3.454 -12.986 -1.633 587 HA LYS 77 HA LYS 77 -0.799 -12.216 -0.984 588 HB2 LYS 77 HB2 LYS 77 -1.112 -12.998 1.146 589 HB3 LYS 77 HB1 LYS 77 -2.704 -12.439 0.659 590 HG2 LYS 77 HG2 LYS 77 -2.003 -15.310 0.297 591 HG3 LYS 77 HG1 LYS 77 -2.409 -14.716 1.905 592 HD2 LYS 77 HD2 LYS 77 -4.516 -13.779 0.905 593 HD3 LYS 77 HD1 LYS 77 -4.124 -14.660 -0.570 594 HE2 LYS 77 HE2 LYS 77 -4.692 -15.792 2.162 595 HE3 LYS 77 HE1 LYS 77 -5.650 -15.988 0.696 596 HZ1 LYS 77 HZ1 LYS 77 -3.368 -17.467 1.589 597 HZ2 LYS 77 HZ2 LYS 77 -3.188 -16.917 -0.001 598 HZ3 LYS 77 HZ3 LYS 77 -4.522 -17.868 0.418 599 H GLY 78 HN GLY 78 0.953 -13.433 -0.367 600 HA2 GLY 78 HA2 GLY 78 1.912 -15.685 -0.138 601 HA3 GLY 78 HA1 GLY 78 1.017 -16.121 -1.588 602 H GLY 79 HN GLY 79 2.330 -12.929 -1.561 603 HA2 GLY 79 HA2 GLY 79 4.804 -13.862 -2.819 604 HA3 GLY 79 HA1 GLY 79 3.671 -13.035 -3.870 605 H TYR 80 HN TYR 80 3.794 -10.956 -4.032 606 HA TYR 80 HA TYR 80 4.876 -9.273 -1.957 607 HB2 TYR 80 HB2 TYR 80 6.116 -9.002 -4.669 608 HB3 TYR 80 HB1 TYR 80 6.734 -8.468 -3.119 609 HD1 TYR 80 HD2 TYR 80 6.211 -11.446 -5.252 610 HD2 TYR 80 HD1 TYR 80 8.194 -9.829 -1.851 611 HE1 TYR 80 HE2 TYR 80 7.641 -13.445 -5.142 612 HE2 TYR 80 HE1 TYR 80 9.630 -11.821 -1.731 613 HH TYR 80 HH TYR 80 9.273 -14.496 -4.047 614 H PHE 81 HN PHE 81 4.582 -6.979 -2.516 615 HA PHE 81 HA PHE 81 3.013 -6.413 -4.860 616 HB2 PHE 81 HB2 PHE 81 1.181 -5.269 -3.601 617 HB3 PHE 81 HB1 PHE 81 1.168 -7.019 -3.483 618 HD1 PHE 81 HD2 PHE 81 2.691 -7.891 -1.442 619 HD2 PHE 81 HD1 PHE 81 0.722 -4.108 -1.690 620 HE1 PHE 81 HE2 PHE 81 2.620 -7.749 1.025 621 HE2 PHE 81 HE1 PHE 81 0.653 -3.964 0.737 622 HZ PHE 81 HZ PHE 81 1.604 -5.783 2.118 623 H VAL 82 HN VAL 82 2.303 -4.080 -4.790 624 HA VAL 82 HA VAL 82 4.302 -2.484 -3.373 625 HB VAL 82 HB VAL 82 4.142 -2.959 -6.246 626 HG11 VAL 82 HG11 VAL 82 3.181 -0.438 -5.568 627 HG12 VAL 82 HG12 VAL 82 3.840 -0.919 -7.126 628 HG13 VAL 82 HG13 VAL 82 4.881 -0.159 -5.926 629 HG21 VAL 82 HG21 VAL 82 6.215 -1.469 -4.643 630 HG22 VAL 82 HG22 VAL 82 6.427 -2.283 -6.193 631 HG23 VAL 82 HG23 VAL 82 6.118 -3.227 -4.736 632 H ILE 83 HN ILE 83 3.338 -0.859 -2.365 633 HA ILE 83 HA ILE 83 0.539 -0.440 -2.678 634 HB ILE 83 HB ILE 83 2.621 1.011 -1.127 635 HG12 ILE 83 HG12 ILE 83 1.994 -0.194 0.714 636 HG13 ILE 83 HG11 ILE 83 0.340 -0.357 0.170 637 HG21 ILE 83 HG21 ILE 83 1.135 2.729 -1.443 638 HG22 ILE 83 HG22 ILE 83 0.563 2.017 0.064 639 HG23 ILE 83 HG23 ILE 83 -0.258 1.650 -1.454 640 HD11 ILE 83 HD11 ILE 83 0.888 -2.178 -1.223 641 HD12 ILE 83 HD12 ILE 83 1.696 -2.464 0.316 642 HD13 ILE 83 HD13 ILE 83 2.613 -1.874 -1.060 643 H ASN 84 HN ASN 84 -0.295 0.654 -4.294 644 HA ASN 84 HA ASN 84 1.105 2.344 -5.977 645 HB2 ASN 84 HB2 ASN 84 -1.463 1.348 -5.871 646 HB3 ASN 84 HB1 ASN 84 -1.691 3.067 -5.643 647 HD21 ASN 84 HD21 ASN 84 -2.115 1.095 -7.929 648 HD22 ASN 84 HD22 ASN 84 -1.466 1.925 -9.295 649 HA PRO 85 HA PRO 85 1.556 5.783 -3.047 650 HB2 PRO 85 HB2 PRO 85 3.067 7.335 -4.611 651 HB3 PRO 85 HB1 PRO 85 3.738 5.854 -3.902 652 HG2 PRO 85 HG2 PRO 85 2.481 6.210 -6.618 653 HG3 PRO 85 HG1 PRO 85 4.075 5.581 -6.234 654 HD2 PRO 85 HD2 PRO 85 2.101 3.895 -6.660 655 HD3 PRO 85 HD1 PRO 85 3.225 3.600 -5.311 656 H ASN 86 HN ASN 86 0.530 5.823 -6.293 657 HA ASN 86 HA ASN 86 -0.513 8.440 -6.233 658 HB2 ASN 86 HB2 ASN 86 -0.350 6.261 -8.188 659 HB3 ASN 86 HB1 ASN 86 -1.801 7.235 -8.327 660 HD21 ASN 86 HD21 ASN 86 1.670 7.703 -7.798 661 HD22 ASN 86 HD22 ASN 86 1.834 9.024 -8.900 662 H ASN 87 HN ASN 87 -1.685 5.287 -5.475 663 HA ASN 87 HA ASN 87 -4.448 6.070 -5.217 664 HB2 ASN 87 HB2 ASN 87 -2.900 3.724 -5.265 665 HB3 ASN 87 HB1 ASN 87 -3.761 3.813 -3.741 666 HD21 ASN 87 HD21 ASN 87 -4.188 1.857 -5.480 667 HD22 ASN 87 HD22 ASN 87 -5.772 1.974 -6.164 668 H VAL 88 HN VAL 88 -1.648 6.637 -3.645 669 HA VAL 88 HA VAL 88 -2.614 6.441 -0.999 670 HB VAL 88 HB VAL 88 0.038 6.979 -2.260 671 HG11 VAL 88 HG11 VAL 88 -1.043 7.669 0.392 672 HG12 VAL 88 HG12 VAL 88 0.324 8.356 -0.492 673 HG13 VAL 88 HG13 VAL 88 0.525 6.850 0.407 674 HG21 VAL 88 HG21 VAL 88 0.318 4.808 -1.887 675 HG22 VAL 88 HG22 VAL 88 -1.396 4.742 -1.440 676 HG23 VAL 88 HG23 VAL 88 -0.167 4.989 -0.186 677 H LYS 89 HN LYS 89 -3.197 7.972 0.059 678 HA LYS 89 HA LYS 89 -3.329 10.646 -0.969 679 HB2 LYS 89 HB2 LYS 89 -4.296 9.579 1.651 680 HB3 LYS 89 HB1 LYS 89 -4.692 11.137 0.974 681 HG2 LYS 89 HG2 LYS 89 -6.425 9.322 0.859 682 HG3 LYS 89 HG1 LYS 89 -6.089 10.200 -0.626 683 HD2 LYS 89 HD2 LYS 89 -4.739 7.605 -0.015 684 HD3 LYS 89 HD1 LYS 89 -6.374 7.643 -0.678 685 HE2 LYS 89 HE2 LYS 89 -4.446 9.347 -2.069 686 HE3 LYS 89 HE1 LYS 89 -4.086 7.624 -2.120 687 HZ1 LYS 89 HZ1 LYS 89 -5.659 8.785 -3.874 688 HZ2 LYS 89 HZ2 LYS 89 -6.829 8.443 -2.703 689 HZ3 LYS 89 HZ3 LYS 89 -5.909 7.191 -3.369 690 H SER 90 HN SER 90 -1.964 8.807 1.624 691 HA SER 90 HA SER 90 0.432 10.265 1.794 692 HB2 SER 90 HB2 SER 90 0.159 11.991 3.245 693 HB3 SER 90 HB1 SER 90 -1.511 11.916 2.689 694 HG SER 90 HG SER 90 -2.078 11.349 4.622 695 H VAL 91 HN VAL 91 1.576 9.987 3.985 696 HA VAL 91 HA VAL 91 0.924 7.384 5.114 697 HB VAL 91 HB VAL 91 3.451 7.991 5.998 698 HG11 VAL 91 HG11 VAL 91 3.952 6.460 3.795 699 HG12 VAL 91 HG12 VAL 91 2.224 6.199 4.046 700 HG13 VAL 91 HG13 VAL 91 3.368 5.849 5.343 701 HG21 VAL 91 HG21 VAL 91 3.185 8.980 3.168 702 HG22 VAL 91 HG22 VAL 91 4.724 8.549 3.915 703 HG23 VAL 91 HG23 VAL 91 3.767 9.877 4.571 704 H GLY 92 HN GLY 92 0.169 7.439 7.151 705 HA2 GLY 92 HA2 GLY 92 0.153 9.950 8.557 706 HA3 GLY 92 HA1 GLY 92 -0.894 8.574 8.858 707 H THR 93 HN THR 93 -0.161 9.594 10.914 708 HA THR 93 HA THR 93 2.320 9.074 12.129 709 HB THR 93 HB THR 93 -0.176 9.133 13.724 710 HG1 THR 93 HG1 THR 93 0.556 11.162 11.921 711 HG21 THR 93 HG21 THR 93 1.919 9.431 14.855 712 HG22 THR 93 HG22 THR 93 1.000 10.934 14.898 713 HG23 THR 93 HG23 THR 93 2.338 10.752 13.767 714 HA PRO 94 HA PRO 94 2.097 4.831 12.943 715 HB2 PRO 94 HB2 PRO 94 4.344 4.654 14.253 716 HB3 PRO 94 HB1 PRO 94 4.348 5.265 12.587 717 HG2 PRO 94 HG2 PRO 94 4.275 6.877 15.106 718 HG3 PRO 94 HG1 PRO 94 5.463 6.965 13.795 719 HD2 PRO 94 HD2 PRO 94 3.364 8.602 13.892 720 HD3 PRO 94 HD1 PRO 94 3.981 7.964 12.352 721 H MET 95 HN MET 95 1.865 3.382 14.602 722 HA MET 95 HA MET 95 1.568 4.305 17.333 723 HB2 MET 95 HB2 MET 95 -0.758 3.010 15.903 724 HB3 MET 95 HB1 MET 95 -0.709 3.491 17.593 725 HG2 MET 95 HG2 MET 95 -0.219 5.851 16.638 726 HG3 MET 95 HG1 MET 95 -0.893 5.191 15.151 727 HE1 MET 95 HE1 MET 95 -2.430 7.715 17.419 728 HE2 MET 95 HE2 MET 95 -3.724 7.392 16.265 729 HE3 MET 95 HE3 MET 95 -2.048 7.442 15.719 730 H LYS 96 HN LYS 96 2.099 2.733 18.777 731 HA LYS 96 HA LYS 96 2.922 0.181 17.675 732 HB2 LYS 96 HB2 LYS 96 3.596 -0.211 20.155 733 HB3 LYS 96 HB1 LYS 96 4.512 0.942 19.196 734 HG2 LYS 96 HG2 LYS 96 2.218 2.016 20.716 735 HG3 LYS 96 HG1 LYS 96 3.612 1.470 21.650 736 HD2 LYS 96 HD2 LYS 96 4.005 3.249 19.278 737 HD3 LYS 96 HD1 LYS 96 3.495 3.937 20.820 738 HE2 LYS 96 HE2 LYS 96 5.487 2.546 21.773 739 HE3 LYS 96 HE1 LYS 96 6.052 2.569 20.103 740 HZ1 LYS 96 HZ1 LYS 96 6.204 4.896 20.124 741 HZ2 LYS 96 HZ2 LYS 96 6.869 4.410 21.601 742 HZ3 LYS 96 HZ3 LYS 96 5.301 5.042 21.548 743 H GLY 97 HN GLY 97 1.710 -1.617 17.674 744 HA2 GLY 97 HA2 GLY 97 0.010 -2.299 19.855 745 HA3 GLY 97 HA1 GLY 97 -0.934 -1.671 18.517 746 H SER 98 HN SER 98 0.214 -2.752 16.310 747 HA SER 98 HA SER 98 -0.745 -5.407 16.388 748 HB2 SER 98 HB2 SER 98 0.541 -3.672 14.357 749 HB3 SER 98 HB1 SER 98 0.707 -5.389 14.093 750 HG SER 98 HG SER 98 -1.658 -5.445 14.454 751 H GLY 99 HN GLY 99 0.657 -5.981 18.329 752 HA2 GLY 99 HA2 GLY 99 2.156 -7.853 18.660 753 HA3 GLY 99 HA1 GLY 99 3.138 -7.235 17.344 754 H GLY 100 HN GLY 100 3.535 -4.621 18.012 755 HA2 GLY 100 HA2 GLY 100 4.035 -3.744 20.492 756 HA3 GLY 100 HA1 GLY 100 5.330 -4.890 20.230 757 H LEU 101 HN LEU 101 5.112 -4.034 17.265 758 HA LEU 101 HA LEU 101 7.220 -2.156 17.279 759 HB2 LEU 101 HB2 LEU 101 5.637 -2.726 14.886 760 HB3 LEU 101 HB1 LEU 101 7.354 -2.577 15.097 761 HG LEU 101 HG LEU 101 7.172 -4.862 16.309 762 HD11 LEU 101 HD11 LEU 101 4.607 -4.834 16.161 763 HD12 LEU 101 HD12 LEU 101 5.417 -6.282 15.572 764 HD13 LEU 101 HD13 LEU 101 4.846 -5.062 14.436 765 HD21 LEU 101 HD21 LEU 101 7.867 -5.759 14.345 766 HD22 LEU 101 HD22 LEU 101 8.062 -4.024 14.061 767 HD23 LEU 101 HD23 LEU 101 6.649 -4.874 13.417 768 H SER 102 HN SER 102 6.451 -0.894 14.931 769 HA SER 102 HA SER 102 4.486 1.055 15.859 770 HB2 SER 102 HB2 SER 102 7.168 1.320 14.667 771 HB3 SER 102 HB1 SER 102 5.931 2.470 14.120 772 HG SER 102 HG SER 102 7.334 2.521 16.372 773 H TRP 103 HN TRP 103 2.755 1.040 14.692 774 HA TRP 103 HA TRP 103 2.807 0.233 11.895 775 HB2 TRP 103 HB2 TRP 103 0.669 -0.182 13.962 776 HB3 TRP 103 HB1 TRP 103 0.610 -0.696 12.304 777 HD1 TRP 103 HD1 TRP 103 3.281 -1.075 15.028 778 HE1 TRP 103 HE1 TRP 103 4.172 -3.431 14.982 779 HE3 TRP 103 HE3 TRP 103 0.254 -3.105 11.435 780 HZ2 TRP 103 HZ2 TRP 103 3.678 -5.887 13.681 781 HZ3 TRP 103 HZ3 TRP 103 0.553 -5.460 10.858 782 HH2 TRP 103 HH2 TRP 103 2.217 -6.825 11.975 783 H ALA 104 HN ALA 104 2.362 1.895 10.682 784 HA ALA 104 HA ALA 104 1.012 4.202 11.811 785 HB1 ALA 104 HB1 ALA 104 2.026 5.529 10.030 786 HB2 ALA 104 HB2 ALA 104 2.809 4.069 9.426 787 HB3 ALA 104 HB3 ALA 104 3.215 4.691 11.027 788 H GLN 105 HN GLN 105 -0.499 5.343 10.957 789 HA GLN 105 HA GLN 105 -2.373 3.983 9.347 790 HB2 GLN 105 HB2 GLN 105 -2.693 5.648 11.345 791 HB3 GLN 105 HB1 GLN 105 -2.595 6.856 10.079 792 HG2 GLN 105 HG2 GLN 105 -4.437 5.997 8.968 793 HG3 GLN 105 HG1 GLN 105 -4.417 4.529 9.930 794 HE21 GLN 105 HE21 GLN 105 -6.651 4.927 10.390 795 HE22 GLN 105 HE22 GLN 105 -7.107 6.084 11.588 796 H VAL 106 HN VAL 106 -1.820 3.905 7.117 797 HA VAL 106 HA VAL 106 -0.934 6.432 5.987 798 HB VAL 106 HB VAL 106 -0.676 3.589 5.046 799 HG11 VAL 106 HG11 VAL 106 0.642 4.868 3.156 800 HG12 VAL 106 HG12 VAL 106 -0.573 6.107 3.497 801 HG13 VAL 106 HG13 VAL 106 -1.075 4.506 3.002 802 HG21 VAL 106 HG21 VAL 106 1.730 4.321 4.948 803 HG22 VAL 106 HG22 VAL 106 1.025 4.250 6.566 804 HG23 VAL 106 HG23 VAL 106 1.228 5.815 5.750 805 H ASN 107 HN ASN 107 -2.107 7.466 4.542 806 HA ASN 107 HA ASN 107 -4.895 6.819 4.378 807 HB2 ASN 107 HB2 ASN 107 -3.514 9.135 4.646 808 HB3 ASN 107 HB1 ASN 107 -3.796 9.145 2.921 809 HD21 ASN 107 HD21 ASN 107 -5.742 8.068 5.680 810 HD22 ASN 107 HD22 ASN 107 -7.124 9.032 5.300 811 H PHE 108 HN PHE 108 -5.272 5.255 2.870 812 HA PHE 108 HA PHE 108 -4.134 5.535 0.273 813 HB2 PHE 108 HB2 PHE 108 -5.612 3.273 1.598 814 HB3 PHE 108 HB1 PHE 108 -5.204 3.298 -0.095 815 HD1 PHE 108 HD2 PHE 108 -3.468 3.770 3.168 816 HD2 PHE 108 HD1 PHE 108 -3.402 2.036 -0.710 817 HE1 PHE 108 HE2 PHE 108 -1.353 2.634 3.707 818 HE2 PHE 108 HE1 PHE 108 -1.308 0.892 -0.160 819 HZ PHE 108 HZ PHE 108 -0.270 1.191 2.043 820 H THR 109 HN THR 109 -5.459 4.845 -1.440 821 HA THR 109 HA THR 109 -7.446 6.536 -2.135 822 HB THR 109 HB THR 109 -6.165 5.373 -3.708 823 HG1 THR 109 HG1 THR 109 -8.775 4.299 -3.952 824 HG21 THR 109 HG21 THR 109 -6.643 3.228 -2.032 825 HG22 THR 109 HG22 THR 109 -5.631 3.277 -3.464 826 HG23 THR 109 HG23 THR 109 -7.318 2.789 -3.600 827 H THR 110 HN THR 110 -8.111 3.118 -1.744 828 HA THR 110 HA THR 110 -10.934 3.578 -1.571 829 HB THR 110 HB THR 110 -9.747 0.909 -1.227 830 HG1 THR 110 HG1 THR 110 -8.864 0.890 -3.119 831 HG21 THR 110 HG21 THR 110 -11.806 0.259 -1.670 832 HG22 THR 110 HG22 THR 110 -11.670 0.989 -3.270 833 HG23 THR 110 HG23 THR 110 -12.298 1.934 -1.919 834 H GLY 111 HN GLY 111 -8.609 1.844 0.443 835 HA2 GLY 111 HA2 GLY 111 -10.426 1.476 2.554 836 HA3 GLY 111 HA1 GLY 111 -8.696 1.210 2.628 837 H GLY 112 HN GLY 112 -8.810 4.286 1.588 838 HA2 GLY 112 HA2 GLY 112 -8.507 6.301 2.619 839 HA3 GLY 112 HA1 GLY 112 -9.671 5.735 3.807 840 H ASN 113 HN ASN 113 -8.922 4.657 5.678 841 HA ASN 113 HA ASN 113 -6.148 5.238 6.277 842 HB2 ASN 113 HB2 ASN 113 -6.925 4.160 8.532 843 HB3 ASN 113 HB1 ASN 113 -7.461 5.783 8.143 844 HD21 ASN 113 HD21 ASN 113 -8.508 2.590 7.076 845 HD22 ASN 113 HD22 ASN 113 -10.157 2.760 7.572 846 H VAL 114 HN VAL 114 -4.600 3.740 6.307 847 HA VAL 114 HA VAL 114 -5.254 0.905 6.371 848 HB VAL 114 HB VAL 114 -3.370 1.906 4.288 849 HG11 VAL 114 HG11 VAL 114 -3.224 -0.417 5.039 850 HG12 VAL 114 HG12 VAL 114 -3.651 -0.286 3.330 851 HG13 VAL 114 HG13 VAL 114 -4.893 -0.658 4.524 852 HG21 VAL 114 HG21 VAL 114 -5.168 1.542 2.601 853 HG22 VAL 114 HG22 VAL 114 -5.464 2.917 3.668 854 HG23 VAL 114 HG23 VAL 114 -6.314 1.395 3.932 855 H TRP 115 HN TRP 115 -4.009 0.249 8.003 856 HA TRP 115 HA TRP 115 -1.616 1.753 8.554 857 HB2 TRP 115 HB2 TRP 115 -2.943 -0.406 10.127 858 HB3 TRP 115 HB1 TRP 115 -1.497 0.435 10.634 859 HD1 TRP 115 HD1 TRP 115 -5.096 1.290 9.594 860 HE1 TRP 115 HE1 TRP 115 -5.819 3.232 11.044 861 HE3 TRP 115 HE3 TRP 115 -0.747 2.121 12.056 862 HZ2 TRP 115 HZ2 TRP 115 -4.711 4.953 12.898 863 HZ3 TRP 115 HZ3 TRP 115 -0.647 3.982 13.682 864 HH2 TRP 115 HH2 TRP 115 -2.613 5.378 14.105 865 H LEU 116 HN LEU 116 0.353 0.855 9.075 866 HA LEU 116 HA LEU 116 0.997 -1.795 8.125 867 HB2 LEU 116 HB2 LEU 116 1.172 0.346 6.375 868 HB3 LEU 116 HB1 LEU 116 2.804 0.215 7.024 869 HG LEU 116 HG LEU 116 2.224 -2.397 6.404 870 HD11 LEU 116 HD11 LEU 116 0.774 -2.622 4.723 871 HD12 LEU 116 HD12 LEU 116 1.366 -1.179 3.898 872 HD13 LEU 116 HD13 LEU 116 0.186 -1.028 5.201 873 HD21 LEU 116 HD21 LEU 116 3.345 -0.668 4.263 874 HD22 LEU 116 HD22 LEU 116 3.932 -2.204 4.900 875 HD23 LEU 116 HD23 LEU 116 4.165 -0.720 5.819 876 H ASN 117 HN ASN 117 2.894 -2.527 9.138 877 HA ASN 117 HA ASN 117 3.660 -0.983 11.365 878 HB2 ASN 117 HB2 ASN 117 4.126 -2.961 11.958 879 HB3 ASN 117 HB1 ASN 117 4.446 -3.556 10.349 880 HD21 ASN 117 HD21 ASN 117 5.711 -2.507 13.296 881 HD22 ASN 117 HD22 ASN 117 7.392 -2.627 12.913 882 H THR 118 HN THR 118 4.232 0.638 11.066 883 HA THR 118 HA THR 118 5.737 1.740 8.947 884 HB THR 118 HB THR 118 3.832 2.696 10.241 885 HG1 THR 118 HG1 THR 118 5.228 3.936 8.824 886 HG21 THR 118 HG21 THR 118 5.588 4.046 12.113 887 HG22 THR 118 HG22 THR 118 5.406 2.320 12.422 888 HG23 THR 118 HG23 THR 118 3.981 3.355 12.346 889 H THR 119 HN THR 119 7.008 -0.126 11.079 890 HA THR 119 HA THR 119 8.984 1.453 12.351 891 HB THR 119 HB THR 119 8.425 -0.955 12.884 892 HG1 THR 119 HG1 THR 119 10.321 0.120 13.672 893 HG21 THR 119 HG21 THR 119 10.503 -2.020 11.169 894 HG22 THR 119 HG22 THR 119 9.093 -1.466 10.266 895 HG23 THR 119 HG23 THR 119 8.904 -2.660 11.550 896 H SER 120 HN SER 120 8.545 1.960 9.388 897 HA SER 120 HA SER 120 11.090 2.728 8.679 898 HB2 SER 120 HB2 SER 120 10.619 0.987 6.509 899 HB3 SER 120 HB1 SER 120 11.938 0.893 7.676 900 HG SER 120 HG SER 120 11.036 -0.962 8.128 901 H LYS 121 HN LYS 121 10.606 4.496 7.499 902 HA LYS 121 HA LYS 121 7.959 4.939 6.561 903 HB2 LYS 121 HB2 LYS 121 8.628 7.107 6.197 904 HB3 LYS 121 HB1 LYS 121 9.752 6.580 7.440 905 HG2 LYS 121 HG2 LYS 121 11.548 6.533 5.984 906 HG3 LYS 121 HG1 LYS 121 10.525 6.381 4.556 907 HD2 LYS 121 HD2 LYS 121 11.569 8.604 4.739 908 HD3 LYS 121 HD1 LYS 121 9.807 8.677 4.775 909 HE2 LYS 121 HE2 LYS 121 10.556 8.417 7.442 910 HE3 LYS 121 HE1 LYS 121 11.737 9.532 6.756 911 HZ1 LYS 121 HZ1 LYS 121 9.410 10.445 5.742 912 HZ2 LYS 121 HZ2 LYS 121 10.168 11.061 7.123 913 HZ3 LYS 121 HZ3 LYS 121 8.930 9.921 7.278 914 H ASP 122 HN ASP 122 11.063 4.147 5.138 915 HA ASP 122 HA ASP 122 10.157 4.136 2.453 916 HB2 ASP 122 HB2 ASP 122 12.489 2.848 3.840 917 HB3 ASP 122 HB1 ASP 122 12.193 2.670 2.114 918 H ASN 123 HN ASN 123 9.263 2.355 5.101 919 HA ASN 123 HA ASN 123 9.168 -0.262 4.132 920 HB2 ASN 123 HB2 ASN 123 8.796 -0.033 6.484 921 HB3 ASN 123 HB1 ASN 123 7.647 1.271 6.213 922 HD21 ASN 123 HD21 ASN 123 7.698 -1.579 4.305 923 HD22 ASN 123 HD22 ASN 123 6.161 -2.100 4.770 924 H LEU 124 HN LEU 124 6.592 2.080 4.312 925 HA LEU 124 HA LEU 124 4.859 0.580 2.696 926 HB2 LEU 124 HB2 LEU 124 4.539 3.479 2.531 927 HB3 LEU 124 HB1 LEU 124 3.363 2.253 2.953 928 HG LEU 124 HG LEU 124 3.665 3.716 4.794 929 HD11 LEU 124 HD11 LEU 124 3.278 1.529 5.566 930 HD12 LEU 124 HD12 LEU 124 4.687 2.056 6.485 931 HD13 LEU 124 HD13 LEU 124 4.890 0.979 5.101 932 HD21 LEU 124 HD21 LEU 124 6.435 3.572 3.957 933 HD22 LEU 124 HD22 LEU 124 6.260 3.336 5.702 934 HD23 LEU 124 HD23 LEU 124 5.614 4.793 4.943 935 H LEU 125 HN LEU 125 6.735 3.463 2.038 936 HA LEU 125 HA LEU 125 6.269 3.607 -0.684 937 HB2 LEU 125 HB2 LEU 125 8.610 4.464 0.995 938 HB3 LEU 125 HB1 LEU 125 8.441 4.864 -0.686 939 HG LEU 125 HG LEU 125 6.212 5.953 -0.039 940 HD11 LEU 125 HD11 LEU 125 5.579 5.631 2.065 941 HD12 LEU 125 HD12 LEU 125 6.920 6.661 2.570 942 HD13 LEU 125 HD13 LEU 125 7.139 4.911 2.468 943 HD21 LEU 125 HD21 LEU 125 7.362 7.854 -0.233 944 HD22 LEU 125 HD22 LEU 125 8.845 6.906 -0.119 945 HD23 LEU 125 HD23 LEU 125 8.133 7.608 1.333 946 H TYR 126 HN TYR 126 8.917 2.016 1.091 947 HA TYR 126 HA TYR 126 9.736 0.802 -1.474 948 HB2 TYR 126 HB2 TYR 126 11.184 2.024 0.737 949 HB3 TYR 126 HB1 TYR 126 11.823 0.452 0.295 950 HD1 TYR 126 HD1 TYR 126 10.505 3.437 -1.510 951 HD2 TYR 126 HD2 TYR 126 13.614 0.562 -1.144 952 HE1 TYR 126 HE1 TYR 126 11.692 4.489 -3.393 953 HE2 TYR 126 HE2 TYR 126 14.809 1.599 -3.024 954 HH TYR 126 HH TYR 126 14.693 3.112 -4.675 955 H GLY 127 HN GLY 127 8.959 0.152 1.905 956 HA2 GLY 127 HA2 GLY 127 8.020 -2.027 2.481 957 HA3 GLY 127 HA1 GLY 127 8.942 -2.729 1.163 958 H LYS 128 HN LYS 128 10.402 -0.391 3.235 959 HA LYS 128 HA LYS 128 12.432 -2.197 4.015 960 HB2 LYS 128 HB2 LYS 128 11.768 0.600 4.904 961 HB3 LYS 128 HB1 LYS 128 13.244 -0.250 5.282 962 HG2 LYS 128 HG2 LYS 128 13.474 -0.476 2.713 963 HG3 LYS 128 HG1 LYS 128 12.329 0.873 2.693 964 HD2 LYS 128 HD2 LYS 128 13.833 2.213 4.053 965 HD3 LYS 128 HD1 LYS 128 14.936 0.843 4.225 966 HE2 LYS 128 HE2 LYS 128 15.314 0.854 1.794 967 HE3 LYS 128 HE1 LYS 128 14.258 2.258 1.649 968 HZ1 LYS 128 HZ1 LYS 128 16.337 3.205 1.733 969 HZ2 LYS 128 HZ2 LYS 128 16.946 2.074 2.833 970 HZ3 LYS 128 HZ3 LYS 128 15.883 3.278 3.361 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 37.978 7.694 -21.273 2 H2 MET 1 HT2 MET 1 39.614 7.187 -21.173 3 H3 MET 1 HT3 MET 1 39.014 7.875 -22.627 4 HA MET 1 HA MET 1 39.076 9.311 -20.067 5 HB2 MET 1 HB2 MET 1 41.197 8.723 -22.050 6 HB3 MET 1 HB1 MET 1 41.088 10.395 -21.516 7 HG2 MET 1 HG2 MET 1 41.003 8.398 -19.368 8 HG3 MET 1 HG1 MET 1 42.515 8.467 -20.270 9 HE1 MET 1 HE1 MET 1 41.246 10.745 -16.854 10 HE2 MET 1 HE2 MET 1 42.653 9.683 -16.868 11 HE3 MET 1 HE3 MET 1 41.090 9.082 -17.419 12 H ARG 2 HN ARG 2 36.933 9.258 -21.893 13 HA ARG 2 HA ARG 2 37.105 11.323 -23.825 14 HB2 ARG 2 HB2 ARG 2 35.374 9.421 -23.630 15 HB3 ARG 2 HB1 ARG 2 34.552 10.472 -22.484 16 HG2 ARG 2 HG2 ARG 2 33.615 11.615 -24.129 17 HG3 ARG 2 HG1 ARG 2 35.191 11.955 -24.846 18 HD2 ARG 2 HD2 ARG 2 34.004 10.818 -26.517 19 HD3 ARG 2 HD1 ARG 2 35.073 9.603 -25.815 20 HE ARG 2 HE ARG 2 32.444 9.688 -24.641 21 HH11 ARG 2 HH11 ARG 2 34.420 8.327 -27.177 22 HH12 ARG 2 HH12 ARG 2 33.411 6.936 -27.388 23 HH21 ARG 2 HH21 ARG 2 31.118 7.859 -24.915 24 HH22 ARG 2 HH22 ARG 2 31.538 6.669 -26.100 25 H GLY 3 HN GLY 3 36.838 13.472 -23.668 26 HA2 GLY 3 HA2 GLY 3 35.474 15.221 -22.438 27 HA3 GLY 3 HA1 GLY 3 36.203 14.542 -20.991 28 H SER 4 HN SER 4 36.333 17.122 -22.868 29 HA SER 4 HA SER 4 39.223 17.505 -22.441 30 HB2 SER 4 HB2 SER 4 38.044 17.373 -24.919 31 HB3 SER 4 HB1 SER 4 38.045 19.109 -24.606 32 HG SER 4 HG SER 4 40.339 17.486 -24.263 33 H HIS 5 HN HIS 5 36.004 18.852 -22.390 34 HA HIS 5 HA HIS 5 36.664 20.732 -20.383 35 HB2 HIS 5 HB2 HIS 5 36.860 21.618 -23.158 36 HB3 HIS 5 HB1 HIS 5 35.732 22.590 -22.219 37 HD1 HIS 5 HD1 HIS 5 39.211 22.366 -23.038 38 HD2 HIS 5 HD2 HIS 5 37.043 23.536 -19.691 39 HE1 HIS 5 HE1 HIS 5 40.796 23.748 -21.659 40 HE2 HIS 5 HE2 HIS 5 39.488 24.377 -19.600 41 H HIS 6 HN HIS 6 34.441 19.687 -22.898 42 HA HIS 6 HA HIS 6 32.156 20.749 -21.432 43 HB2 HIS 6 HB2 HIS 6 32.720 20.187 -24.174 44 HB3 HIS 6 HB1 HIS 6 31.344 19.206 -23.688 45 HD1 HIS 6 HD1 HIS 6 31.328 22.295 -21.798 46 HD2 HIS 6 HD2 HIS 6 30.076 21.099 -25.576 47 HE1 HIS 6 HE1 HIS 6 29.705 24.056 -22.557 48 HE2 HIS 6 HE2 HIS 6 28.921 23.286 -24.824 49 H HIS 7 HN HIS 7 31.664 19.517 -19.707 50 HA HIS 7 HA HIS 7 31.594 16.599 -20.030 51 HB2 HIS 7 HB2 HIS 7 32.708 18.045 -18.034 52 HB3 HIS 7 HB1 HIS 7 31.098 17.794 -17.366 53 HD1 HIS 7 HD1 HIS 7 30.768 14.869 -18.581 54 HD2 HIS 7 HD2 HIS 7 33.982 16.264 -16.345 55 HE1 HIS 7 HE1 HIS 7 31.825 12.822 -17.574 56 HE2 HIS 7 HE2 HIS 7 33.769 13.688 -16.225 57 H HIS 8 HN HIS 8 29.687 15.677 -20.423 58 HA HIS 8 HA HIS 8 27.305 16.620 -19.062 59 HB2 HIS 8 HB2 HIS 8 27.849 17.234 -21.847 60 HB3 HIS 8 HB1 HIS 8 26.367 16.301 -21.673 61 HD1 HIS 8 HD1 HIS 8 27.863 19.258 -19.780 62 HD2 HIS 8 HD2 HIS 8 24.282 17.989 -21.465 63 HE1 HIS 8 HE1 HIS 8 26.219 21.111 -19.343 64 HE2 HIS 8 HE2 HIS 8 24.076 20.348 -20.425 65 H HIS 9 HN HIS 9 27.717 14.498 -18.097 66 HA HIS 9 HA HIS 9 26.664 12.323 -19.785 67 HB2 HIS 9 HB2 HIS 9 29.152 12.420 -18.520 68 HB3 HIS 9 HB1 HIS 9 28.173 11.387 -17.485 69 HD1 HIS 9 HD1 HIS 9 27.903 9.019 -18.219 70 HD2 HIS 9 HD2 HIS 9 29.252 11.473 -21.288 71 HE1 HIS 9 HE1 HIS 9 28.431 7.475 -20.132 72 HE2 HIS 9 HE2 HIS 9 29.297 8.976 -21.960 73 H HIS 10 HN HIS 10 25.452 14.334 -17.812 74 HA HIS 10 HA HIS 10 24.605 12.936 -15.515 75 HB2 HIS 10 HB2 HIS 10 23.332 15.274 -16.955 76 HB3 HIS 10 HB1 HIS 10 22.877 14.713 -15.349 77 HD1 HIS 10 HD1 HIS 10 24.450 15.290 -13.404 78 HD2 HIS 10 HD2 HIS 10 25.796 16.627 -17.101 79 HE1 HIS 10 HE1 HIS 10 26.364 16.841 -12.901 80 HE2 HIS 10 HE2 HIS 10 27.151 17.654 -15.152 81 H GLY 11 HN GLY 11 22.257 14.055 -17.936 82 HA2 GLY 11 HA2 GLY 11 20.904 12.568 -19.269 83 HA3 GLY 11 HA1 GLY 11 21.153 11.327 -18.051 84 H SER 12 HN SER 12 18.808 13.058 -19.304 85 HA SER 12 HA SER 12 17.502 13.691 -16.746 86 HB2 SER 12 HB2 SER 12 17.414 14.898 -19.432 87 HB3 SER 12 HB1 SER 12 15.838 14.722 -18.659 88 HG SER 12 HG SER 12 16.512 16.598 -17.861 89 H GLU 13 HN GLU 13 17.305 11.762 -19.630 90 HA GLU 13 HA GLU 13 14.789 10.581 -18.673 91 HB2 GLU 13 HB2 GLU 13 15.814 11.213 -21.349 92 HB3 GLU 13 HB1 GLU 13 15.120 9.603 -21.214 93 HG2 GLU 13 HG2 GLU 13 13.385 11.034 -21.914 94 HG3 GLU 13 HG1 GLU 13 13.084 10.671 -20.215 95 HA PRO 14 HA PRO 14 17.436 6.742 -19.670 96 HB2 PRO 14 HB2 PRO 14 19.876 6.988 -20.780 97 HB3 PRO 14 HB1 PRO 14 18.399 6.991 -21.751 98 HG2 PRO 14 HG2 PRO 14 20.084 9.292 -20.855 99 HG3 PRO 14 HG1 PRO 14 19.310 9.015 -22.426 100 HD2 PRO 14 HD2 PRO 14 18.293 10.656 -20.484 101 HD3 PRO 14 HD1 PRO 14 17.303 9.853 -21.716 102 H THR 15 HN THR 15 17.560 6.702 -17.406 103 HA THR 15 HA THR 15 20.152 6.444 -16.327 104 HB THR 15 HB THR 15 19.390 8.351 -14.511 105 HG1 THR 15 HG1 THR 15 19.051 9.711 -16.920 106 HG21 THR 15 HG21 THR 15 21.371 8.204 -16.654 107 HG22 THR 15 HG22 THR 15 21.548 8.678 -14.966 108 HG23 THR 15 HG23 THR 15 20.952 9.841 -16.151 109 H THR 16 HN THR 16 19.966 6.254 -13.802 110 HA THR 16 HA THR 16 17.483 4.771 -13.249 111 HB THR 16 HB THR 16 20.173 4.398 -11.923 112 HG1 THR 16 HG1 THR 16 20.066 3.837 -14.217 113 HG21 THR 16 HG21 THR 16 17.852 3.591 -10.911 114 HG22 THR 16 HG22 THR 16 19.335 2.645 -10.777 115 HG23 THR 16 HG23 THR 16 18.148 2.254 -12.021 116 HA PRO 17 HA PRO 17 16.873 8.000 -10.197 117 HB2 PRO 17 HB2 PRO 17 14.435 7.239 -9.358 118 HB3 PRO 17 HB1 PRO 17 14.683 8.006 -10.932 119 HG2 PRO 17 HG2 PRO 17 14.333 5.107 -10.271 120 HG3 PRO 17 HG1 PRO 17 13.628 6.044 -11.601 121 HD2 PRO 17 HD2 PRO 17 15.813 4.426 -11.884 122 HD3 PRO 17 HD1 PRO 17 15.509 5.850 -12.897 123 H THR 18 HN THR 18 15.927 7.935 -7.838 124 HA THR 18 HA THR 18 16.884 5.532 -6.439 125 HB THR 18 HB THR 18 18.688 7.158 -6.320 126 HG1 THR 18 HG1 THR 18 17.445 6.161 -4.198 127 HG21 THR 18 HG21 THR 18 18.346 9.284 -5.061 128 HG22 THR 18 HG22 THR 18 16.608 9.036 -5.243 129 HG23 THR 18 HG23 THR 18 17.624 9.245 -6.669 130 H THR 19 HN THR 19 14.284 5.741 -6.856 131 HA THR 19 HA THR 19 13.205 5.978 -4.225 132 HB THR 19 HB THR 19 13.109 8.324 -4.700 133 HG1 THR 19 HG1 THR 19 10.989 8.621 -4.366 134 HG21 THR 19 HG21 THR 19 12.521 7.487 -7.395 135 HG22 THR 19 HG22 THR 19 13.074 9.048 -6.789 136 HG23 THR 19 HG23 THR 19 11.352 8.671 -6.810 137 H ASN 20 HN ASN 20 13.381 3.887 -6.063 138 HA ASN 20 HA ASN 20 10.829 3.572 -7.378 139 HB2 ASN 20 HB2 ASN 20 13.028 1.540 -6.951 140 HB3 ASN 20 HB1 ASN 20 11.671 1.391 -8.064 141 HD21 ASN 20 HD21 ASN 20 14.804 1.823 -8.080 142 HD22 ASN 20 HD22 ASN 20 15.001 2.899 -9.416 143 H LEU 21 HN LEU 21 9.062 2.688 -6.537 144 HA LEU 21 HA LEU 21 8.861 2.039 -3.822 145 HB2 LEU 21 HB2 LEU 21 6.885 1.110 -5.875 146 HB3 LEU 21 HB1 LEU 21 6.593 1.618 -4.222 147 HG LEU 21 HG LEU 21 7.698 3.678 -6.038 148 HD11 LEU 21 HD11 LEU 21 5.951 3.911 -7.430 149 HD12 LEU 21 HD12 LEU 21 4.787 3.358 -6.231 150 HD13 LEU 21 HD13 LEU 21 5.746 2.186 -7.128 151 HD21 LEU 21 HD21 LEU 21 6.921 5.031 -4.465 152 HD22 LEU 21 HD22 LEU 21 6.584 3.589 -3.508 153 HD23 LEU 21 HD23 LEU 21 5.319 4.294 -4.516 154 H LYS 22 HN LYS 22 10.425 0.456 -3.416 155 HA LYS 22 HA LYS 22 10.773 -1.951 -4.694 156 HB2 LYS 22 HB2 LYS 22 11.465 -0.807 -2.117 157 HB3 LYS 22 HB1 LYS 22 11.224 -2.540 -2.042 158 HG2 LYS 22 HG2 LYS 22 13.005 -1.238 -4.074 159 HG3 LYS 22 HG1 LYS 22 13.576 -1.770 -2.491 160 HD2 LYS 22 HD2 LYS 22 12.416 -4.028 -3.213 161 HD3 LYS 22 HD1 LYS 22 12.679 -3.378 -4.834 162 HE2 LYS 22 HE2 LYS 22 14.976 -3.230 -2.986 163 HE3 LYS 22 HE1 LYS 22 14.496 -4.849 -3.494 164 HZ1 LYS 22 HZ1 LYS 22 14.478 -3.625 -5.831 165 HZ2 LYS 22 HZ2 LYS 22 15.870 -4.346 -5.197 166 HZ3 LYS 22 HZ3 LYS 22 15.646 -2.676 -5.057 167 H ILE 23 HN ILE 23 10.311 -4.130 -3.741 168 HA ILE 23 HA ILE 23 7.539 -4.579 -3.802 169 HB ILE 23 HB ILE 23 9.944 -6.045 -4.112 170 HG12 ILE 23 HG12 ILE 23 7.457 -7.438 -4.681 171 HG13 ILE 23 HG11 ILE 23 7.463 -5.768 -5.231 172 HG21 ILE 23 HG21 ILE 23 9.257 -8.221 -3.161 173 HG22 ILE 23 HG22 ILE 23 7.969 -7.397 -2.289 174 HG23 ILE 23 HG23 ILE 23 9.652 -7.018 -1.934 175 HD11 ILE 23 HD11 ILE 23 9.640 -7.717 -5.886 176 HD12 ILE 23 HD12 ILE 23 9.383 -6.108 -6.569 177 HD13 ILE 23 HD13 ILE 23 8.244 -7.409 -6.913 178 H TYR 24 HN TYR 24 6.230 -5.711 -2.430 179 HA TYR 24 HA TYR 24 6.690 -5.405 0.461 180 HB2 TYR 24 HB2 TYR 24 4.377 -5.190 -1.322 181 HB3 TYR 24 HB1 TYR 24 4.091 -6.078 0.140 182 HD1 TYR 24 HD2 TYR 24 5.369 -2.777 -1.045 183 HD2 TYR 24 HD1 TYR 24 3.435 -4.978 2.018 184 HE1 TYR 24 HE2 TYR 24 4.910 -0.691 0.171 185 HE2 TYR 24 HE1 TYR 24 2.959 -2.915 3.234 186 HH TYR 24 HH TYR 24 3.028 0.019 1.968 187 H LYS 25 HN LYS 25 5.548 -7.343 1.655 188 HA LYS 25 HA LYS 25 5.920 -9.775 0.022 189 HB2 LYS 25 HB2 LYS 25 6.544 -9.252 2.898 190 HB3 LYS 25 HB1 LYS 25 6.283 -10.885 2.292 191 HG2 LYS 25 HG2 LYS 25 8.080 -10.016 0.495 192 HG3 LYS 25 HG1 LYS 25 8.560 -9.050 1.890 193 HD2 LYS 25 HD2 LYS 25 8.111 -11.708 2.788 194 HD3 LYS 25 HD1 LYS 25 9.113 -11.792 1.340 195 HE2 LYS 25 HE2 LYS 25 10.551 -9.990 2.421 196 HE3 LYS 25 HE1 LYS 25 9.667 -10.325 3.908 197 HZ1 LYS 25 HZ1 LYS 25 11.532 -11.665 4.056 198 HZ2 LYS 25 HZ2 LYS 25 11.501 -12.091 2.419 199 HZ3 LYS 25 HZ3 LYS 25 10.354 -12.738 3.481 200 H VAL 26 HN VAL 26 3.920 -10.521 -0.500 201 HA VAL 26 HA VAL 26 1.724 -10.022 1.245 202 HB VAL 26 HB VAL 26 1.136 -11.965 -0.822 203 HG11 VAL 26 HG11 VAL 26 -0.323 -10.526 0.616 204 HG12 VAL 26 HG12 VAL 26 -0.695 -10.537 -1.113 205 HG13 VAL 26 HG13 VAL 26 0.177 -9.180 -0.400 206 HG21 VAL 26 HG21 VAL 26 2.879 -9.786 -1.496 207 HG22 VAL 26 HG22 VAL 26 1.326 -9.615 -2.302 208 HG23 VAL 26 HG23 VAL 26 2.272 -11.084 -2.517 209 H ASP 27 HN ASP 27 2.473 -10.965 3.002 210 HA ASP 27 HA ASP 27 2.964 -13.785 3.172 211 HB2 ASP 27 HB2 ASP 27 2.983 -11.552 5.164 212 HB3 ASP 27 HB1 ASP 27 3.114 -13.210 5.719 213 H ASP 28 HN ASP 28 0.248 -11.716 3.639 214 HA ASP 28 HA ASP 28 -1.537 -13.897 3.742 215 HB2 ASP 28 HB2 ASP 28 -0.395 -13.868 6.075 216 HB3 ASP 28 HB1 ASP 28 -1.438 -12.485 6.383 217 H LEU 29 HN LEU 29 -3.237 -13.083 2.699 218 HA LEU 29 HA LEU 29 -4.274 -10.523 3.568 219 HB2 LEU 29 HB2 LEU 29 -3.685 -9.601 1.672 220 HB3 LEU 29 HB1 LEU 29 -3.334 -11.141 0.958 221 HG LEU 29 HG LEU 29 -6.175 -10.613 1.277 222 HD11 LEU 29 HD11 LEU 29 -4.430 -8.811 -0.318 223 HD12 LEU 29 HD12 LEU 29 -5.783 -8.424 0.754 224 HD13 LEU 29 HD13 LEU 29 -6.082 -9.160 -0.827 225 HD21 LEU 29 HD21 LEU 29 -4.671 -12.369 -0.011 226 HD22 LEU 29 HD22 LEU 29 -4.950 -11.210 -1.312 227 HD23 LEU 29 HD23 LEU 29 -6.317 -11.965 -0.485 228 H GLN 30 HN GLN 30 -6.351 -10.421 3.884 229 HA GLN 30 HA GLN 30 -8.065 -12.676 3.155 230 HB2 GLN 30 HB2 GLN 30 -7.381 -11.562 5.798 231 HB3 GLN 30 HB1 GLN 30 -9.097 -11.737 5.514 232 HG2 GLN 30 HG2 GLN 30 -8.073 -13.676 6.636 233 HG3 GLN 30 HG1 GLN 30 -8.865 -14.081 5.112 234 HE21 GLN 30 HE21 GLN 30 -7.443 -14.011 3.202 235 HE22 GLN 30 HE22 GLN 30 -5.829 -14.587 3.370 236 H LYS 31 HN LYS 31 -10.387 -12.240 3.209 237 HA LYS 31 HA LYS 31 -10.942 -9.654 2.119 238 HB2 LYS 31 HB2 LYS 31 -12.206 -11.956 1.735 239 HB3 LYS 31 HB1 LYS 31 -13.102 -11.462 3.162 240 HG2 LYS 31 HG2 LYS 31 -13.822 -10.889 0.633 241 HG3 LYS 31 HG1 LYS 31 -14.291 -9.936 2.039 242 HD2 LYS 31 HD2 LYS 31 -12.651 -8.300 1.594 243 HD3 LYS 31 HD1 LYS 31 -11.812 -9.345 0.448 244 HE2 LYS 31 HE2 LYS 31 -13.071 -7.619 -0.718 245 HE3 LYS 31 HE1 LYS 31 -13.719 -9.220 -1.072 246 HZ1 LYS 31 HZ1 LYS 31 -15.249 -7.188 -0.393 247 HZ2 LYS 31 HZ2 LYS 31 -14.915 -7.772 1.159 248 HZ3 LYS 31 HZ3 LYS 31 -15.638 -8.784 0.013 249 H ILE 32 HN ILE 32 -10.581 -8.081 3.530 250 HA ILE 32 HA ILE 32 -11.535 -8.383 6.293 251 HB ILE 32 HB ILE 32 -9.082 -7.107 5.137 252 HG12 ILE 32 HG12 ILE 32 -9.793 -9.781 6.021 253 HG13 ILE 32 HG11 ILE 32 -8.485 -9.236 4.987 254 HG21 ILE 32 HG21 ILE 32 -9.914 -7.313 8.000 255 HG22 ILE 32 HG22 ILE 32 -9.451 -5.874 7.090 256 HG23 ILE 32 HG23 ILE 32 -8.228 -7.103 7.481 257 HD11 ILE 32 HD11 ILE 32 -8.180 -8.646 7.815 258 HD12 ILE 32 HD12 ILE 32 -7.023 -9.212 6.622 259 HD13 ILE 32 HD13 ILE 32 -8.138 -10.345 7.358 260 H ASN 33 HN ASN 33 -12.988 -6.970 6.957 261 HA ASN 33 HA ASN 33 -14.275 -5.117 7.179 262 HB2 ASN 33 HB2 ASN 33 -11.603 -4.070 6.457 263 HB3 ASN 33 HB1 ASN 33 -12.949 -2.965 6.211 264 HD21 ASN 33 HD21 ASN 33 -12.445 -5.450 8.657 265 HD22 ASN 33 HD22 ASN 33 -12.537 -4.386 10.013 266 H GLY 34 HN GLY 34 -14.516 -6.729 4.845 267 HA2 GLY 34 HA2 GLY 34 -15.823 -6.692 2.961 268 HA3 GLY 34 HA1 GLY 34 -16.044 -4.974 3.221 269 H ILE 35 HN ILE 35 -12.794 -5.565 3.293 270 HA ILE 35 HA ILE 35 -12.430 -5.262 0.410 271 HB ILE 35 HB ILE 35 -10.434 -3.734 1.664 272 HG12 ILE 35 HG12 ILE 35 -12.861 -2.311 2.479 273 HG13 ILE 35 HG11 ILE 35 -12.549 -3.755 3.423 274 HG21 ILE 35 HG21 ILE 35 -11.748 -1.827 0.525 275 HG22 ILE 35 HG22 ILE 35 -12.802 -3.118 -0.053 276 HG23 ILE 35 HG23 ILE 35 -11.089 -3.123 -0.472 277 HD11 ILE 35 HD11 ILE 35 -10.782 -1.364 3.092 278 HD12 ILE 35 HD12 ILE 35 -10.225 -2.889 3.783 279 HD13 ILE 35 HD13 ILE 35 -11.524 -1.989 4.566 280 H TRP 36 HN TRP 36 -10.586 -6.295 -0.367 281 HA TRP 36 HA TRP 36 -9.463 -8.351 1.180 282 HB2 TRP 36 HB2 TRP 36 -8.462 -7.014 -1.352 283 HB3 TRP 36 HB1 TRP 36 -7.770 -8.488 -0.677 284 HD1 TRP 36 HD1 TRP 36 -10.317 -7.389 -3.083 285 HE1 TRP 36 HE1 TRP 36 -11.920 -9.308 -3.687 286 HE3 TRP 36 HE3 TRP 36 -9.054 -10.700 0.604 287 HZ2 TRP 36 HZ2 TRP 36 -12.569 -11.879 -2.731 288 HZ3 TRP 36 HZ3 TRP 36 -10.219 -12.866 0.690 289 HH2 TRP 36 HH2 TRP 36 -11.940 -13.442 -0.944 290 H GLN 37 HN GLN 37 -7.794 -8.348 2.642 291 HA GLN 37 HA GLN 37 -6.255 -5.849 2.857 292 HB2 GLN 37 HB2 GLN 37 -7.656 -6.074 4.745 293 HB3 GLN 37 HB1 GLN 37 -7.192 -7.750 4.985 294 HG2 GLN 37 HG2 GLN 37 -4.825 -6.321 5.122 295 HG3 GLN 37 HG1 GLN 37 -6.011 -5.326 5.937 296 HE21 GLN 37 HE21 GLN 37 -5.320 -8.820 5.821 297 HE22 GLN 37 HE22 GLN 37 -5.242 -9.017 7.554 298 H VAL 38 HN VAL 38 -4.088 -5.915 3.305 299 HA VAL 38 HA VAL 38 -2.861 -8.545 2.775 300 HB VAL 38 HB VAL 38 -1.670 -5.805 2.224 301 HG11 VAL 38 HG11 VAL 38 0.090 -7.346 2.315 302 HG12 VAL 38 HG12 VAL 38 -0.329 -7.349 0.601 303 HG13 VAL 38 HG13 VAL 38 -0.875 -8.658 1.645 304 HG21 VAL 38 HG21 VAL 38 -3.589 -7.465 0.709 305 HG22 VAL 38 HG22 VAL 38 -2.214 -6.866 -0.219 306 HG23 VAL 38 HG23 VAL 38 -3.267 -5.735 0.632 307 H ARG 39 HN ARG 39 -0.949 -9.176 3.703 308 HA ARG 39 HA ARG 39 0.135 -7.610 5.905 309 HB2 ARG 39 HB2 ARG 39 -0.870 -10.447 6.241 310 HB3 ARG 39 HB1 ARG 39 0.105 -9.577 7.403 311 HG2 ARG 39 HG2 ARG 39 -1.583 -8.284 8.083 312 HG3 ARG 39 HG1 ARG 39 -2.368 -8.258 6.514 313 HD2 ARG 39 HD2 ARG 39 -3.531 -9.510 8.421 314 HD3 ARG 39 HD1 ARG 39 -3.406 -10.314 6.860 315 HE ARG 39 HE ARG 39 -1.340 -11.400 7.943 316 HH11 ARG 39 HH11 ARG 39 -4.242 -10.520 9.682 317 HH12 ARG 39 HH12 ARG 39 -4.074 -11.788 10.845 318 HH21 ARG 39 HH21 ARG 39 -1.125 -13.065 9.471 319 HH22 ARG 39 HH22 ARG 39 -2.305 -13.232 10.728 320 H ASN 40 HN ASN 40 2.345 -7.960 6.243 321 HA ASN 40 HA ASN 40 3.554 -10.202 4.864 322 HB2 ASN 40 HB2 ASN 40 5.450 -8.043 5.006 323 HB3 ASN 40 HB1 ASN 40 5.059 -9.106 3.690 324 HD21 ASN 40 HD21 ASN 40 5.701 -6.273 3.852 325 HD22 ASN 40 HD22 ASN 40 4.480 -5.542 2.895 326 H ASN 41 HN ASN 41 5.423 -10.846 5.732 327 HA ASN 41 HA ASN 41 5.456 -10.969 8.489 328 HB2 ASN 41 HB2 ASN 41 7.861 -11.949 8.012 329 HB3 ASN 41 HB1 ASN 41 6.427 -12.817 7.490 330 HD21 ASN 41 HD21 ASN 41 7.171 -9.965 5.798 331 HD22 ASN 41 HD22 ASN 41 7.743 -10.673 4.363 332 H ILE 42 HN ILE 42 6.808 -8.547 6.429 333 HA ILE 42 HA ILE 42 8.926 -7.764 8.119 334 HB ILE 42 HB ILE 42 7.664 -6.249 5.878 335 HG12 ILE 42 HG12 ILE 42 9.925 -7.333 4.857 336 HG13 ILE 42 HG11 ILE 42 9.375 -8.632 5.905 337 HG21 ILE 42 HG21 ILE 42 9.275 -5.208 7.572 338 HG22 ILE 42 HG22 ILE 42 9.527 -4.937 5.850 339 HG23 ILE 42 HG23 ILE 42 10.505 -6.126 6.710 340 HD11 ILE 42 HD11 ILE 42 8.362 -9.054 3.858 341 HD12 ILE 42 HD12 ILE 42 7.944 -7.361 3.617 342 HD13 ILE 42 HD13 ILE 42 7.112 -8.310 4.850 343 H LEU 43 HN LEU 43 5.851 -6.440 7.063 344 HA LEU 43 HA LEU 43 5.887 -4.546 9.255 345 HB2 LEU 43 HB2 LEU 43 3.953 -4.651 6.968 346 HB3 LEU 43 HB1 LEU 43 4.169 -3.343 8.111 347 HG LEU 43 HG LEU 43 5.294 -2.456 6.390 348 HD11 LEU 43 HD11 LEU 43 7.650 -2.646 6.616 349 HD12 LEU 43 HD12 LEU 43 7.510 -4.259 7.305 350 HD13 LEU 43 HD13 LEU 43 6.945 -2.862 8.219 351 HD21 LEU 43 HD21 LEU 43 5.346 -5.194 5.431 352 HD22 LEU 43 HD22 LEU 43 6.771 -4.259 4.975 353 HD23 LEU 43 HD23 LEU 43 5.159 -3.678 4.547 354 H VAL 44 HN VAL 44 4.623 -7.562 8.397 355 HA VAL 44 HA VAL 44 2.734 -7.354 10.587 356 HB VAL 44 HB VAL 44 1.738 -8.565 8.102 357 HG11 VAL 44 HG11 VAL 44 -0.256 -8.679 9.180 358 HG12 VAL 44 HG12 VAL 44 0.040 -7.198 10.095 359 HG13 VAL 44 HG13 VAL 44 0.809 -8.708 10.581 360 HG21 VAL 44 HG21 VAL 44 2.438 -6.008 7.999 361 HG22 VAL 44 HG22 VAL 44 0.878 -5.829 8.785 362 HG23 VAL 44 HG23 VAL 44 0.986 -6.608 7.211 363 HA PRO 45 HA PRO 45 5.319 -11.208 10.637 364 HB2 PRO 45 HB2 PRO 45 4.589 -10.432 13.421 365 HB3 PRO 45 HB1 PRO 45 6.089 -11.181 12.865 366 HG2 PRO 45 HG2 PRO 45 6.061 -8.643 13.422 367 HG3 PRO 45 HG1 PRO 45 6.794 -9.149 11.881 368 HD2 PRO 45 HD2 PRO 45 4.099 -7.955 12.401 369 HD3 PRO 45 HD1 PRO 45 5.235 -7.635 11.106 370 H THR 46 HN THR 46 2.457 -10.018 12.127 371 HA THR 46 HA THR 46 0.641 -11.857 11.274 372 HB THR 46 HB THR 46 2.057 -13.483 12.588 373 HG1 THR 46 HG1 THR 46 -0.644 -13.157 13.371 374 HG21 THR 46 HG21 THR 46 1.184 -13.413 15.109 375 HG22 THR 46 HG22 THR 46 1.309 -11.684 14.795 376 HG23 THR 46 HG23 THR 46 2.721 -12.721 14.594 377 H ASP 47 HN ASP 47 -1.455 -11.587 12.214 378 HA ASP 47 HA ASP 47 -3.111 -10.541 13.424 379 HB2 ASP 47 HB2 ASP 47 -1.170 -9.122 15.087 380 HB3 ASP 47 HB1 ASP 47 -2.724 -9.786 15.548 381 H PHE 48 HN PHE 48 -2.674 -9.193 11.147 382 HA PHE 48 HA PHE 48 -2.099 -6.450 11.653 383 HB2 PHE 48 HB2 PHE 48 -2.042 -8.047 9.429 384 HB3 PHE 48 HB1 PHE 48 -3.536 -7.168 9.188 385 HD1 PHE 48 HD1 PHE 48 -1.383 -4.994 10.957 386 HD2 PHE 48 HD2 PHE 48 -2.011 -6.704 7.113 387 HE1 PHE 48 HE1 PHE 48 -0.111 -3.170 9.900 388 HE2 PHE 48 HE2 PHE 48 -0.721 -4.906 6.087 389 HZ PHE 48 HZ PHE 48 0.225 -3.133 7.475 390 H THR 49 HN THR 49 -3.649 -5.375 12.744 391 HA THR 49 HA THR 49 -6.179 -6.183 13.319 392 HB THR 49 HB THR 49 -5.960 -3.299 12.768 393 HG1 THR 49 HG1 THR 49 -4.270 -4.678 14.579 394 HG21 THR 49 HG21 THR 49 -6.868 -4.975 15.055 395 HG22 THR 49 HG22 THR 49 -7.800 -3.901 14.004 396 HG23 THR 49 HG23 THR 49 -6.663 -3.226 15.177 397 H TRP 50 HN TRP 50 -7.172 -7.137 11.662 398 HA TRP 50 HA TRP 50 -7.584 -6.442 9.060 399 HB2 TRP 50 HB2 TRP 50 -9.447 -7.614 11.101 400 HB3 TRP 50 HB1 TRP 50 -9.911 -7.466 9.465 401 HD1 TRP 50 HD1 TRP 50 -6.330 -8.500 9.948 402 HE1 TRP 50 HE1 TRP 50 -6.065 -11.012 9.467 403 HE3 TRP 50 HE3 TRP 50 -11.265 -9.796 9.670 404 HZ2 TRP 50 HZ2 TRP 50 -7.728 -13.251 9.030 405 HZ3 TRP 50 HZ3 TRP 50 -11.843 -12.143 9.216 406 HH2 TRP 50 HH2 TRP 50 -10.110 -13.835 8.902 407 H VAL 51 HN VAL 51 -8.921 -4.997 11.901 408 HA VAL 51 HA VAL 51 -11.148 -3.689 10.994 409 HB VAL 51 HB VAL 51 -10.314 -3.782 13.377 410 HG11 VAL 51 HG11 VAL 51 -8.821 -2.214 14.228 411 HG12 VAL 51 HG12 VAL 51 -8.894 -1.223 12.771 412 HG13 VAL 51 HG13 VAL 51 -8.054 -2.774 12.741 413 HG21 VAL 51 HG21 VAL 51 -11.906 -2.295 13.852 414 HG22 VAL 51 HG22 VAL 51 -12.022 -2.022 12.113 415 HG23 VAL 51 HG23 VAL 51 -10.997 -0.982 13.103 416 H ASP 52 HN ASP 52 -7.954 -2.405 11.274 417 HA ASP 52 HA ASP 52 -8.337 -0.802 8.907 418 HB2 ASP 52 HB2 ASP 52 -9.263 0.485 10.785 419 HB3 ASP 52 HB1 ASP 52 -7.695 0.417 11.562 420 H ASN 53 HN ASN 53 -6.318 -2.431 11.032 421 HA ASN 53 HA ASN 53 -3.943 -1.084 10.123 422 HB2 ASN 53 HB2 ASN 53 -4.197 -3.473 11.922 423 HB3 ASN 53 HB1 ASN 53 -2.709 -2.621 11.571 424 HD21 ASN 53 HD21 ASN 53 -5.179 -0.350 11.747 425 HD22 ASN 53 HD22 ASN 53 -5.026 0.085 13.402 426 H GLY 54 HN GLY 54 -5.860 -3.488 9.073 427 HA2 GLY 54 HA2 GLY 54 -3.825 -4.909 7.696 428 HA3 GLY 54 HA1 GLY 54 -5.570 -5.116 7.584 429 H ILE 55 HN ILE 55 -3.436 -4.631 5.569 430 HA ILE 55 HA ILE 55 -4.083 -2.067 4.481 431 HB ILE 55 HB ILE 55 -2.009 -2.411 3.692 432 HG12 ILE 55 HG12 ILE 55 -2.029 -3.965 1.569 433 HG13 ILE 55 HG11 ILE 55 -3.754 -3.737 1.759 434 HG21 ILE 55 HG21 ILE 55 -2.424 -5.304 3.792 435 HG22 ILE 55 HG22 ILE 55 -1.619 -4.314 4.994 436 HG23 ILE 55 HG23 ILE 55 -0.919 -4.492 3.387 437 HD11 ILE 55 HD11 ILE 55 -1.684 -1.645 1.394 438 HD12 ILE 55 HD12 ILE 55 -3.341 -1.304 1.886 439 HD13 ILE 55 HD13 ILE 55 -3.027 -2.056 0.328 440 H ALA 56 HN ALA 56 -5.867 -1.660 3.244 441 HA ALA 56 HA ALA 56 -7.340 -3.827 2.171 442 HB1 ALA 56 HB1 ALA 56 -8.354 -1.663 0.862 443 HB2 ALA 56 HB2 ALA 56 -7.688 -0.915 2.314 444 HB3 ALA 56 HB3 ALA 56 -8.888 -2.199 2.455 445 H ALA 57 HN ALA 57 -5.938 -4.930 1.004 446 HA ALA 57 HA ALA 57 -4.069 -4.315 -0.663 447 HB1 ALA 57 HB1 ALA 57 -4.247 -6.363 -1.658 448 HB2 ALA 57 HB2 ALA 57 -6.008 -6.278 -1.747 449 HB3 ALA 57 HB3 ALA 57 -5.216 -6.586 -0.202 450 H ASP 58 HN ASP 58 -7.417 -3.786 -1.494 451 HA ASP 58 HA ASP 58 -7.222 -3.371 -4.216 452 HB2 ASP 58 HB2 ASP 58 -9.324 -3.386 -2.837 453 HB3 ASP 58 HB1 ASP 58 -8.923 -1.737 -2.414 454 H ASP 59 HN ASP 59 -6.435 -1.258 -1.570 455 HA ASP 59 HA ASP 59 -6.036 1.100 -3.034 456 HB2 ASP 59 HB2 ASP 59 -4.650 0.329 -0.473 457 HB3 ASP 59 HB1 ASP 59 -5.108 1.918 -1.025 458 H VAL 60 HN VAL 60 -3.986 -1.710 -2.454 459 HA VAL 60 HA VAL 60 -1.711 -0.251 -3.459 460 HB VAL 60 HB VAL 60 -0.384 -2.084 -2.756 461 HG11 VAL 60 HG11 VAL 60 -2.326 -0.996 -0.785 462 HG12 VAL 60 HG12 VAL 60 -0.734 -0.378 -1.194 463 HG13 VAL 60 HG13 VAL 60 -0.886 -1.902 -0.319 464 HG21 VAL 60 HG21 VAL 60 -2.726 -3.500 -2.970 465 HG22 VAL 60 HG22 VAL 60 -2.346 -3.514 -1.253 466 HG23 VAL 60 HG23 VAL 60 -1.169 -4.115 -2.431 467 H ILE 61 HN ILE 61 -0.184 -2.052 -4.621 468 HA ILE 61 HA ILE 61 -1.709 -3.242 -6.762 469 HB ILE 61 HB ILE 61 0.320 -2.040 -8.092 470 HG12 ILE 61 HG12 ILE 61 -0.804 0.167 -6.605 471 HG13 ILE 61 HG11 ILE 61 0.285 -0.789 -5.672 472 HG21 ILE 61 HG21 ILE 61 -1.419 -0.914 -9.119 473 HG22 ILE 61 HG22 ILE 61 -2.186 -0.576 -7.558 474 HG23 ILE 61 HG23 ILE 61 -2.309 -2.195 -8.278 475 HD11 ILE 61 HD11 ILE 61 0.887 1.226 -7.491 476 HD12 ILE 61 HD12 ILE 61 1.470 -0.296 -8.176 477 HD13 ILE 61 HD13 ILE 61 1.993 0.213 -6.571 478 H GLU 62 HN GLU 62 -1.049 -5.253 -6.808 479 HA GLU 62 HA GLU 62 1.333 -6.228 -5.714 480 HB2 GLU 62 HB2 GLU 62 0.582 -8.212 -7.416 481 HB3 GLU 62 HB1 GLU 62 -0.041 -8.001 -5.794 482 HG2 GLU 62 HG2 GLU 62 -1.818 -8.410 -7.397 483 HG3 GLU 62 HG1 GLU 62 -1.964 -6.805 -6.685 484 H VAL 63 HN VAL 63 3.297 -6.290 -6.392 485 HA VAL 63 HA VAL 63 3.839 -5.915 -9.254 486 HB VAL 63 HB VAL 63 6.221 -5.456 -8.294 487 HG11 VAL 63 HG11 VAL 63 5.326 -3.626 -9.323 488 HG12 VAL 63 HG12 VAL 63 5.390 -3.044 -7.664 489 HG13 VAL 63 HG13 VAL 63 3.871 -3.643 -8.327 490 HG21 VAL 63 HG21 VAL 63 6.246 -4.502 -6.059 491 HG22 VAL 63 HG22 VAL 63 5.717 -6.185 -6.019 492 HG23 VAL 63 HG23 VAL 63 4.538 -4.887 -5.872 493 H THR 64 HN THR 64 5.598 -7.210 -10.171 494 HA THR 64 HA THR 64 5.615 -9.892 -9.054 495 HB THR 64 HB THR 64 6.410 -10.659 -11.096 496 HG1 THR 64 HG1 THR 64 7.517 -9.302 -12.575 497 HG21 THR 64 HG21 THR 64 5.423 -9.032 -12.915 498 HG22 THR 64 HG22 THR 64 4.669 -8.299 -11.502 499 HG23 THR 64 HG23 THR 64 4.385 -9.998 -11.868 500 H SER 65 HN SER 65 7.663 -11.073 -8.806 501 HA SER 65 HA SER 65 9.314 -10.166 -6.913 502 HB2 SER 65 HB2 SER 65 10.924 -11.842 -7.547 503 HB3 SER 65 HB1 SER 65 9.311 -12.469 -7.887 504 HG SER 65 HG SER 65 11.122 -11.342 -9.760 505 H ASN 66 HN ASN 66 9.689 -9.387 -10.338 506 HA ASN 66 HA ASN 66 12.217 -8.145 -9.976 507 HB2 ASN 66 HB2 ASN 66 10.984 -9.152 -12.129 508 HB3 ASN 66 HB1 ASN 66 10.612 -7.445 -12.294 509 HD21 ASN 66 HD21 ASN 66 11.897 -6.757 -13.878 510 HD22 ASN 66 HD22 ASN 66 13.615 -6.947 -13.917 511 H GLY 67 HN GLY 67 9.145 -7.284 -9.219 512 HA2 GLY 67 HA2 GLY 67 8.513 -5.309 -8.130 513 HA3 GLY 67 HA1 GLY 67 9.862 -4.481 -8.891 514 H THR 68 HN THR 68 7.831 -6.526 -10.807 515 HA THR 68 HA THR 68 7.153 -4.378 -12.512 516 HB THR 68 HB THR 68 6.857 -7.283 -12.488 517 HG1 THR 68 HG1 THR 68 7.032 -5.531 -14.692 518 HG21 THR 68 HG21 THR 68 5.147 -7.333 -14.233 519 HG22 THR 68 HG22 THR 68 4.831 -5.624 -13.934 520 HG23 THR 68 HG23 THR 68 4.522 -6.811 -12.671 521 H ARG 69 HN ARG 69 5.626 -2.937 -12.141 522 HA ARG 69 HA ARG 69 3.625 -3.314 -10.148 523 HB2 ARG 69 HB2 ARG 69 4.559 -1.128 -11.859 524 HB3 ARG 69 HB1 ARG 69 2.833 -1.079 -11.527 525 HG2 ARG 69 HG2 ARG 69 3.142 -0.776 -9.262 526 HG3 ARG 69 HG1 ARG 69 4.766 -1.465 -9.285 527 HD2 ARG 69 HD2 ARG 69 5.493 0.646 -9.266 528 HD3 ARG 69 HD1 ARG 69 4.998 0.705 -10.957 529 HE ARG 69 HE ARG 69 3.706 1.978 -8.715 530 HH11 ARG 69 HH11 ARG 69 3.333 0.851 -11.998 531 HH12 ARG 69 HH12 ARG 69 2.012 1.915 -12.344 532 HH21 ARG 69 HH21 ARG 69 1.967 3.376 -9.171 533 HH22 ARG 69 HH22 ARG 69 1.239 3.349 -10.742 534 H THR 70 HN THR 70 1.474 -3.591 -10.288 535 HA THR 70 HA THR 70 -0.392 -4.642 -11.085 536 HB THR 70 HB THR 70 -1.375 -3.438 -13.072 537 HG1 THR 70 HG1 THR 70 0.852 -1.722 -12.852 538 HG21 THR 70 HG21 THR 70 -2.195 -2.103 -11.519 539 HG22 THR 70 HG22 THR 70 -0.764 -1.086 -11.684 540 HG23 THR 70 HG23 THR 70 -0.793 -2.379 -10.484 541 H SER 71 HN SER 71 0.825 -6.642 -11.492 542 HA SER 71 HA SER 71 1.364 -7.221 -14.307 543 HB2 SER 71 HB2 SER 71 2.869 -7.925 -12.302 544 HB3 SER 71 HB1 SER 71 1.674 -9.197 -12.061 545 HG SER 71 HG SER 71 3.123 -10.084 -13.417 546 H ASP 72 HN ASP 72 -0.575 -8.480 -11.613 547 HA ASP 72 HA ASP 72 -2.215 -10.014 -13.500 548 HB2 ASP 72 HB2 ASP 72 -1.960 -10.081 -10.490 549 HB3 ASP 72 HB1 ASP 72 -3.187 -10.987 -11.370 550 H GLN 73 HN GLN 73 -2.276 -7.248 -11.419 551 HA GLN 73 HA GLN 73 -3.755 -5.524 -11.305 552 HB2 GLN 73 HB2 GLN 73 -4.804 -6.977 -13.541 553 HB3 GLN 73 HB1 GLN 73 -6.136 -6.429 -12.534 554 HG2 GLN 73 HG2 GLN 73 -4.126 -4.374 -12.968 555 HG3 GLN 73 HG1 GLN 73 -4.840 -4.968 -14.465 556 HE21 GLN 73 HE21 GLN 73 -5.169 -2.366 -13.545 557 HE22 GLN 73 HE22 GLN 73 -6.830 -2.126 -13.138 558 H VAL 74 HN VAL 74 -4.632 -8.752 -10.596 559 HA VAL 74 HA VAL 74 -6.517 -7.851 -8.524 560 HB VAL 74 HB VAL 74 -7.504 -9.445 -10.107 561 HG11 VAL 74 HG11 VAL 74 -5.301 -10.582 -10.612 562 HG12 VAL 74 HG12 VAL 74 -6.700 -11.640 -10.438 563 HG13 VAL 74 HG13 VAL 74 -5.537 -11.494 -9.121 564 HG21 VAL 74 HG21 VAL 74 -7.042 -10.741 -7.425 565 HG22 VAL 74 HG22 VAL 74 -8.415 -10.988 -8.503 566 HG23 VAL 74 HG23 VAL 74 -8.180 -9.426 -7.718 567 H LEU 75 HN LEU 75 -5.616 -7.734 -6.564 568 HA LEU 75 HA LEU 75 -3.104 -8.864 -5.956 569 HB2 LEU 75 HB2 LEU 75 -4.780 -6.992 -4.805 570 HB3 LEU 75 HB1 LEU 75 -4.659 -8.252 -3.600 571 HG LEU 75 HG LEU 75 -2.131 -7.321 -4.840 572 HD11 LEU 75 HD11 LEU 75 -2.653 -5.673 -2.595 573 HD12 LEU 75 HD12 LEU 75 -3.975 -5.475 -3.744 574 HD13 LEU 75 HD13 LEU 75 -2.311 -5.197 -4.257 575 HD21 LEU 75 HD21 LEU 75 -1.274 -7.727 -2.624 576 HD22 LEU 75 HD22 LEU 75 -2.222 -9.116 -3.152 577 HD23 LEU 75 HD23 LEU 75 -2.905 -7.968 -2.001 578 H GLN 76 HN GLN 76 -2.503 -10.441 -4.585 579 HA GLN 76 HA GLN 76 -4.366 -12.219 -3.332 580 HB2 GLN 76 HB2 GLN 76 -2.561 -13.394 -5.445 581 HB3 GLN 76 HB1 GLN 76 -3.842 -14.200 -4.552 582 HG2 GLN 76 HG2 GLN 76 -5.491 -12.755 -5.696 583 HG3 GLN 76 HG1 GLN 76 -4.177 -12.067 -6.649 584 HE21 GLN 76 HE21 GLN 76 -5.552 -15.211 -5.761 585 HE22 GLN 76 HE22 GLN 76 -5.346 -15.935 -7.317 586 H LYS 77 HN LYS 77 -3.431 -13.068 -1.563 587 HA LYS 77 HA LYS 77 -0.784 -12.288 -0.899 588 HB2 LYS 77 HB2 LYS 77 -1.079 -13.170 1.212 589 HB3 LYS 77 HB1 LYS 77 -2.654 -12.536 0.755 590 HG2 LYS 77 HG2 LYS 77 -2.057 -15.409 0.261 591 HG3 LYS 77 HG1 LYS 77 -2.431 -14.878 1.899 592 HD2 LYS 77 HD2 LYS 77 -4.516 -13.850 1.012 593 HD3 LYS 77 HD1 LYS 77 -4.157 -14.570 -0.555 594 HE2 LYS 77 HE2 LYS 77 -4.269 -16.789 0.408 595 HE3 LYS 77 HE1 LYS 77 -4.515 -16.106 2.015 596 HZ1 LYS 77 HZ1 LYS 77 -6.673 -16.299 1.568 597 HZ2 LYS 77 HZ2 LYS 77 -6.414 -16.554 -0.083 598 HZ3 LYS 77 HZ3 LYS 77 -6.491 -14.978 0.526 599 H GLY 78 HN GLY 78 0.987 -13.500 -0.320 600 HA2 GLY 78 HA2 GLY 78 1.975 -15.734 -0.123 601 HA3 GLY 78 HA1 GLY 78 1.047 -16.183 -1.549 602 H GLY 79 HN GLY 79 2.341 -12.987 -1.567 603 HA2 GLY 79 HA2 GLY 79 4.790 -13.912 -2.878 604 HA3 GLY 79 HA1 GLY 79 3.629 -13.101 -3.909 605 H TYR 80 HN TYR 80 3.732 -11.017 -4.086 606 HA TYR 80 HA TYR 80 4.864 -9.323 -2.043 607 HB2 TYR 80 HB2 TYR 80 6.041 -8.957 -4.760 608 HB3 TYR 80 HB1 TYR 80 6.731 -8.584 -3.189 609 HD1 TYR 80 HD1 TYR 80 5.965 -11.372 -5.509 610 HD2 TYR 80 HD2 TYR 80 8.226 -10.074 -2.146 611 HE1 TYR 80 HE1 TYR 80 7.312 -13.426 -5.631 612 HE2 TYR 80 HE2 TYR 80 9.579 -12.124 -2.257 613 HH TYR 80 HH TYR 80 9.672 -14.232 -3.160 614 H PHE 81 HN PHE 81 4.581 -7.035 -2.580 615 HA PHE 81 HA PHE 81 2.984 -6.412 -4.880 616 HB2 PHE 81 HB2 PHE 81 1.152 -5.303 -3.597 617 HB3 PHE 81 HB1 PHE 81 1.143 -7.056 -3.513 618 HD1 PHE 81 HD1 PHE 81 2.691 -7.947 -1.484 619 HD2 PHE 81 HD2 PHE 81 0.671 -4.187 -1.665 620 HE1 PHE 81 HE1 PHE 81 2.619 -7.852 0.984 621 HE2 PHE 81 HE2 PHE 81 0.603 -4.085 0.762 622 HZ PHE 81 HZ PHE 81 1.577 -5.916 2.111 623 H VAL 82 HN VAL 82 2.284 -4.082 -4.759 624 HA VAL 82 HA VAL 82 4.260 -2.529 -3.271 625 HB VAL 82 HB VAL 82 4.307 -3.013 -6.116 626 HG11 VAL 82 HG11 VAL 82 4.908 -0.451 -6.505 627 HG12 VAL 82 HG12 VAL 82 3.666 -0.233 -5.277 628 HG13 VAL 82 HG13 VAL 82 3.287 -1.087 -6.773 629 HG21 VAL 82 HG21 VAL 82 6.528 -2.110 -5.940 630 HG22 VAL 82 HG22 VAL 82 6.206 -3.112 -4.525 631 HG23 VAL 82 HG23 VAL 82 6.145 -1.354 -4.393 632 H ILE 83 HN ILE 83 3.284 -0.917 -2.289 633 HA ILE 83 HA ILE 83 0.507 -0.478 -2.654 634 HB ILE 83 HB ILE 83 2.570 1.001 -1.112 635 HG12 ILE 83 HG12 ILE 83 2.031 -0.243 0.727 636 HG13 ILE 83 HG11 ILE 83 0.353 -0.406 0.243 637 HG21 ILE 83 HG21 ILE 83 1.019 2.667 -1.459 638 HG22 ILE 83 HG22 ILE 83 0.536 1.989 0.095 639 HG23 ILE 83 HG23 ILE 83 -0.339 1.547 -1.373 640 HD11 ILE 83 HD11 ILE 83 0.975 -2.140 -1.336 641 HD12 ILE 83 HD12 ILE 83 1.519 -2.536 0.293 642 HD13 ILE 83 HD13 ILE 83 2.668 -1.940 -0.895 643 H ASN 84 HN ASN 84 -0.287 0.580 -4.338 644 HA ASN 84 HA ASN 84 1.113 2.276 -6.000 645 HB2 ASN 84 HB2 ASN 84 -1.493 1.328 -5.808 646 HB3 ASN 84 HB1 ASN 84 -1.658 3.062 -5.697 647 HD21 ASN 84 HD21 ASN 84 0.321 3.938 -7.335 648 HD22 ASN 84 HD22 ASN 84 -0.024 3.458 -8.953 649 HA PRO 85 HA PRO 85 1.617 5.662 -3.015 650 HB2 PRO 85 HB2 PRO 85 3.237 7.160 -4.517 651 HB3 PRO 85 HB1 PRO 85 3.820 5.642 -3.808 652 HG2 PRO 85 HG2 PRO 85 2.659 6.086 -6.554 653 HG3 PRO 85 HG1 PRO 85 4.212 5.377 -6.134 654 HD2 PRO 85 HD2 PRO 85 2.171 3.794 -6.635 655 HD3 PRO 85 HD1 PRO 85 3.244 3.430 -5.263 656 H ASN 86 HN ASN 86 0.702 5.801 -6.292 657 HA ASN 86 HA ASN 86 -0.234 8.462 -6.214 658 HB2 ASN 86 HB2 ASN 86 -0.024 6.359 -8.220 659 HB3 ASN 86 HB1 ASN 86 -1.509 7.282 -8.365 660 HD21 ASN 86 HD21 ASN 86 1.848 8.063 -7.548 661 HD22 ASN 86 HD22 ASN 86 2.014 9.338 -8.701 662 H ASN 87 HN ASN 87 -1.526 5.353 -5.530 663 HA ASN 87 HA ASN 87 -4.281 6.189 -5.364 664 HB2 ASN 87 HB2 ASN 87 -2.770 3.820 -5.356 665 HB3 ASN 87 HB1 ASN 87 -3.649 3.932 -3.845 666 HD21 ASN 87 HD21 ASN 87 -4.074 1.953 -5.522 667 HD22 ASN 87 HD22 ASN 87 -5.648 2.060 -6.231 668 H VAL 88 HN VAL 88 -1.508 6.670 -3.694 669 HA VAL 88 HA VAL 88 -2.574 6.509 -1.087 670 HB VAL 88 HB VAL 88 0.147 6.886 -2.264 671 HG11 VAL 88 HG11 VAL 88 0.419 8.287 -0.497 672 HG12 VAL 88 HG12 VAL 88 0.617 6.766 0.378 673 HG13 VAL 88 HG13 VAL 88 -0.944 7.603 0.389 674 HG21 VAL 88 HG21 VAL 88 -1.430 4.734 -1.418 675 HG22 VAL 88 HG22 VAL 88 -0.166 4.933 -0.195 676 HG23 VAL 88 HG23 VAL 88 0.271 4.705 -1.905 677 H LYS 89 HN LYS 89 -2.950 8.072 0.027 678 HA LYS 89 HA LYS 89 -2.968 10.743 -1.008 679 HB2 LYS 89 HB2 LYS 89 -3.842 9.707 1.646 680 HB3 LYS 89 HB1 LYS 89 -4.144 11.322 1.041 681 HG2 LYS 89 HG2 LYS 89 -6.105 9.906 0.880 682 HG3 LYS 89 HG1 LYS 89 -5.557 10.413 -0.704 683 HD2 LYS 89 HD2 LYS 89 -4.535 7.866 0.299 684 HD3 LYS 89 HD1 LYS 89 -6.249 7.924 -0.074 685 HE2 LYS 89 HE2 LYS 89 -3.982 7.719 -1.811 686 HE3 LYS 89 HE1 LYS 89 -5.688 7.504 -2.169 687 HZ1 LYS 89 HZ1 LYS 89 -5.912 9.866 -2.529 688 HZ2 LYS 89 HZ2 LYS 89 -4.682 9.256 -3.515 689 HZ3 LYS 89 HZ3 LYS 89 -4.292 10.122 -2.120 690 H SER 90 HN SER 90 -1.727 8.897 1.608 691 HA SER 90 HA SER 90 0.852 9.904 1.680 692 HB2 SER 90 HB2 SER 90 0.937 11.861 2.795 693 HB3 SER 90 HB1 SER 90 -0.772 11.989 2.395 694 HG SER 90 HG SER 90 -1.163 11.884 4.443 695 H VAL 91 HN VAL 91 1.930 9.645 3.944 696 HA VAL 91 HA VAL 91 0.846 7.255 5.173 697 HB VAL 91 HB VAL 91 3.450 8.616 5.636 698 HG11 VAL 91 HG11 VAL 91 3.341 7.447 7.561 699 HG12 VAL 91 HG12 VAL 91 3.837 6.113 6.519 700 HG13 VAL 91 HG13 VAL 91 2.136 6.330 6.923 701 HG21 VAL 91 HG21 VAL 91 2.586 6.962 3.516 702 HG22 VAL 91 HG22 VAL 91 3.740 6.043 4.483 703 HG23 VAL 91 HG23 VAL 91 4.203 7.605 3.809 704 H GLY 92 HN GLY 92 0.795 7.223 7.649 705 HA2 GLY 92 HA2 GLY 92 0.154 9.876 8.683 706 HA3 GLY 92 HA1 GLY 92 -0.904 8.498 8.943 707 H THR 93 HN THR 93 -0.361 9.600 11.059 708 HA THR 93 HA THR 93 2.043 9.113 12.460 709 HB THR 93 HB THR 93 -0.657 10.074 13.033 710 HG1 THR 93 HG1 THR 93 1.909 10.537 14.135 711 HG21 THR 93 HG21 THR 93 -0.414 9.700 15.501 712 HG22 THR 93 HG22 THR 93 0.746 8.434 15.097 713 HG23 THR 93 HG23 THR 93 -0.924 8.310 14.544 714 HA PRO 94 HA PRO 94 1.868 4.839 13.114 715 HB2 PRO 94 HB2 PRO 94 4.115 4.659 14.432 716 HB3 PRO 94 HB1 PRO 94 4.116 5.309 12.783 717 HG2 PRO 94 HG2 PRO 94 4.019 6.859 15.342 718 HG3 PRO 94 HG1 PRO 94 5.205 6.997 14.033 719 HD2 PRO 94 HD2 PRO 94 3.079 8.599 14.177 720 HD3 PRO 94 HD1 PRO 94 3.711 8.017 12.620 721 H MET 95 HN MET 95 1.686 3.329 14.757 722 HA MET 95 HA MET 95 1.350 4.202 17.501 723 HB2 MET 95 HB2 MET 95 -0.928 2.962 15.951 724 HB3 MET 95 HB1 MET 95 -0.908 3.185 17.696 725 HG2 MET 95 HG2 MET 95 -0.550 5.660 17.200 726 HG3 MET 95 HG1 MET 95 -1.018 5.269 15.547 727 HE1 MET 95 HE1 MET 95 -4.009 7.177 17.095 728 HE2 MET 95 HE2 MET 95 -2.294 7.387 16.740 729 HE3 MET 95 HE3 MET 95 -2.818 7.060 18.392 730 H LYS 96 HN LYS 96 1.810 2.601 18.963 731 HA LYS 96 HA LYS 96 2.793 0.103 17.856 732 HB2 LYS 96 HB2 LYS 96 2.798 1.122 20.706 733 HB3 LYS 96 HB1 LYS 96 3.606 -0.336 20.148 734 HG2 LYS 96 HG2 LYS 96 5.391 0.808 19.509 735 HG3 LYS 96 HG1 LYS 96 4.409 1.932 18.568 736 HD2 LYS 96 HD2 LYS 96 4.804 3.519 20.075 737 HD3 LYS 96 HD1 LYS 96 4.003 2.540 21.305 738 HE2 LYS 96 HE2 LYS 96 5.994 1.649 22.078 739 HE3 LYS 96 HE1 LYS 96 6.841 1.970 20.565 740 HZ1 LYS 96 HZ1 LYS 96 5.900 4.350 21.877 741 HZ2 LYS 96 HZ2 LYS 96 7.431 3.994 21.252 742 HZ3 LYS 96 HZ3 LYS 96 7.012 3.475 22.807 743 H GLY 97 HN GLY 97 1.658 -1.763 17.802 744 HA2 GLY 97 HA2 GLY 97 -0.122 -2.510 19.888 745 HA3 GLY 97 HA1 GLY 97 -1.027 -1.898 18.517 746 H SER 98 HN SER 98 0.182 -2.913 16.350 747 HA SER 98 HA SER 98 -0.651 -5.613 16.393 748 HB2 SER 98 HB2 SER 98 0.575 -3.783 14.407 749 HB3 SER 98 HB1 SER 98 0.786 -5.488 14.100 750 HG SER 98 HG SER 98 -1.167 -4.480 13.214 751 H GLY 99 HN GLY 99 0.768 -6.120 18.340 752 HA2 GLY 99 HA2 GLY 99 2.361 -7.908 18.683 753 HA3 GLY 99 HA1 GLY 99 3.313 -7.247 17.364 754 H GLY 100 HN GLY 100 3.573 -4.607 18.026 755 HA2 GLY 100 HA2 GLY 100 4.024 -3.690 20.497 756 HA3 GLY 100 HA1 GLY 100 5.366 -4.786 20.258 757 H LEU 101 HN LEU 101 5.104 -3.924 17.276 758 HA LEU 101 HA LEU 101 7.169 -1.999 17.295 759 HB2 LEU 101 HB2 LEU 101 5.591 -2.619 14.907 760 HB3 LEU 101 HB1 LEU 101 7.302 -2.402 15.104 761 HG LEU 101 HG LEU 101 7.206 -4.690 16.330 762 HD11 LEU 101 HD11 LEU 101 5.512 -6.177 15.559 763 HD12 LEU 101 HD12 LEU 101 4.885 -4.957 14.457 764 HD13 LEU 101 HD13 LEU 101 4.653 -4.774 16.187 765 HD21 LEU 101 HD21 LEU 101 7.928 -5.576 14.367 766 HD22 LEU 101 HD22 LEU 101 8.089 -3.835 14.095 767 HD23 LEU 101 HD23 LEU 101 6.701 -4.712 13.435 768 H SER 102 HN SER 102 6.364 -0.758 14.941 769 HA SER 102 HA SER 102 4.365 1.150 15.884 770 HB2 SER 102 HB2 SER 102 7.031 1.462 14.689 771 HB3 SER 102 HB1 SER 102 5.771 2.573 14.121 772 HG SER 102 HG SER 102 6.010 3.623 15.915 773 H TRP 103 HN TRP 103 2.612 1.018 14.754 774 HA TRP 103 HA TRP 103 2.669 0.274 11.942 775 HB2 TRP 103 HB2 TRP 103 0.545 -0.231 14.005 776 HB3 TRP 103 HB1 TRP 103 0.512 -0.735 12.346 777 HD1 TRP 103 HD1 TRP 103 3.195 -1.041 15.064 778 HE1 TRP 103 HE1 TRP 103 4.160 -3.368 15.007 779 HE3 TRP 103 HE3 TRP 103 0.223 -3.164 11.482 780 HZ2 TRP 103 HZ2 TRP 103 3.749 -5.829 13.704 781 HZ3 TRP 103 HZ3 TRP 103 0.600 -5.508 10.895 782 HH2 TRP 103 HH2 TRP 103 2.315 -6.816 12.003 783 H ALA 104 HN ALA 104 2.206 1.945 10.766 784 HA ALA 104 HA ALA 104 0.796 4.206 11.915 785 HB1 ALA 104 HB1 ALA 104 2.656 4.152 9.578 786 HB2 ALA 104 HB2 ALA 104 3.007 4.749 11.201 787 HB3 ALA 104 HB3 ALA 104 1.833 5.584 10.187 788 H GLN 105 HN GLN 105 -0.632 5.435 10.932 789 HA GLN 105 HA GLN 105 -2.487 4.055 9.308 790 HB2 GLN 105 HB2 GLN 105 -2.825 5.751 11.280 791 HB3 GLN 105 HB1 GLN 105 -2.713 6.936 9.995 792 HG2 GLN 105 HG2 GLN 105 -4.553 6.053 8.882 793 HG3 GLN 105 HG1 GLN 105 -4.550 4.612 9.883 794 HE21 GLN 105 HE21 GLN 105 -6.856 5.227 10.118 795 HE22 GLN 105 HE22 GLN 105 -7.279 6.346 11.364 796 H VAL 106 HN VAL 106 -1.876 3.949 7.087 797 HA VAL 106 HA VAL 106 -0.942 6.450 5.941 798 HB VAL 106 HB VAL 106 -0.807 3.603 4.960 799 HG11 VAL 106 HG11 VAL 106 -0.915 4.460 2.906 800 HG12 VAL 106 HG12 VAL 106 0.694 5.093 3.234 801 HG13 VAL 106 HG13 VAL 106 -0.731 6.104 3.487 802 HG21 VAL 106 HG21 VAL 106 1.492 3.759 5.287 803 HG22 VAL 106 HG22 VAL 106 0.823 4.591 6.691 804 HG23 VAL 106 HG23 VAL 106 1.461 5.527 5.329 805 H ASN 107 HN ASN 107 -2.133 7.511 4.491 806 HA ASN 107 HA ASN 107 -4.910 6.792 4.281 807 HB2 ASN 107 HB2 ASN 107 -3.324 9.232 4.143 808 HB3 ASN 107 HB1 ASN 107 -4.498 9.146 2.842 809 HD21 ASN 107 HD21 ASN 107 -5.836 7.401 5.309 810 HD22 ASN 107 HD22 ASN 107 -6.750 8.650 6.059 811 H PHE 108 HN PHE 108 -5.256 5.298 2.718 812 HA PHE 108 HA PHE 108 -4.083 5.737 0.153 813 HB2 PHE 108 HB2 PHE 108 -5.619 3.347 1.195 814 HB3 PHE 108 HB1 PHE 108 -4.934 3.501 -0.392 815 HD1 PHE 108 HD2 PHE 108 -3.578 4.012 3.038 816 HD2 PHE 108 HD1 PHE 108 -3.240 2.001 -0.692 817 HE1 PHE 108 HE2 PHE 108 -1.591 2.818 3.849 818 HE2 PHE 108 HE1 PHE 108 -1.264 0.801 0.133 819 HZ PHE 108 HZ PHE 108 -0.429 1.215 2.403 820 H THR 109 HN THR 109 -5.416 5.038 -1.595 821 HA THR 109 HA THR 109 -7.442 6.705 -2.231 822 HB THR 109 HB THR 109 -6.184 5.611 -3.861 823 HG1 THR 109 HG1 THR 109 -8.553 5.930 -4.269 824 HG21 THR 109 HG21 THR 109 -5.543 3.545 -3.571 825 HG22 THR 109 HG22 THR 109 -7.193 2.990 -3.828 826 HG23 THR 109 HG23 THR 109 -6.631 3.400 -2.205 827 H THR 110 HN THR 110 -8.079 3.270 -1.899 828 HA THR 110 HA THR 110 -10.901 3.731 -1.703 829 HB THR 110 HB THR 110 -9.786 1.042 -1.374 830 HG1 THR 110 HG1 THR 110 -8.935 0.935 -3.313 831 HG21 THR 110 HG21 THR 110 -11.897 0.575 -1.840 832 HG22 THR 110 HG22 THR 110 -11.546 1.076 -3.493 833 HG23 THR 110 HG23 THR 110 -12.220 2.233 -2.347 834 H GLY 111 HN GLY 111 -8.583 1.946 0.270 835 HA2 GLY 111 HA2 GLY 111 -10.399 1.559 2.380 836 HA3 GLY 111 HA1 GLY 111 -8.670 1.273 2.446 837 H GLY 112 HN GLY 112 -8.774 4.357 1.433 838 HA2 GLY 112 HA2 GLY 112 -8.417 6.352 2.469 839 HA3 GLY 112 HA1 GLY 112 -9.615 5.813 3.636 840 H ASN 113 HN ASN 113 -8.935 4.785 5.533 841 HA ASN 113 HA ASN 113 -6.166 5.289 6.174 842 HB2 ASN 113 HB2 ASN 113 -6.987 4.268 8.422 843 HB3 ASN 113 HB1 ASN 113 -7.538 5.874 7.992 844 HD21 ASN 113 HD21 ASN 113 -8.484 2.575 7.151 845 HD22 ASN 113 HD22 ASN 113 -10.158 2.760 7.546 846 H VAL 114 HN VAL 114 -4.643 3.790 6.256 847 HA VAL 114 HA VAL 114 -5.318 0.960 6.308 848 HB VAL 114 HB VAL 114 -3.387 1.986 4.282 849 HG11 VAL 114 HG11 VAL 114 -3.474 -0.193 3.362 850 HG12 VAL 114 HG12 VAL 114 -4.860 -0.608 4.367 851 HG13 VAL 114 HG13 VAL 114 -3.279 -0.361 5.109 852 HG21 VAL 114 HG21 VAL 114 -5.251 1.381 2.608 853 HG22 VAL 114 HG22 VAL 114 -5.344 2.936 3.438 854 HG23 VAL 114 HG23 VAL 114 -6.334 1.582 3.986 855 H TRP 115 HN TRP 115 -4.147 0.315 7.979 856 HA TRP 115 HA TRP 115 -1.768 1.794 8.633 857 HB2 TRP 115 HB2 TRP 115 -3.246 -0.332 10.099 858 HB3 TRP 115 HB1 TRP 115 -1.777 0.404 10.702 859 HD1 TRP 115 HD1 TRP 115 -5.296 1.410 9.562 860 HE1 TRP 115 HE1 TRP 115 -5.980 3.393 10.975 861 HE3 TRP 115 HE3 TRP 115 -0.958 2.141 12.097 862 HZ2 TRP 115 HZ2 TRP 115 -4.854 5.098 12.821 863 HZ3 TRP 115 HZ3 TRP 115 -0.836 4.025 13.699 864 HH2 TRP 115 HH2 TRP 115 -2.768 5.482 14.062 865 H LEU 116 HN LEU 116 0.209 0.912 9.129 866 HA LEU 116 HA LEU 116 0.852 -1.754 8.215 867 HB2 LEU 116 HB2 LEU 116 0.981 0.296 6.406 868 HB3 LEU 116 HB1 LEU 116 2.602 0.326 7.098 869 HG LEU 116 HG LEU 116 2.421 -2.297 6.586 870 HD11 LEU 116 HD11 LEU 116 0.939 -2.925 5.020 871 HD12 LEU 116 HD12 LEU 116 1.069 -1.403 4.138 872 HD13 LEU 116 HD13 LEU 116 0.043 -1.508 5.571 873 HD21 LEU 116 HD21 LEU 116 3.036 -0.243 4.473 874 HD22 LEU 116 HD22 LEU 116 3.671 -1.885 4.572 875 HD23 LEU 116 HD23 LEU 116 4.118 -0.692 5.785 876 H ASN 117 HN ASN 117 2.798 -2.460 9.175 877 HA ASN 117 HA ASN 117 3.563 -0.911 11.404 878 HB2 ASN 117 HB2 ASN 117 4.075 -2.870 12.009 879 HB3 ASN 117 HB1 ASN 117 4.343 -3.482 10.397 880 HD21 ASN 117 HD21 ASN 117 5.699 -2.402 13.292 881 HD22 ASN 117 HD22 ASN 117 7.366 -2.531 12.863 882 H THR 118 HN THR 118 4.107 0.718 11.103 883 HA THR 118 HA THR 118 5.545 1.854 8.956 884 HB THR 118 HB THR 118 3.653 2.763 10.337 885 HG1 THR 118 HG1 THR 118 4.934 4.016 8.832 886 HG21 THR 118 HG21 THR 118 3.892 3.434 12.425 887 HG22 THR 118 HG22 THR 118 5.447 4.203 12.094 888 HG23 THR 118 HG23 THR 118 5.371 2.476 12.433 889 H THR 119 HN THR 119 6.880 0.013 11.092 890 HA THR 119 HA THR 119 8.879 1.611 12.298 891 HB THR 119 HB THR 119 8.369 -0.748 12.929 892 HG1 THR 119 HG1 THR 119 10.615 -1.320 13.196 893 HG21 THR 119 HG21 THR 119 10.207 -1.729 10.823 894 HG22 THR 119 HG22 THR 119 8.518 -1.461 10.397 895 HG23 THR 119 HG23 THR 119 8.933 -2.573 11.701 896 H SER 120 HN SER 120 8.419 2.041 9.285 897 HA SER 120 HA SER 120 10.988 2.757 8.587 898 HB2 SER 120 HB2 SER 120 10.534 0.974 6.460 899 HB3 SER 120 HB1 SER 120 11.802 0.855 7.680 900 HG SER 120 HG SER 120 10.778 -0.994 7.997 901 H LYS 121 HN LYS 121 10.584 4.487 7.346 902 HA LYS 121 HA LYS 121 7.961 5.010 6.375 903 HB2 LYS 121 HB2 LYS 121 9.430 6.736 7.244 904 HB3 LYS 121 HB1 LYS 121 10.565 6.459 5.932 905 HG2 LYS 121 HG2 LYS 121 9.183 7.434 4.346 906 HG3 LYS 121 HG1 LYS 121 7.734 7.206 5.327 907 HD2 LYS 121 HD2 LYS 121 7.999 9.175 6.350 908 HD3 LYS 121 HD1 LYS 121 9.713 8.877 6.646 909 HE2 LYS 121 HE2 LYS 121 10.260 9.604 4.402 910 HE3 LYS 121 HE1 LYS 121 8.550 9.805 4.022 911 HZ1 LYS 121 HZ1 LYS 121 9.108 11.932 4.558 912 HZ2 LYS 121 HZ2 LYS 121 10.299 11.478 5.670 913 HZ3 LYS 121 HZ3 LYS 121 8.664 11.382 6.095 914 H ASP 122 HN ASP 122 11.050 4.046 4.985 915 HA ASP 122 HA ASP 122 10.165 4.059 2.293 916 HB2 ASP 122 HB2 ASP 122 12.386 2.593 3.692 917 HB3 ASP 122 HB1 ASP 122 12.142 2.579 1.949 918 H ASN 123 HN ASN 123 9.199 2.343 4.963 919 HA ASN 123 HA ASN 123 8.987 -0.277 4.022 920 HB2 ASN 123 HB2 ASN 123 8.656 0.027 6.381 921 HB3 ASN 123 HB1 ASN 123 7.542 1.352 6.090 922 HD21 ASN 123 HD21 ASN 123 7.418 -1.478 4.184 923 HD22 ASN 123 HD22 ASN 123 5.895 -1.966 4.730 924 H LEU 124 HN LEU 124 6.525 2.175 4.175 925 HA LEU 124 HA LEU 124 4.708 0.764 2.576 926 HB2 LEU 124 HB2 LEU 124 4.570 3.684 2.425 927 HB3 LEU 124 HB1 LEU 124 3.313 2.526 2.813 928 HG LEU 124 HG LEU 124 3.693 3.926 4.692 929 HD11 LEU 124 HD11 LEU 124 4.549 2.188 6.367 930 HD12 LEU 124 HD12 LEU 124 4.776 1.125 4.975 931 HD13 LEU 124 HD13 LEU 124 3.165 1.726 5.377 932 HD21 LEU 124 HD21 LEU 124 6.261 3.352 5.594 933 HD22 LEU 124 HD22 LEU 124 5.691 4.877 4.914 934 HD23 LEU 124 HD23 LEU 124 6.442 3.665 3.863 935 H LEU 125 HN LEU 125 6.726 3.537 1.877 936 HA LEU 125 HA LEU 125 6.259 3.643 -0.853 937 HB2 LEU 125 HB2 LEU 125 8.612 4.463 0.824 938 HB3 LEU 125 HB1 LEU 125 8.474 4.831 -0.868 939 HG LEU 125 HG LEU 125 6.241 5.966 -0.226 940 HD11 LEU 125 HD11 LEU 125 7.082 6.780 2.321 941 HD12 LEU 125 HD12 LEU 125 7.230 5.020 2.284 942 HD13 LEU 125 HD13 LEU 125 5.682 5.784 1.911 943 HD21 LEU 125 HD21 LEU 125 9.026 6.922 0.143 944 HD22 LEU 125 HD22 LEU 125 7.732 7.943 0.769 945 HD23 LEU 125 HD23 LEU 125 7.763 7.506 -0.940 946 H TYR 126 HN TYR 126 8.843 1.988 0.953 947 HA TYR 126 HA TYR 126 9.661 0.745 -1.597 948 HB2 TYR 126 HB2 TYR 126 11.116 1.898 0.644 949 HB3 TYR 126 HB1 TYR 126 11.698 0.304 0.210 950 HD1 TYR 126 HD1 TYR 126 10.739 3.526 -1.384 951 HD2 TYR 126 HD2 TYR 126 13.349 0.169 -1.415 952 HE1 TYR 126 HE1 TYR 126 12.030 4.554 -3.212 953 HE2 TYR 126 HE2 TYR 126 14.646 1.182 -3.242 954 HH TYR 126 HH TYR 126 14.709 2.844 -4.767 955 H GLY 127 HN GLY 127 8.772 0.132 1.746 956 HA2 GLY 127 HA2 GLY 127 7.753 -1.994 2.337 957 HA3 GLY 127 HA1 GLY 127 8.628 -2.745 1.012 958 H LYS 128 HN LYS 128 10.208 -0.485 3.087 959 HA LYS 128 HA LYS 128 12.158 -2.385 3.839 960 HB2 LYS 128 HB2 LYS 128 11.628 0.424 4.784 961 HB3 LYS 128 HB1 LYS 128 13.077 -0.495 5.102 962 HG2 LYS 128 HG2 LYS 128 13.221 -0.669 2.518 963 HG3 LYS 128 HG1 LYS 128 12.149 0.736 2.569 964 HD2 LYS 128 HD2 LYS 128 13.748 2.061 3.662 965 HD3 LYS 128 HD1 LYS 128 14.651 0.654 4.225 966 HE2 LYS 128 HE2 LYS 128 16.039 1.248 2.538 967 HE3 LYS 128 HE1 LYS 128 14.915 0.268 1.600 968 HZ1 LYS 128 HZ1 LYS 128 15.400 2.417 0.561 969 HZ2 LYS 128 HZ2 LYS 128 14.751 3.217 1.901 970 HZ3 LYS 128 HZ3 LYS 128 13.758 2.253 0.929 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 43.591 17.858 -4.269 2 H2 MET 1 HT2 MET 1 44.535 19.150 -4.889 3 H3 MET 1 HT3 MET 1 45.290 17.864 -4.040 4 HA MET 1 HA MET 1 44.976 16.379 -5.722 5 HB2 MET 1 HB2 MET 1 42.907 18.366 -6.634 6 HB3 MET 1 HB1 MET 1 43.527 17.138 -7.730 7 HG2 MET 1 HG2 MET 1 42.856 15.439 -5.974 8 HG3 MET 1 HG1 MET 1 41.978 16.750 -5.191 9 HE1 MET 1 HE1 MET 1 38.976 17.425 -7.314 10 HE2 MET 1 HE2 MET 1 40.265 18.223 -6.411 11 HE3 MET 1 HE3 MET 1 39.354 16.907 -5.671 12 H ARG 2 HN ARG 2 46.509 16.246 -7.283 13 HA ARG 2 HA ARG 2 47.860 18.738 -8.017 14 HB2 ARG 2 HB2 ARG 2 48.832 16.287 -7.164 15 HB3 ARG 2 HB1 ARG 2 49.132 16.261 -8.896 16 HG2 ARG 2 HG2 ARG 2 50.915 17.534 -8.614 17 HG3 ARG 2 HG1 ARG 2 49.907 18.807 -7.922 18 HD2 ARG 2 HD2 ARG 2 51.200 16.518 -6.444 19 HD3 ARG 2 HD1 ARG 2 51.662 18.216 -6.372 20 HE ARG 2 HE ARG 2 49.014 17.305 -5.463 21 HH11 ARG 2 HH11 ARG 2 52.017 18.999 -4.865 22 HH12 ARG 2 HH12 ARG 2 51.487 19.647 -3.351 23 HH21 ARG 2 HH21 ARG 2 48.332 18.157 -3.471 24 HH22 ARG 2 HH22 ARG 2 49.403 19.170 -2.562 25 H GLY 3 HN GLY 3 45.435 18.282 -9.288 26 HA2 GLY 3 HA2 GLY 3 45.984 18.758 -11.941 27 HA3 GLY 3 HA1 GLY 3 45.780 17.015 -11.827 28 H SER 4 HN SER 4 44.149 19.896 -10.502 29 HA SER 4 HA SER 4 41.599 18.692 -10.437 30 HB2 SER 4 HB2 SER 4 40.912 21.254 -10.403 31 HB3 SER 4 HB1 SER 4 41.695 20.500 -9.014 32 HG SER 4 HG SER 4 43.099 21.857 -11.070 33 H HIS 5 HN HIS 5 39.989 18.566 -11.885 34 HA HIS 5 HA HIS 5 40.500 19.675 -14.562 35 HB2 HIS 5 HB2 HIS 5 38.733 17.350 -13.768 36 HB3 HIS 5 HB1 HIS 5 39.023 17.909 -15.412 37 HD1 HIS 5 HD1 HIS 5 42.029 18.158 -15.485 38 HD2 HIS 5 HD2 HIS 5 40.067 15.002 -13.626 39 HE1 HIS 5 HE1 HIS 5 43.697 16.277 -15.416 40 HE2 HIS 5 HE2 HIS 5 42.519 14.411 -14.200 41 H HIS 6 HN HIS 6 39.402 21.484 -14.928 42 HA HIS 6 HA HIS 6 36.772 21.831 -13.675 43 HB2 HIS 6 HB2 HIS 6 38.771 23.787 -14.793 44 HB3 HIS 6 HB1 HIS 6 37.114 24.255 -14.425 45 HD1 HIS 6 HD1 HIS 6 39.451 22.079 -12.365 46 HD2 HIS 6 HD2 HIS 6 37.404 25.688 -12.137 47 HE1 HIS 6 HE1 HIS 6 39.814 22.910 -10.021 48 HE2 HIS 6 HE2 HIS 6 38.635 25.135 -9.929 49 H HIS 7 HN HIS 7 35.579 20.569 -15.137 50 HA HIS 7 HA HIS 7 35.021 21.937 -17.661 51 HB2 HIS 7 HB2 HIS 7 36.453 19.523 -17.531 52 HB3 HIS 7 HB1 HIS 7 34.828 19.076 -18.035 53 HD1 HIS 7 HD1 HIS 7 34.742 22.088 -19.540 54 HD2 HIS 7 HD2 HIS 7 37.211 18.814 -20.214 55 HE1 HIS 7 HE1 HIS 7 35.583 22.353 -21.894 56 HE2 HIS 7 HE2 HIS 7 37.027 20.330 -22.301 57 H HIS 8 HN HIS 8 33.009 22.617 -17.154 58 HA HIS 8 HA HIS 8 31.142 20.808 -15.849 59 HB2 HIS 8 HB2 HIS 8 30.718 23.660 -16.761 60 HB3 HIS 8 HB1 HIS 8 29.661 22.730 -15.702 61 HD1 HIS 8 HD1 HIS 8 32.868 21.854 -14.570 62 HD2 HIS 8 HD2 HIS 8 30.544 25.281 -14.215 63 HE1 HIS 8 HE1 HIS 8 33.807 23.100 -12.599 64 HE2 HIS 8 HE2 HIS 8 32.339 25.135 -12.359 65 H HIS 9 HN HIS 9 30.364 19.311 -17.198 66 HA HIS 9 HA HIS 9 28.791 20.214 -19.475 67 HB2 HIS 9 HB2 HIS 9 29.787 18.594 -21.011 68 HB3 HIS 9 HB1 HIS 9 31.000 19.729 -20.430 69 HD1 HIS 9 HD1 HIS 9 31.961 18.502 -17.881 70 HD2 HIS 9 HD2 HIS 9 31.058 16.228 -21.238 71 HE1 HIS 9 HE1 HIS 9 33.227 16.350 -17.595 72 HE2 HIS 9 HE2 HIS 9 32.764 15.045 -19.698 73 H HIS 10 HN HIS 10 29.540 17.854 -17.055 74 HA HIS 10 HA HIS 10 26.896 16.868 -16.979 75 HB2 HIS 10 HB2 HIS 10 28.180 15.692 -19.032 76 HB3 HIS 10 HB1 HIS 10 28.718 14.630 -17.735 77 HD1 HIS 10 HD1 HIS 10 25.681 15.282 -16.390 78 HD2 HIS 10 HD2 HIS 10 26.724 13.339 -19.911 79 HE1 HIS 10 HE1 HIS 10 23.707 13.839 -16.971 80 HE2 HIS 10 HE2 HIS 10 24.415 12.578 -19.033 81 H GLY 11 HN GLY 11 27.543 14.261 -15.882 82 HA2 GLY 11 HA2 GLY 11 28.928 15.159 -13.436 83 HA3 GLY 11 HA1 GLY 11 27.583 14.030 -13.446 84 H SER 12 HN SER 12 30.622 14.076 -12.704 85 HA SER 12 HA SER 12 31.371 11.583 -14.070 86 HB2 SER 12 HB2 SER 12 32.849 13.919 -13.396 87 HB3 SER 12 HB1 SER 12 33.494 12.591 -12.431 88 HG SER 12 HG SER 12 34.484 12.027 -14.186 89 H GLU 13 HN GLU 13 30.243 12.835 -11.123 90 HA GLU 13 HA GLU 13 31.367 10.815 -9.408 91 HB2 GLU 13 HB2 GLU 13 29.237 12.918 -9.006 92 HB3 GLU 13 HB1 GLU 13 29.739 11.810 -7.741 93 HG2 GLU 13 HG2 GLU 13 31.842 12.769 -7.557 94 HG3 GLU 13 HG1 GLU 13 31.748 13.511 -9.155 95 HA PRO 14 HA PRO 14 28.439 7.541 -9.642 96 HB2 PRO 14 HB2 PRO 14 27.429 7.398 -7.068 97 HB3 PRO 14 HB1 PRO 14 28.906 6.619 -7.632 98 HG2 PRO 14 HG2 PRO 14 28.568 9.198 -6.159 99 HG3 PRO 14 HG1 PRO 14 29.814 7.949 -5.967 100 HD2 PRO 14 HD2 PRO 14 30.348 10.212 -7.269 101 HD3 PRO 14 HD1 PRO 14 30.993 8.663 -7.845 102 H THR 15 HN THR 15 26.694 9.251 -7.092 103 HA THR 15 HA THR 15 24.545 9.996 -6.989 104 HB THR 15 HB THR 15 24.822 10.916 -9.834 105 HG1 THR 15 HG1 THR 15 26.029 12.672 -9.053 106 HG21 THR 15 HG21 THR 15 23.318 12.495 -9.345 107 HG22 THR 15 HG22 THR 15 23.958 12.755 -7.723 108 HG23 THR 15 HG23 THR 15 22.873 11.401 -8.036 109 H THR 16 HN THR 16 24.972 7.279 -7.960 110 HA THR 16 HA THR 16 23.325 6.627 -10.120 111 HB THR 16 HB THR 16 23.578 4.791 -7.770 112 HG1 THR 16 HG1 THR 16 25.664 5.627 -9.486 113 HG21 THR 16 HG21 THR 16 24.168 3.181 -9.622 114 HG22 THR 16 HG22 THR 16 23.645 4.436 -10.746 115 HG23 THR 16 HG23 THR 16 22.503 3.762 -9.583 116 HA PRO 17 HA PRO 17 19.351 7.454 -8.267 117 HB2 PRO 17 HB2 PRO 17 17.818 6.791 -10.367 118 HB3 PRO 17 HB1 PRO 17 18.807 8.257 -10.366 119 HG2 PRO 17 HG2 PRO 17 19.352 5.605 -11.644 120 HG3 PRO 17 HG1 PRO 17 19.600 7.235 -12.297 121 HD2 PRO 17 HD2 PRO 17 21.598 5.711 -11.209 122 HD3 PRO 17 HD1 PRO 17 21.613 7.485 -11.233 123 H THR 18 HN THR 18 17.941 6.267 -7.101 124 HA THR 18 HA THR 18 17.527 3.449 -7.780 125 HB THR 18 HB THR 18 17.828 2.787 -5.418 126 HG1 THR 18 HG1 THR 18 18.631 4.218 -3.948 127 HG21 THR 18 HG21 THR 18 20.041 3.808 -7.050 128 HG22 THR 18 HG22 THR 18 19.814 2.235 -6.289 129 HG23 THR 18 HG23 THR 18 20.395 3.600 -5.336 130 H THR 19 HN THR 19 15.956 5.993 -7.853 131 HA THR 19 HA THR 19 13.974 5.856 -5.806 132 HB THR 19 HB THR 19 14.286 7.963 -6.831 133 HG1 THR 19 HG1 THR 19 12.244 8.399 -7.099 134 HG21 THR 19 HG21 THR 19 13.905 6.566 -9.458 135 HG22 THR 19 HG22 THR 19 15.297 7.499 -8.903 136 HG23 THR 19 HG23 THR 19 13.777 8.315 -9.268 137 H ASN 20 HN ASN 20 12.567 4.211 -5.636 138 HA ASN 20 HA ASN 20 10.699 3.591 -7.621 139 HB2 ASN 20 HB2 ASN 20 11.376 1.338 -8.270 140 HB3 ASN 20 HB1 ASN 20 12.605 2.509 -8.735 141 HD21 ASN 20 HD21 ASN 20 14.458 2.726 -7.308 142 HD22 ASN 20 HD22 ASN 20 15.032 1.334 -6.465 143 H LEU 21 HN LEU 21 8.987 2.639 -6.727 144 HA LEU 21 HA LEU 21 8.859 2.187 -3.948 145 HB2 LEU 21 HB2 LEU 21 6.852 1.044 -5.853 146 HB3 LEU 21 HB1 LEU 21 6.594 1.738 -4.265 147 HG LEU 21 HG LEU 21 7.595 3.606 -6.328 148 HD11 LEU 21 HD11 LEU 21 5.642 3.793 -7.562 149 HD12 LEU 21 HD12 LEU 21 4.700 2.864 -6.397 150 HD13 LEU 21 HD13 LEU 21 5.871 2.049 -7.432 151 HD21 LEU 21 HD21 LEU 21 6.753 3.929 -3.838 152 HD22 LEU 21 HD22 LEU 21 5.198 4.071 -4.658 153 HD23 LEU 21 HD23 LEU 21 6.521 5.158 -5.080 154 H LYS 22 HN LYS 22 10.502 0.644 -3.527 155 HA LYS 22 HA LYS 22 10.892 -1.805 -4.658 156 HB2 LYS 22 HB2 LYS 22 11.585 -0.536 -2.190 157 HB3 LYS 22 HB1 LYS 22 11.188 -2.219 -1.908 158 HG2 LYS 22 HG2 LYS 22 13.292 -2.659 -2.474 159 HG3 LYS 22 HG1 LYS 22 12.774 -2.360 -4.135 160 HD2 LYS 22 HD2 LYS 22 13.271 0.131 -3.549 161 HD3 LYS 22 HD1 LYS 22 14.247 -0.562 -2.252 162 HE2 LYS 22 HE2 LYS 22 14.720 -1.866 -4.803 163 HE3 LYS 22 HE1 LYS 22 15.042 -0.134 -4.872 164 HZ1 LYS 22 HZ1 LYS 22 17.016 -0.701 -4.031 165 HZ2 LYS 22 HZ2 LYS 22 16.487 -2.217 -3.501 166 HZ3 LYS 22 HZ3 LYS 22 16.209 -0.846 -2.551 167 H ILE 23 HN ILE 23 10.399 -3.971 -3.779 168 HA ILE 23 HA ILE 23 7.626 -4.415 -3.847 169 HB ILE 23 HB ILE 23 10.033 -5.886 -4.158 170 HG12 ILE 23 HG12 ILE 23 7.567 -7.272 -4.806 171 HG13 ILE 23 HG11 ILE 23 7.551 -5.582 -5.305 172 HG21 ILE 23 HG21 ILE 23 9.328 -8.070 -3.258 173 HG22 ILE 23 HG22 ILE 23 8.018 -7.264 -2.401 174 HG23 ILE 23 HG23 ILE 23 9.690 -6.891 -1.997 175 HD11 ILE 23 HD11 ILE 23 9.040 -5.905 -6.932 176 HD12 ILE 23 HD12 ILE 23 8.603 -7.608 -6.759 177 HD13 ILE 23 HD13 ILE 23 10.030 -6.977 -5.940 178 H TYR 24 HN TYR 24 6.346 -5.610 -2.490 179 HA TYR 24 HA TYR 24 6.783 -5.286 0.398 180 HB2 TYR 24 HB2 TYR 24 4.467 -5.181 -1.402 181 HB3 TYR 24 HB1 TYR 24 4.217 -5.979 0.114 182 HD1 TYR 24 HD1 TYR 24 5.450 -2.744 -1.273 183 HD2 TYR 24 HD2 TYR 24 3.525 -4.775 1.909 184 HE1 TYR 24 HE1 TYR 24 4.918 -0.592 -0.221 185 HE2 TYR 24 HE2 TYR 24 2.993 -2.643 2.976 186 HH TYR 24 HH TYR 24 2.756 -0.364 2.471 187 H LYS 25 HN LYS 25 5.649 -7.206 1.600 188 HA LYS 25 HA LYS 25 6.064 -9.657 0.017 189 HB2 LYS 25 HB2 LYS 25 6.644 -9.095 2.897 190 HB3 LYS 25 HB1 LYS 25 6.430 -10.735 2.291 191 HG2 LYS 25 HG2 LYS 25 8.430 -8.817 1.129 192 HG3 LYS 25 HG1 LYS 25 8.810 -9.907 2.463 193 HD2 LYS 25 HD2 LYS 25 7.645 -10.915 -0.113 194 HD3 LYS 25 HD1 LYS 25 9.381 -10.678 0.089 195 HE2 LYS 25 HE2 LYS 25 9.581 -12.389 1.595 196 HE3 LYS 25 HE1 LYS 25 7.926 -12.215 2.175 197 HZ1 LYS 25 HZ1 LYS 25 8.955 -13.910 0.124 198 HZ2 LYS 25 HZ2 LYS 25 7.667 -12.971 -0.443 199 HZ3 LYS 25 HZ3 LYS 25 7.458 -13.963 0.911 200 H VAL 26 HN VAL 26 4.096 -10.432 -0.521 201 HA VAL 26 HA VAL 26 1.865 -9.961 1.188 202 HB VAL 26 HB VAL 26 1.316 -11.928 -0.859 203 HG11 VAL 26 HG11 VAL 26 -0.129 -10.379 0.536 204 HG12 VAL 26 HG12 VAL 26 -0.521 -10.557 -1.180 205 HG13 VAL 26 HG13 VAL 26 0.349 -9.133 -0.612 206 HG21 VAL 26 HG21 VAL 26 1.555 -9.621 -2.394 207 HG22 VAL 26 HG22 VAL 26 2.493 -11.102 -2.550 208 HG23 VAL 26 HG23 VAL 26 3.088 -9.781 -1.549 209 H ASP 27 HN ASP 27 2.564 -10.887 2.974 210 HA ASP 27 HA ASP 27 3.088 -13.707 3.151 211 HB2 ASP 27 HB2 ASP 27 3.060 -11.500 5.174 212 HB3 ASP 27 HB1 ASP 27 3.267 -13.168 5.673 213 H ASP 28 HN ASP 28 0.369 -11.634 3.672 214 HA ASP 28 HA ASP 28 -1.399 -13.836 3.774 215 HB2 ASP 28 HB2 ASP 28 -0.234 -13.812 6.095 216 HB3 ASP 28 HB1 ASP 28 -1.287 -12.440 6.425 217 H LEU 29 HN LEU 29 -3.163 -13.087 2.830 218 HA LEU 29 HA LEU 29 -4.209 -10.520 3.670 219 HB2 LEU 29 HB2 LEU 29 -3.744 -9.576 1.765 220 HB3 LEU 29 HB1 LEU 29 -3.208 -11.085 1.110 221 HG LEU 29 HG LEU 29 -6.113 -10.769 1.288 222 HD11 LEU 29 HD11 LEU 29 -5.969 -9.488 -0.935 223 HD12 LEU 29 HD12 LEU 29 -4.393 -8.976 -0.334 224 HD13 LEU 29 HD13 LEU 29 -5.852 -8.621 0.601 225 HD21 LEU 29 HD21 LEU 29 -4.665 -11.513 -1.160 226 HD22 LEU 29 HD22 LEU 29 -6.097 -12.227 -0.411 227 HD23 LEU 29 HD23 LEU 29 -4.495 -12.557 0.250 228 H GLN 30 HN GLN 30 -6.312 -10.381 3.902 229 HA GLN 30 HA GLN 30 -7.993 -12.702 3.273 230 HB2 GLN 30 HB2 GLN 30 -7.366 -11.454 5.851 231 HB3 GLN 30 HB1 GLN 30 -9.086 -11.546 5.532 232 HG2 GLN 30 HG2 GLN 30 -8.344 -13.474 6.767 233 HG3 GLN 30 HG1 GLN 30 -8.902 -13.943 5.160 234 HE21 GLN 30 HE21 GLN 30 -7.145 -13.867 3.493 235 HE22 GLN 30 HE22 GLN 30 -5.615 -14.520 3.944 236 H LYS 31 HN LYS 31 -10.297 -12.326 3.234 237 HA LYS 31 HA LYS 31 -10.923 -9.828 1.987 238 HB2 LYS 31 HB2 LYS 31 -12.083 -12.203 1.696 239 HB3 LYS 31 HB1 LYS 31 -13.032 -11.670 3.072 240 HG2 LYS 31 HG2 LYS 31 -13.700 -11.262 0.489 241 HG3 LYS 31 HG1 LYS 31 -14.263 -10.278 1.837 242 HD2 LYS 31 HD2 LYS 31 -12.705 -8.574 1.373 243 HD3 LYS 31 HD1 LYS 31 -11.771 -9.617 0.302 244 HE2 LYS 31 HE2 LYS 31 -13.693 -9.690 -1.248 245 HE3 LYS 31 HE1 LYS 31 -14.551 -8.566 -0.197 246 HZ1 LYS 31 HZ1 LYS 31 -13.337 -6.833 -0.916 247 HZ2 LYS 31 HZ2 LYS 31 -13.070 -7.809 -2.272 248 HZ3 LYS 31 HZ3 LYS 31 -11.907 -7.727 -1.047 249 H ILE 32 HN ILE 32 -10.673 -8.163 3.340 250 HA ILE 32 HA ILE 32 -11.656 -8.447 6.098 251 HB ILE 32 HB ILE 32 -9.260 -6.950 5.060 252 HG12 ILE 32 HG12 ILE 32 -9.628 -9.662 5.205 253 HG13 ILE 32 HG11 ILE 32 -8.082 -8.839 5.136 254 HG21 ILE 32 HG21 ILE 32 -9.705 -5.902 7.073 255 HG22 ILE 32 HG22 ILE 32 -8.514 -7.156 7.475 256 HG23 ILE 32 HG23 ILE 32 -10.234 -7.406 7.839 257 HD11 ILE 32 HD11 ILE 32 -7.588 -9.597 7.115 258 HD12 ILE 32 HD12 ILE 32 -9.116 -10.477 7.142 259 HD13 ILE 32 HD13 ILE 32 -9.026 -8.840 7.782 260 H ASN 33 HN ASN 33 -13.275 -7.196 6.608 261 HA ASN 33 HA ASN 33 -14.709 -5.454 6.765 262 HB2 ASN 33 HB2 ASN 33 -12.144 -4.059 6.056 263 HB3 ASN 33 HB1 ASN 33 -13.647 -3.157 6.190 264 HD21 ASN 33 HD21 ASN 33 -12.031 -5.740 8.012 265 HD22 ASN 33 HD22 ASN 33 -12.217 -4.994 9.558 266 H GLY 34 HN GLY 34 -14.707 -7.004 4.412 267 HA2 GLY 34 HA2 GLY 34 -15.883 -6.992 2.443 268 HA3 GLY 34 HA1 GLY 34 -16.170 -5.282 2.692 269 H ILE 35 HN ILE 35 -12.926 -5.723 3.007 270 HA ILE 35 HA ILE 35 -12.364 -5.425 0.152 271 HB ILE 35 HB ILE 35 -10.536 -3.811 1.599 272 HG12 ILE 35 HG12 ILE 35 -13.157 -2.531 2.042 273 HG13 ILE 35 HG11 ILE 35 -12.799 -3.875 3.110 274 HG21 ILE 35 HG21 ILE 35 -11.974 -2.010 0.256 275 HG22 ILE 35 HG22 ILE 35 -12.555 -3.476 -0.533 276 HG23 ILE 35 HG23 ILE 35 -10.832 -3.099 -0.531 277 HD11 ILE 35 HD11 ILE 35 -10.654 -1.899 2.778 278 HD12 ILE 35 HD12 ILE 35 -11.204 -2.766 4.212 279 HD13 ILE 35 HD13 ILE 35 -12.099 -1.362 3.633 280 H TRP 36 HN TRP 36 -10.524 -6.489 -0.500 281 HA TRP 36 HA TRP 36 -9.406 -8.451 1.160 282 HB2 TRP 36 HB2 TRP 36 -8.355 -7.211 -1.400 283 HB3 TRP 36 HB1 TRP 36 -7.648 -8.631 -0.634 284 HD1 TRP 36 HD1 TRP 36 -10.132 -7.704 -3.166 285 HE1 TRP 36 HE1 TRP 36 -11.657 -9.693 -3.749 286 HE3 TRP 36 HE3 TRP 36 -8.909 -10.830 0.696 287 HZ2 TRP 36 HZ2 TRP 36 -12.265 -12.244 -2.710 288 HZ3 TRP 36 HZ3 TRP 36 -10.014 -13.026 0.827 289 HH2 TRP 36 HH2 TRP 36 -11.656 -13.716 -0.840 290 H GLN 37 HN GLN 37 -7.729 -8.390 2.623 291 HA GLN 37 HA GLN 37 -6.233 -5.861 2.777 292 HB2 GLN 37 HB2 GLN 37 -7.560 -5.970 4.704 293 HB3 GLN 37 HB1 GLN 37 -7.221 -7.670 4.946 294 HG2 GLN 37 HG2 GLN 37 -4.741 -6.503 5.086 295 HG3 GLN 37 HG1 GLN 37 -5.801 -5.339 5.838 296 HE21 GLN 37 HE21 GLN 37 -5.638 -8.900 5.876 297 HE22 GLN 37 HE22 GLN 37 -5.545 -9.027 7.616 298 H VAL 38 HN VAL 38 -4.069 -5.888 3.218 299 HA VAL 38 HA VAL 38 -2.811 -8.518 2.756 300 HB VAL 38 HB VAL 38 -1.704 -5.756 2.126 301 HG11 VAL 38 HG11 VAL 38 -0.793 -8.126 0.619 302 HG12 VAL 38 HG12 VAL 38 -0.361 -8.147 2.325 303 HG13 VAL 38 HG13 VAL 38 0.121 -6.800 1.317 304 HG21 VAL 38 HG21 VAL 38 -2.256 -6.908 -0.279 305 HG22 VAL 38 HG22 VAL 38 -3.314 -5.769 0.557 306 HG23 VAL 38 HG23 VAL 38 -3.600 -7.506 0.697 307 H ARG 39 HN ARG 39 -0.916 -9.113 3.728 308 HA ARG 39 HA ARG 39 0.157 -7.477 5.887 309 HB2 ARG 39 HB2 ARG 39 -0.761 -10.335 6.290 310 HB3 ARG 39 HB1 ARG 39 0.116 -9.364 7.447 311 HG2 ARG 39 HG2 ARG 39 -1.669 -8.158 8.024 312 HG3 ARG 39 HG1 ARG 39 -2.392 -8.229 6.427 313 HD2 ARG 39 HD2 ARG 39 -3.555 -9.498 8.326 314 HD3 ARG 39 HD1 ARG 39 -3.311 -10.341 6.798 315 HE ARG 39 HE ARG 39 -1.167 -11.149 8.105 316 HH11 ARG 39 HH11 ARG 39 -4.434 -10.827 9.279 317 HH12 ARG 39 HH12 ARG 39 -4.283 -12.111 10.427 318 HH21 ARG 39 HH21 ARG 39 -0.968 -12.841 9.617 319 HH22 ARG 39 HH22 ARG 39 -2.319 -13.251 10.620 320 H ASN 40 HN ASN 40 2.356 -7.892 6.314 321 HA ASN 40 HA ASN 40 3.561 -10.124 4.920 322 HB2 ASN 40 HB2 ASN 40 5.452 -7.936 5.085 323 HB3 ASN 40 HB1 ASN 40 5.125 -9.053 3.796 324 HD21 ASN 40 HD21 ASN 40 5.667 -6.176 3.869 325 HD22 ASN 40 HD22 ASN 40 4.447 -5.533 2.831 326 H ASN 41 HN ASN 41 5.406 -10.805 5.823 327 HA ASN 41 HA ASN 41 5.380 -10.944 8.578 328 HB2 ASN 41 HB2 ASN 41 7.810 -11.914 8.137 329 HB3 ASN 41 HB1 ASN 41 6.378 -12.792 7.626 330 HD21 ASN 41 HD21 ASN 41 7.128 -9.956 5.906 331 HD22 ASN 41 HD22 ASN 41 7.684 -10.679 4.470 332 H ILE 42 HN ILE 42 6.810 -8.525 6.571 333 HA ILE 42 HA ILE 42 8.849 -7.761 8.368 334 HB ILE 42 HB ILE 42 7.736 -6.257 6.039 335 HG12 ILE 42 HG12 ILE 42 10.055 -7.341 5.173 336 HG13 ILE 42 HG11 ILE 42 9.463 -8.625 6.213 337 HG21 ILE 42 HG21 ILE 42 9.178 -4.713 6.591 338 HG22 ILE 42 HG22 ILE 42 10.493 -5.878 6.447 339 HG23 ILE 42 HG23 ILE 42 9.670 -5.660 7.989 340 HD11 ILE 42 HD11 ILE 42 7.244 -8.307 5.012 341 HD12 ILE 42 HD12 ILE 42 8.553 -9.134 4.159 342 HD13 ILE 42 HD13 ILE 42 8.188 -7.449 3.793 343 H LEU 43 HN LEU 43 5.849 -6.413 7.133 344 HA LEU 43 HA LEU 43 5.787 -4.501 9.307 345 HB2 LEU 43 HB2 LEU 43 3.947 -4.636 6.948 346 HB3 LEU 43 HB1 LEU 43 4.112 -3.319 8.085 347 HG LEU 43 HG LEU 43 5.320 -2.427 6.439 348 HD11 LEU 43 HD11 LEU 43 7.482 -4.289 7.361 349 HD12 LEU 43 HD12 LEU 43 6.923 -2.906 8.296 350 HD13 LEU 43 HD13 LEU 43 7.663 -2.661 6.715 351 HD21 LEU 43 HD21 LEU 43 6.789 -4.256 5.031 352 HD22 LEU 43 HD22 LEU 43 5.219 -3.595 4.565 353 HD23 LEU 43 HD23 LEU 43 5.311 -5.136 5.423 354 H VAL 44 HN VAL 44 4.540 -7.528 8.427 355 HA VAL 44 HA VAL 44 2.617 -7.320 10.585 356 HB VAL 44 HB VAL 44 1.591 -8.451 8.083 357 HG11 VAL 44 HG11 VAL 44 0.652 -8.540 10.580 358 HG12 VAL 44 HG12 VAL 44 -0.397 -8.530 9.167 359 HG13 VAL 44 HG13 VAL 44 -0.087 -7.032 10.046 360 HG21 VAL 44 HG21 VAL 44 0.674 -6.397 7.375 361 HG22 VAL 44 HG22 VAL 44 2.373 -6.080 7.713 362 HG23 VAL 44 HG23 VAL 44 1.138 -5.600 8.877 363 HA PRO 45 HA PRO 45 5.068 -11.258 10.510 364 HB2 PRO 45 HB2 PRO 45 4.442 -10.542 13.331 365 HB3 PRO 45 HB1 PRO 45 5.907 -11.308 12.707 366 HG2 PRO 45 HG2 PRO 45 5.953 -8.790 13.347 367 HG3 PRO 45 HG1 PRO 45 6.634 -9.263 11.774 368 HD2 PRO 45 HD2 PRO 45 3.978 -8.032 12.401 369 HD3 PRO 45 HD1 PRO 45 5.092 -7.681 11.093 370 H THR 46 HN THR 46 2.269 -10.001 12.064 371 HA THR 46 HA THR 46 0.394 -11.799 11.226 372 HB THR 46 HB THR 46 1.755 -13.468 12.503 373 HG1 THR 46 HG1 THR 46 -0.607 -13.584 12.184 374 HG21 THR 46 HG21 THR 46 2.458 -13.049 14.546 375 HG22 THR 46 HG22 THR 46 0.783 -13.035 15.096 376 HG23 THR 46 HG23 THR 46 1.555 -11.535 14.582 377 H ASP 47 HN ASP 47 -1.686 -11.508 12.207 378 HA ASP 47 HA ASP 47 -3.313 -10.438 13.431 379 HB2 ASP 47 HB2 ASP 47 -1.352 -9.014 15.062 380 HB3 ASP 47 HB1 ASP 47 -2.895 -9.691 15.545 381 H PHE 48 HN PHE 48 -2.920 -9.113 11.150 382 HA PHE 48 HA PHE 48 -2.293 -6.382 11.624 383 HB2 PHE 48 HB2 PHE 48 -2.229 -7.981 9.419 384 HB3 PHE 48 HB1 PHE 48 -3.723 -7.105 9.158 385 HD1 PHE 48 HD1 PHE 48 -1.504 -4.990 10.971 386 HD2 PHE 48 HD2 PHE 48 -2.265 -6.566 7.086 387 HE1 PHE 48 HE1 PHE 48 -0.228 -3.160 9.944 388 HE2 PHE 48 HE2 PHE 48 -0.961 -4.752 6.092 389 HZ PHE 48 HZ PHE 48 0.057 -3.046 7.519 390 H THR 49 HN THR 49 -3.776 -5.198 12.633 391 HA THR 49 HA THR 49 -6.347 -5.874 13.247 392 HB THR 49 HB THR 49 -6.047 -3.029 12.592 393 HG1 THR 49 HG1 THR 49 -4.626 -2.797 14.475 394 HG21 THR 49 HG21 THR 49 -6.859 -4.553 15.027 395 HG22 THR 49 HG22 THR 49 -7.868 -3.626 13.908 396 HG23 THR 49 HG23 THR 49 -6.724 -2.794 14.964 397 H TRP 50 HN TRP 50 -7.359 -6.846 11.616 398 HA TRP 50 HA TRP 50 -7.695 -6.175 8.981 399 HB2 TRP 50 HB2 TRP 50 -9.592 -7.343 11.004 400 HB3 TRP 50 HB1 TRP 50 -10.011 -7.206 9.350 401 HD1 TRP 50 HD1 TRP 50 -6.494 -8.087 9.304 402 HE1 TRP 50 HE1 TRP 50 -6.149 -10.623 9.046 403 HE3 TRP 50 HE3 TRP 50 -11.227 -9.679 10.401 404 HZ2 TRP 50 HZ2 TRP 50 -7.668 -12.986 9.285 405 HZ3 TRP 50 HZ3 TRP 50 -11.697 -12.093 10.366 406 HH2 TRP 50 HH2 TRP 50 -9.953 -13.712 9.819 407 H VAL 51 HN VAL 51 -9.047 -4.700 11.788 408 HA VAL 51 HA VAL 51 -11.267 -3.391 10.851 409 HB VAL 51 HB VAL 51 -10.474 -3.475 13.238 410 HG11 VAL 51 HG11 VAL 51 -8.182 -2.529 12.618 411 HG12 VAL 51 HG12 VAL 51 -8.943 -1.959 14.105 412 HG13 VAL 51 HG13 VAL 51 -8.979 -0.957 12.655 413 HG21 VAL 51 HG21 VAL 51 -11.082 -0.670 13.014 414 HG22 VAL 51 HG22 VAL 51 -12.073 -1.985 13.651 415 HG23 VAL 51 HG23 VAL 51 -12.085 -1.628 11.923 416 H ASP 52 HN ASP 52 -8.057 -2.131 11.149 417 HA ASP 52 HA ASP 52 -8.453 -0.501 8.794 418 HB2 ASP 52 HB2 ASP 52 -9.314 0.802 10.667 419 HB3 ASP 52 HB1 ASP 52 -7.765 0.652 11.470 420 H ASN 53 HN ASN 53 -6.392 -2.142 10.886 421 HA ASN 53 HA ASN 53 -4.018 -0.848 9.887 422 HB2 ASN 53 HB2 ASN 53 -4.294 -3.199 11.744 423 HB3 ASN 53 HB1 ASN 53 -2.784 -2.422 11.329 424 HD21 ASN 53 HD21 ASN 53 -5.486 -0.299 11.710 425 HD22 ASN 53 HD22 ASN 53 -5.098 0.265 13.284 426 H GLY 54 HN GLY 54 -5.998 -3.244 8.921 427 HA2 GLY 54 HA2 GLY 54 -4.040 -4.797 7.588 428 HA3 GLY 54 HA1 GLY 54 -5.795 -4.910 7.463 429 H ILE 55 HN ILE 55 -3.504 -4.537 5.492 430 HA ILE 55 HA ILE 55 -4.138 -2.010 4.306 431 HB ILE 55 HB ILE 55 -2.018 -2.377 3.651 432 HG12 ILE 55 HG12 ILE 55 -2.008 -3.866 1.473 433 HG13 ILE 55 HG11 ILE 55 -3.733 -3.595 1.636 434 HG21 ILE 55 HG21 ILE 55 -0.973 -4.497 3.265 435 HG22 ILE 55 HG22 ILE 55 -2.495 -5.258 3.713 436 HG23 ILE 55 HG23 ILE 55 -1.623 -4.290 4.885 437 HD11 ILE 55 HD11 ILE 55 -3.151 -1.825 0.377 438 HD12 ILE 55 HD12 ILE 55 -1.592 -1.640 1.189 439 HD13 ILE 55 HD13 ILE 55 -3.073 -1.158 2.000 440 H ALA 56 HN ALA 56 -5.913 -1.687 3.049 441 HA ALA 56 HA ALA 56 -7.320 -3.899 1.994 442 HB1 ALA 56 HB1 ALA 56 -8.282 -1.752 0.575 443 HB2 ALA 56 HB2 ALA 56 -7.740 -1.015 2.085 444 HB3 ALA 56 HB3 ALA 56 -8.918 -2.324 2.116 445 H ALA 57 HN ALA 57 -5.883 -5.034 0.880 446 HA ALA 57 HA ALA 57 -4.008 -4.445 -0.796 447 HB1 ALA 57 HB1 ALA 57 -5.870 -6.439 -1.917 448 HB2 ALA 57 HB2 ALA 57 -5.232 -6.713 -0.294 449 HB3 ALA 57 HB3 ALA 57 -4.126 -6.533 -1.660 450 H ASP 58 HN ASP 58 -7.362 -3.994 -1.622 451 HA ASP 58 HA ASP 58 -7.186 -3.651 -4.357 452 HB2 ASP 58 HB2 ASP 58 -9.370 -3.216 -4.136 453 HB3 ASP 58 HB1 ASP 58 -9.139 -3.323 -2.399 454 H ASP 59 HN ASP 59 -6.476 -1.454 -1.757 455 HA ASP 59 HA ASP 59 -6.096 0.883 -3.261 456 HB2 ASP 59 HB2 ASP 59 -4.632 0.342 -0.711 457 HB3 ASP 59 HB1 ASP 59 -5.410 1.806 -1.256 458 H VAL 60 HN VAL 60 -3.990 -1.876 -2.621 459 HA VAL 60 HA VAL 60 -1.728 -0.356 -3.564 460 HB VAL 60 HB VAL 60 -0.369 -2.158 -2.873 461 HG11 VAL 60 HG11 VAL 60 -0.957 -2.117 -0.449 462 HG12 VAL 60 HG12 VAL 60 -2.392 -1.203 -0.926 463 HG13 VAL 60 HG13 VAL 60 -0.791 -0.552 -1.242 464 HG21 VAL 60 HG21 VAL 60 -2.590 -3.680 -3.269 465 HG22 VAL 60 HG22 VAL 60 -2.393 -3.698 -1.522 466 HG23 VAL 60 HG23 VAL 60 -1.073 -4.233 -2.568 467 H ILE 61 HN ILE 61 -0.140 -2.139 -4.689 468 HA ILE 61 HA ILE 61 -1.582 -3.290 -6.897 469 HB ILE 61 HB ILE 61 0.426 -2.002 -8.157 470 HG12 ILE 61 HG12 ILE 61 -0.725 0.117 -6.553 471 HG13 ILE 61 HG11 ILE 61 0.383 -0.874 -5.680 472 HG21 ILE 61 HG21 ILE 61 -1.348 -0.968 -9.175 473 HG22 ILE 61 HG22 ILE 61 -2.037 -0.506 -7.606 474 HG23 ILE 61 HG23 ILE 61 -2.254 -2.156 -8.222 475 HD11 ILE 61 HD11 ILE 61 0.898 1.187 -7.556 476 HD12 ILE 61 HD12 ILE 61 1.666 -0.328 -8.046 477 HD13 ILE 61 HD13 ILE 61 1.998 0.361 -6.458 478 H GLU 62 HN GLU 62 -0.930 -5.299 -6.794 479 HA GLU 62 HA GLU 62 1.520 -6.206 -5.771 480 HB2 GLU 62 HB2 GLU 62 0.757 -8.355 -6.958 481 HB3 GLU 62 HB1 GLU 62 -0.211 -7.743 -5.636 482 HG2 GLU 62 HG2 GLU 62 -1.934 -7.134 -7.014 483 HG3 GLU 62 HG1 GLU 62 -0.885 -6.924 -8.415 484 H VAL 63 HN VAL 63 3.447 -6.289 -6.574 485 HA VAL 63 HA VAL 63 3.709 -6.288 -9.507 486 HB VAL 63 HB VAL 63 5.987 -5.370 -9.115 487 HG11 VAL 63 HG11 VAL 63 3.472 -3.953 -8.706 488 HG12 VAL 63 HG12 VAL 63 4.805 -3.617 -9.813 489 HG13 VAL 63 HG13 VAL 63 4.901 -3.092 -8.132 490 HG21 VAL 63 HG21 VAL 63 5.134 -5.618 -6.328 491 HG22 VAL 63 HG22 VAL 63 5.928 -4.099 -6.737 492 HG23 VAL 63 HG23 VAL 63 6.751 -5.630 -7.030 493 H THR 64 HN THR 64 5.636 -7.449 -10.341 494 HA THR 64 HA THR 64 5.932 -9.972 -8.941 495 HB THR 64 HB THR 64 6.842 -10.862 -10.901 496 HG1 THR 64 HG1 THR 64 7.859 -9.659 -12.460 497 HG21 THR 64 HG21 THR 64 4.793 -8.810 -11.520 498 HG22 THR 64 HG22 THR 64 4.724 -10.565 -11.660 499 HG23 THR 64 HG23 THR 64 5.612 -9.620 -12.855 500 H SER 65 HN SER 65 8.148 -10.927 -8.750 501 HA SER 65 HA SER 65 9.696 -9.794 -6.900 502 HB2 SER 65 HB2 SER 65 11.663 -11.070 -8.213 503 HB3 SER 65 HB1 SER 65 10.407 -11.918 -7.311 504 HG SER 65 HG SER 65 10.247 -11.307 -10.075 505 H ASN 66 HN ASN 66 9.988 -9.061 -10.351 506 HA ASN 66 HA ASN 66 12.329 -7.493 -9.989 507 HB2 ASN 66 HB2 ASN 66 11.260 -8.731 -12.121 508 HB3 ASN 66 HB1 ASN 66 10.726 -7.078 -12.366 509 HD21 ASN 66 HD21 ASN 66 13.599 -8.999 -11.691 510 HD22 ASN 66 HD22 ASN 66 14.702 -7.984 -12.550 511 H GLY 67 HN GLY 67 9.165 -7.002 -9.309 512 HA2 GLY 67 HA2 GLY 67 8.231 -5.070 -8.359 513 HA3 GLY 67 HA1 GLY 67 9.493 -4.114 -9.116 514 H THR 68 HN THR 68 7.846 -6.507 -10.952 515 HA THR 68 HA THR 68 6.971 -4.563 -12.809 516 HB THR 68 HB THR 68 7.189 -7.458 -12.686 517 HG1 THR 68 HG1 THR 68 7.986 -7.135 -14.658 518 HG21 THR 68 HG21 THR 68 5.579 -7.829 -14.537 519 HG22 THR 68 HG22 THR 68 4.897 -6.242 -14.174 520 HG23 THR 68 HG23 THR 68 4.843 -7.522 -12.965 521 H ARG 69 HN ARG 69 5.199 -3.412 -12.684 522 HA ARG 69 HA ARG 69 3.152 -3.922 -10.776 523 HB2 ARG 69 HB2 ARG 69 3.716 -1.880 -12.826 524 HB3 ARG 69 HB1 ARG 69 2.006 -2.144 -12.510 525 HG2 ARG 69 HG2 ARG 69 2.188 -1.474 -10.289 526 HG3 ARG 69 HG1 ARG 69 3.941 -1.681 -10.272 527 HD2 ARG 69 HD2 ARG 69 4.311 0.280 -11.458 528 HD3 ARG 69 HD1 ARG 69 2.673 0.314 -12.107 529 HE ARG 69 HE ARG 69 2.275 0.620 -9.461 530 HH11 ARG 69 HH11 ARG 69 4.334 2.256 -11.746 531 HH12 ARG 69 HH12 ARG 69 4.307 3.758 -10.886 532 HH21 ARG 69 HH21 ARG 69 2.238 2.591 -8.322 533 HH22 ARG 69 HH22 ARG 69 3.118 3.948 -8.939 534 H THR 70 HN THR 70 1.044 -4.657 -11.055 535 HA THR 70 HA THR 70 0.058 -5.432 -13.638 536 HB THR 70 HB THR 70 1.592 -7.293 -13.208 537 HG1 THR 70 HG1 THR 70 -0.540 -7.624 -14.185 538 HG21 THR 70 HG21 THR 70 1.896 -7.729 -11.013 539 HG22 THR 70 HG22 THR 70 0.630 -8.912 -11.344 540 HG23 THR 70 HG23 THR 70 0.222 -7.369 -10.592 541 H SER 71 HN SER 71 -1.189 -3.725 -12.170 542 HA SER 71 HA SER 71 -2.987 -4.841 -10.235 543 HB2 SER 71 HB2 SER 71 -4.097 -2.543 -10.495 544 HB3 SER 71 HB1 SER 71 -2.440 -2.584 -9.903 545 HG SER 71 HG SER 71 -1.828 -1.519 -11.596 546 H ASP 72 HN ASP 72 -2.942 -4.977 -13.577 547 HA ASP 72 HA ASP 72 -5.625 -4.534 -14.260 548 HB2 ASP 72 HB2 ASP 72 -5.100 -5.974 -16.249 549 HB3 ASP 72 HB1 ASP 72 -3.976 -4.645 -15.987 550 H GLN 73 HN GLN 73 -4.422 -6.901 -12.220 551 HA GLN 73 HA GLN 73 -6.746 -8.647 -12.750 552 HB2 GLN 73 HB2 GLN 73 -4.154 -9.417 -13.006 553 HB3 GLN 73 HB1 GLN 73 -4.439 -9.814 -11.318 554 HG2 GLN 73 HG2 GLN 73 -5.028 -11.772 -12.339 555 HG3 GLN 73 HG1 GLN 73 -6.589 -10.959 -12.247 556 HE21 GLN 73 HE21 GLN 73 -7.613 -10.348 -14.094 557 HE22 GLN 73 HE22 GLN 73 -7.046 -10.739 -15.678 558 H VAL 74 HN VAL 74 -6.281 -10.239 -10.389 559 HA VAL 74 HA VAL 74 -7.186 -8.315 -8.348 560 HB VAL 74 HB VAL 74 -8.860 -9.991 -8.948 561 HG11 VAL 74 HG11 VAL 74 -7.724 -12.334 -7.780 562 HG12 VAL 74 HG12 VAL 74 -6.639 -11.732 -9.033 563 HG13 VAL 74 HG13 VAL 74 -8.322 -12.090 -9.421 564 HG21 VAL 74 HG21 VAL 74 -8.105 -9.288 -6.414 565 HG22 VAL 74 HG22 VAL 74 -8.155 -11.048 -6.312 566 HG23 VAL 74 HG23 VAL 74 -9.584 -10.154 -6.832 567 H LEU 75 HN LEU 75 -6.270 -8.298 -6.328 568 HA LEU 75 HA LEU 75 -3.600 -9.186 -6.088 569 HB2 LEU 75 HB2 LEU 75 -5.314 -7.465 -4.700 570 HB3 LEU 75 HB1 LEU 75 -4.775 -8.640 -3.525 571 HG LEU 75 HG LEU 75 -2.677 -7.450 -5.235 572 HD11 LEU 75 HD11 LEU 75 -3.003 -5.680 -3.058 573 HD12 LEU 75 HD12 LEU 75 -4.553 -5.777 -3.894 574 HD13 LEU 75 HD13 LEU 75 -3.099 -5.323 -4.783 575 HD21 LEU 75 HD21 LEU 75 -1.435 -7.523 -3.144 576 HD22 LEU 75 HD22 LEU 75 -2.185 -9.083 -3.486 577 HD23 LEU 75 HD23 LEU 75 -2.895 -8.006 -2.281 578 H GLN 76 HN GLN 76 -2.687 -10.658 -4.684 579 HA GLN 76 HA GLN 76 -4.303 -12.567 -3.268 580 HB2 GLN 76 HB2 GLN 76 -2.509 -13.535 -5.498 581 HB3 GLN 76 HB1 GLN 76 -3.487 -14.530 -4.432 582 HG2 GLN 76 HG2 GLN 76 -5.443 -13.084 -5.441 583 HG3 GLN 76 HG1 GLN 76 -4.296 -12.882 -6.763 584 HE21 GLN 76 HE21 GLN 76 -5.392 -15.505 -4.634 585 HE22 GLN 76 HE22 GLN 76 -5.625 -16.662 -5.895 586 H LYS 77 HN LYS 77 -3.240 -13.278 -1.546 587 HA LYS 77 HA LYS 77 -0.610 -12.289 -1.025 588 HB2 LYS 77 HB2 LYS 77 -0.842 -12.880 1.158 589 HB3 LYS 77 HB1 LYS 77 -2.501 -12.542 0.683 590 HG2 LYS 77 HG2 LYS 77 -1.633 -15.348 0.412 591 HG3 LYS 77 HG1 LYS 77 -1.739 -14.727 2.054 592 HD2 LYS 77 HD2 LYS 77 -4.071 -13.879 1.323 593 HD3 LYS 77 HD1 LYS 77 -3.898 -15.040 0.006 594 HE2 LYS 77 HE2 LYS 77 -3.150 -16.486 2.225 595 HE3 LYS 77 HE1 LYS 77 -4.459 -15.477 2.833 596 HZ1 LYS 77 HZ1 LYS 77 -5.538 -17.346 2.050 597 HZ2 LYS 77 HZ2 LYS 77 -4.533 -17.507 0.699 598 HZ3 LYS 77 HZ3 LYS 77 -5.692 -16.276 0.747 599 H GLY 78 HN GLY 78 1.213 -13.419 -0.385 600 HA2 GLY 78 HA2 GLY 78 2.255 -15.622 -0.068 601 HA3 GLY 78 HA1 GLY 78 1.337 -16.160 -1.470 602 H GLY 79 HN GLY 79 2.571 -12.934 -1.604 603 HA2 GLY 79 HA2 GLY 79 5.022 -13.869 -2.915 604 HA3 GLY 79 HA1 GLY 79 3.849 -13.075 -3.947 605 H TYR 80 HN TYR 80 3.947 -10.993 -4.153 606 HA TYR 80 HA TYR 80 5.064 -9.267 -2.130 607 HB2 TYR 80 HB2 TYR 80 6.234 -8.961 -4.864 608 HB3 TYR 80 HB1 TYR 80 6.898 -8.478 -3.313 609 HD1 TYR 80 HD2 TYR 80 6.324 -11.364 -5.549 610 HD2 TYR 80 HD1 TYR 80 8.369 -9.905 -2.113 611 HE1 TYR 80 HE2 TYR 80 7.747 -13.371 -5.550 612 HE2 TYR 80 HE1 TYR 80 9.799 -11.906 -2.106 613 HH TYR 80 HH TYR 80 10.538 -13.648 -3.521 614 H PHE 81 HN PHE 81 4.734 -6.991 -2.682 615 HA PHE 81 HA PHE 81 3.130 -6.419 -4.992 616 HB2 PHE 81 HB2 PHE 81 1.289 -5.317 -3.711 617 HB3 PHE 81 HB1 PHE 81 1.299 -7.068 -3.610 618 HD1 PHE 81 HD1 PHE 81 2.876 -7.918 -1.580 619 HD2 PHE 81 HD2 PHE 81 0.779 -4.193 -1.765 620 HE1 PHE 81 HE1 PHE 81 2.830 -7.798 0.885 621 HE2 PHE 81 HE2 PHE 81 0.745 -4.075 0.657 622 HZ PHE 81 HZ PHE 81 1.773 -5.875 2.006 623 H VAL 82 HN VAL 82 2.405 -4.083 -4.872 624 HA VAL 82 HA VAL 82 4.383 -2.508 -3.411 625 HB VAL 82 HB VAL 82 4.357 -2.978 -6.268 626 HG11 VAL 82 HG11 VAL 82 4.949 -0.418 -6.657 627 HG12 VAL 82 HG12 VAL 82 3.764 -0.197 -5.373 628 HG13 VAL 82 HG13 VAL 82 3.311 -1.036 -6.857 629 HG21 VAL 82 HG21 VAL 82 6.271 -3.040 -4.622 630 HG22 VAL 82 HG22 VAL 82 6.264 -1.278 -4.677 631 HG23 VAL 82 HG23 VAL 82 6.585 -2.204 -6.143 632 H ILE 83 HN ILE 83 3.382 -0.901 -2.388 633 HA ILE 83 HA ILE 83 0.586 -0.521 -2.746 634 HB ILE 83 HB ILE 83 2.641 0.939 -1.166 635 HG12 ILE 83 HG12 ILE 83 2.000 -0.280 0.669 636 HG13 ILE 83 HG11 ILE 83 0.352 -0.450 0.100 637 HG21 ILE 83 HG21 ILE 83 0.215 2.029 -1.951 638 HG22 ILE 83 HG22 ILE 83 1.292 2.618 -0.685 639 HG23 ILE 83 HG23 ILE 83 -0.012 1.514 -0.286 640 HD11 ILE 83 HD11 ILE 83 2.668 -1.951 -1.071 641 HD12 ILE 83 HD12 ILE 83 0.952 -2.241 -1.329 642 HD13 ILE 83 HD13 ILE 83 1.676 -2.552 0.247 643 H ASN 84 HN ASN 84 -0.263 0.589 -4.351 644 HA ASN 84 HA ASN 84 1.114 2.273 -6.050 645 HB2 ASN 84 HB2 ASN 84 -1.500 1.328 -5.823 646 HB3 ASN 84 HB1 ASN 84 -1.649 3.072 -5.761 647 HD21 ASN 84 HD21 ASN 84 0.322 3.894 -7.418 648 HD22 ASN 84 HD22 ASN 84 -0.005 3.357 -9.023 649 HA PRO 85 HA PRO 85 1.687 5.711 -3.135 650 HB2 PRO 85 HB2 PRO 85 2.978 7.332 -4.858 651 HB3 PRO 85 HB1 PRO 85 3.788 5.925 -4.144 652 HG2 PRO 85 HG2 PRO 85 2.321 6.088 -6.772 653 HG3 PRO 85 HG1 PRO 85 3.978 5.579 -6.488 654 HD2 PRO 85 HD2 PRO 85 2.150 3.732 -6.706 655 HD3 PRO 85 HD1 PRO 85 3.313 3.612 -5.363 656 H ASN 86 HN ASN 86 0.414 5.682 -6.283 657 HA ASN 86 HA ASN 86 -0.753 8.242 -6.180 658 HB2 ASN 86 HB2 ASN 86 -0.639 6.029 -8.095 659 HB3 ASN 86 HB1 ASN 86 -2.162 6.900 -8.119 660 HD21 ASN 86 HD21 ASN 86 1.316 7.563 -7.989 661 HD22 ASN 86 HD22 ASN 86 1.281 8.881 -9.105 662 H ASN 87 HN ASN 87 -1.670 5.082 -5.172 663 HA ASN 87 HA ASN 87 -4.450 5.736 -4.719 664 HB2 ASN 87 HB2 ASN 87 -3.136 3.373 -4.966 665 HB3 ASN 87 HB1 ASN 87 -3.182 3.601 -3.220 666 HD21 ASN 87 HD21 ASN 87 -4.821 2.530 -5.896 667 HD22 ASN 87 HD22 ASN 87 -6.387 2.314 -5.197 668 H VAL 88 HN VAL 88 -1.566 6.561 -3.462 669 HA VAL 88 HA VAL 88 -2.328 6.551 -0.740 670 HB VAL 88 HB VAL 88 0.240 6.986 -2.194 671 HG11 VAL 88 HG11 VAL 88 0.645 8.391 -0.466 672 HG12 VAL 88 HG12 VAL 88 0.846 6.903 0.463 673 HG13 VAL 88 HG13 VAL 88 -0.704 7.761 0.482 674 HG21 VAL 88 HG21 VAL 88 0.398 4.795 -1.875 675 HG22 VAL 88 HG22 VAL 88 -1.199 4.807 -1.105 676 HG23 VAL 88 HG23 VAL 88 0.253 5.044 -0.118 677 H LYS 89 HN LYS 89 -2.791 8.136 0.239 678 HA LYS 89 HA LYS 89 -2.853 10.786 -0.901 679 HB2 LYS 89 HB2 LYS 89 -3.889 9.767 1.704 680 HB3 LYS 89 HB1 LYS 89 -4.180 11.368 1.056 681 HG2 LYS 89 HG2 LYS 89 -6.079 9.877 0.787 682 HG3 LYS 89 HG1 LYS 89 -5.450 10.429 -0.752 683 HD2 LYS 89 HD2 LYS 89 -4.384 7.897 0.272 684 HD3 LYS 89 HD1 LYS 89 -6.080 7.907 -0.188 685 HE2 LYS 89 HE2 LYS 89 -3.725 7.827 -1.819 686 HE3 LYS 89 HE1 LYS 89 -5.393 7.526 -2.257 687 HZ1 LYS 89 HZ1 LYS 89 -4.098 10.191 -2.146 688 HZ2 LYS 89 HZ2 LYS 89 -5.718 9.911 -2.538 689 HZ3 LYS 89 HZ3 LYS 89 -4.493 9.337 -3.550 690 H SER 90 HN SER 90 -1.634 8.927 1.719 691 HA SER 90 HA SER 90 0.838 10.218 1.923 692 HB2 SER 90 HB2 SER 90 0.659 12.045 3.238 693 HB3 SER 90 HB1 SER 90 -1.027 12.031 2.727 694 HG SER 90 HG SER 90 -1.526 10.866 4.615 695 H VAL 91 HN VAL 91 1.877 9.956 4.179 696 HA VAL 91 HA VAL 91 1.021 7.417 5.312 697 HB VAL 91 HB VAL 91 3.473 7.887 6.393 698 HG11 VAL 91 HG11 VAL 91 4.119 6.464 4.151 699 HG12 VAL 91 HG12 VAL 91 2.367 6.257 4.237 700 HG13 VAL 91 HG13 VAL 91 3.380 5.788 5.605 701 HG21 VAL 91 HG21 VAL 91 4.965 8.538 4.517 702 HG22 VAL 91 HG22 VAL 91 3.936 9.852 5.089 703 HG23 VAL 91 HG23 VAL 91 3.533 9.001 3.598 704 H GLY 92 HN GLY 92 0.516 7.359 7.517 705 HA2 GLY 92 HA2 GLY 92 0.347 9.958 8.807 706 HA3 GLY 92 HA1 GLY 92 -0.743 8.611 9.089 707 H THR 93 HN THR 93 -0.040 9.619 11.178 708 HA THR 93 HA THR 93 2.397 9.056 12.447 709 HB THR 93 HB THR 93 -0.146 9.120 13.973 710 HG1 THR 93 HG1 THR 93 -0.873 10.727 12.864 711 HG21 THR 93 HG21 THR 93 2.448 10.593 14.136 712 HG22 THR 93 HG22 THR 93 1.851 9.342 15.226 713 HG23 THR 93 HG23 THR 93 1.068 10.921 15.179 714 HA PRO 94 HA PRO 94 2.123 4.804 13.198 715 HB2 PRO 94 HB2 PRO 94 4.349 4.594 14.540 716 HB3 PRO 94 HB1 PRO 94 4.380 5.231 12.886 717 HG2 PRO 94 HG2 PRO 94 4.286 6.804 15.429 718 HG3 PRO 94 HG1 PRO 94 5.488 6.907 14.133 719 HD2 PRO 94 HD2 PRO 94 3.392 8.549 14.237 720 HD3 PRO 94 HD1 PRO 94 4.034 7.942 12.695 721 H MET 95 HN MET 95 1.874 3.325 14.838 722 HA MET 95 HA MET 95 1.511 4.210 17.576 723 HB2 MET 95 HB2 MET 95 -0.759 3.039 15.960 724 HB3 MET 95 HB1 MET 95 -0.771 3.201 17.711 725 HG2 MET 95 HG2 MET 95 -0.160 5.726 16.978 726 HG3 MET 95 HG1 MET 95 -1.160 5.221 15.619 727 HE1 MET 95 HE1 MET 95 -3.294 3.891 15.964 728 HE2 MET 95 HE2 MET 95 -3.978 5.514 15.871 729 HE3 MET 95 HE3 MET 95 -4.533 4.394 17.116 730 H LYS 96 HN LYS 96 1.926 2.595 19.045 731 HA LYS 96 HA LYS 96 2.886 0.083 17.955 732 HB2 LYS 96 HB2 LYS 96 2.779 0.878 20.865 733 HB3 LYS 96 HB1 LYS 96 3.803 -0.345 20.124 734 HG2 LYS 96 HG2 LYS 96 4.394 2.048 18.796 735 HG3 LYS 96 HG1 LYS 96 4.293 2.452 20.511 736 HD2 LYS 96 HD2 LYS 96 5.838 0.054 19.599 737 HD3 LYS 96 HD1 LYS 96 6.558 1.664 19.536 738 HE2 LYS 96 HE2 LYS 96 5.305 0.525 22.023 739 HE3 LYS 96 HE1 LYS 96 7.011 0.316 21.630 740 HZ1 LYS 96 HZ1 LYS 96 5.700 2.969 21.830 741 HZ2 LYS 96 HZ2 LYS 96 7.358 2.643 21.732 742 HZ3 LYS 96 HZ3 LYS 96 6.494 2.225 23.126 743 H GLY 97 HN GLY 97 1.704 -1.767 17.852 744 HA2 GLY 97 HA2 GLY 97 -0.124 -2.493 19.904 745 HA3 GLY 97 HA1 GLY 97 -0.998 -1.837 18.535 746 H SER 98 HN SER 98 0.109 -2.869 16.355 747 HA SER 98 HA SER 98 -0.788 -5.536 16.363 748 HB2 SER 98 HB2 SER 98 0.510 -3.729 14.405 749 HB3 SER 98 HB1 SER 98 0.671 -5.435 14.082 750 HG SER 98 HG SER 98 -1.206 -4.692 13.119 751 H GLY 99 HN GLY 99 0.612 -6.137 18.305 752 HA2 GLY 99 HA2 GLY 99 2.129 -7.998 18.602 753 HA3 GLY 99 HA1 GLY 99 3.109 -7.345 17.301 754 H GLY 100 HN GLY 100 3.477 -4.735 18.027 755 HA2 GLY 100 HA2 GLY 100 3.961 -3.903 20.522 756 HA3 GLY 100 HA1 GLY 100 5.259 -5.046 20.254 757 H LEU 101 HN LEU 101 5.045 -4.117 17.301 758 HA LEU 101 HA LEU 101 7.169 -2.258 17.367 759 HB2 LEU 101 HB2 LEU 101 5.590 -2.766 14.956 760 HB3 LEU 101 HB1 LEU 101 7.307 -2.626 15.175 761 HG LEU 101 HG LEU 101 7.113 -4.936 16.338 762 HD11 LEU 101 HD11 LEU 101 4.554 -4.910 16.189 763 HD12 LEU 101 HD12 LEU 101 5.360 -6.336 15.548 764 HD13 LEU 101 HD13 LEU 101 4.785 -5.079 14.459 765 HD21 LEU 101 HD21 LEU 101 8.022 -4.055 14.118 766 HD22 LEU 101 HD22 LEU 101 6.606 -4.872 13.442 767 HD23 LEU 101 HD23 LEU 101 7.810 -5.793 14.356 768 H SER 102 HN SER 102 6.410 -0.946 15.039 769 HA SER 102 HA SER 102 4.458 0.997 16.000 770 HB2 SER 102 HB2 SER 102 7.147 1.263 14.846 771 HB3 SER 102 HB1 SER 102 5.927 2.414 14.272 772 HG SER 102 HG SER 102 7.259 2.405 16.595 773 H TRP 103 HN TRP 103 2.725 1.008 14.837 774 HA TRP 103 HA TRP 103 2.768 0.267 12.021 775 HB2 TRP 103 HB2 TRP 103 0.628 -0.192 14.078 776 HB3 TRP 103 HB1 TRP 103 0.576 -0.673 12.410 777 HD1 TRP 103 HD1 TRP 103 3.241 -1.110 15.129 778 HE1 TRP 103 HE1 TRP 103 4.127 -3.464 15.033 779 HE3 TRP 103 HE3 TRP 103 0.209 -3.057 11.504 780 HZ2 TRP 103 HZ2 TRP 103 3.633 -5.893 13.680 781 HZ3 TRP 103 HZ3 TRP 103 0.504 -5.402 10.874 782 HH2 TRP 103 HH2 TRP 103 2.168 -6.793 11.956 783 H ALA 104 HN ALA 104 2.331 1.965 10.855 784 HA ALA 104 HA ALA 104 0.945 4.222 12.046 785 HB1 ALA 104 HB1 ALA 104 2.006 5.646 10.428 786 HB2 ALA 104 HB2 ALA 104 2.740 4.241 9.663 787 HB3 ALA 104 HB3 ALA 104 3.196 4.689 11.309 788 H GLN 105 HN GLN 105 -0.501 5.446 11.128 789 HA GLN 105 HA GLN 105 -2.369 4.116 9.481 790 HB2 GLN 105 HB2 GLN 105 -2.723 5.742 11.494 791 HB3 GLN 105 HB1 GLN 105 -2.575 6.981 10.262 792 HG2 GLN 105 HG2 GLN 105 -4.407 6.191 9.092 793 HG3 GLN 105 HG1 GLN 105 -4.425 4.685 9.993 794 HE21 GLN 105 HE21 GLN 105 -6.673 5.104 10.385 795 HE22 GLN 105 HE22 GLN 105 -7.154 6.208 11.624 796 H VAL 106 HN VAL 106 -1.820 4.064 7.255 797 HA VAL 106 HA VAL 106 -0.846 6.571 6.152 798 HB VAL 106 HB VAL 106 -0.730 3.720 5.200 799 HG11 VAL 106 HG11 VAL 106 0.385 4.586 3.162 800 HG12 VAL 106 HG12 VAL 106 -0.163 6.203 3.608 801 HG13 VAL 106 HG13 VAL 106 -1.340 4.951 3.248 802 HG21 VAL 106 HG21 VAL 106 1.239 5.867 5.921 803 HG22 VAL 106 HG22 VAL 106 1.711 4.434 5.004 804 HG23 VAL 106 HG23 VAL 106 1.048 4.256 6.632 805 H ASN 107 HN ASN 107 -1.989 7.669 4.662 806 HA ASN 107 HA ASN 107 -4.813 7.088 4.550 807 HB2 ASN 107 HB2 ASN 107 -3.097 9.441 4.287 808 HB3 ASN 107 HB1 ASN 107 -4.341 9.388 3.047 809 HD21 ASN 107 HD21 ASN 107 -6.539 8.600 4.051 810 HD22 ASN 107 HD22 ASN 107 -7.023 9.479 5.458 811 H PHE 108 HN PHE 108 -5.247 5.582 3.055 812 HA PHE 108 HA PHE 108 -4.121 5.775 0.447 813 HB2 PHE 108 HB2 PHE 108 -5.644 3.631 1.926 814 HB3 PHE 108 HB1 PHE 108 -5.419 3.564 0.203 815 HD1 PHE 108 HD2 PHE 108 -3.298 4.073 3.229 816 HD2 PHE 108 HD1 PHE 108 -3.796 2.158 -0.527 817 HE1 PHE 108 HE2 PHE 108 -1.212 2.817 3.590 818 HE2 PHE 108 HE1 PHE 108 -1.736 0.885 -0.170 819 HZ PHE 108 HZ PHE 108 -0.431 1.217 1.893 820 H THR 109 HN THR 109 -5.510 5.509 -1.283 821 HA THR 109 HA THR 109 -7.606 7.279 -1.445 822 HB THR 109 HB THR 109 -6.054 5.825 -3.182 823 HG1 THR 109 HG1 THR 109 -6.742 7.338 -4.595 824 HG21 THR 109 HG21 THR 109 -7.314 4.618 -4.579 825 HG22 THR 109 HG22 THR 109 -8.765 5.572 -4.260 826 HG23 THR 109 HG23 THR 109 -8.240 4.357 -3.102 827 H THR 110 HN THR 110 -7.893 3.815 -1.840 828 HA THR 110 HA THR 110 -10.762 3.924 -1.517 829 HB THR 110 HB THR 110 -9.499 1.302 -1.635 830 HG1 THR 110 HG1 THR 110 -8.631 1.489 -3.605 831 HG21 THR 110 HG21 THR 110 -11.261 0.714 -2.902 832 HG22 THR 110 HG22 THR 110 -11.290 2.253 -3.765 833 HG23 THR 110 HG23 THR 110 -11.969 2.139 -2.140 834 H GLY 111 HN GLY 111 -7.998 2.505 0.013 835 HA2 GLY 111 HA2 GLY 111 -9.474 1.405 2.172 836 HA3 GLY 111 HA1 GLY 111 -7.732 1.534 2.077 837 H GLY 112 HN GLY 112 -8.795 4.586 1.446 838 HA2 GLY 112 HA2 GLY 112 -8.612 6.509 2.707 839 HA3 GLY 112 HA1 GLY 112 -9.722 5.672 3.777 840 H ASN 113 HN ASN 113 -8.922 4.632 5.603 841 HA ASN 113 HA ASN 113 -6.206 5.413 6.344 842 HB2 ASN 113 HB2 ASN 113 -7.051 4.289 8.565 843 HB3 ASN 113 HB1 ASN 113 -7.584 5.911 8.166 844 HD21 ASN 113 HD21 ASN 113 -8.547 2.721 7.029 845 HD22 ASN 113 HD22 ASN 113 -10.219 2.864 7.454 846 H VAL 114 HN VAL 114 -4.603 3.913 6.405 847 HA VAL 114 HA VAL 114 -5.254 1.078 6.482 848 HB VAL 114 HB VAL 114 -3.311 2.029 4.417 849 HG11 VAL 114 HG11 VAL 114 -4.813 -0.519 4.904 850 HG12 VAL 114 HG12 VAL 114 -3.077 -0.246 5.047 851 HG13 VAL 114 HG13 VAL 114 -3.847 -0.224 3.458 852 HG21 VAL 114 HG21 VAL 114 -6.260 1.549 4.017 853 HG22 VAL 114 HG22 VAL 114 -5.083 1.671 2.708 854 HG23 VAL 114 HG23 VAL 114 -5.386 3.059 3.755 855 H TRP 115 HN TRP 115 -4.001 0.329 8.066 856 HA TRP 115 HA TRP 115 -1.635 1.865 8.689 857 HB2 TRP 115 HB2 TRP 115 -2.984 -0.300 10.232 858 HB3 TRP 115 HB1 TRP 115 -1.542 0.535 10.761 859 HD1 TRP 115 HD1 TRP 115 -5.114 1.409 9.655 860 HE1 TRP 115 HE1 TRP 115 -5.862 3.349 11.096 861 HE3 TRP 115 HE3 TRP 115 -0.813 2.226 12.211 862 HZ2 TRP 115 HZ2 TRP 115 -4.795 5.057 12.978 863 HZ3 TRP 115 HZ3 TRP 115 -0.749 4.084 13.848 864 HH2 TRP 115 HH2 TRP 115 -2.723 5.479 14.231 865 H LEU 116 HN LEU 116 0.328 0.963 9.222 866 HA LEU 116 HA LEU 116 0.972 -1.668 8.203 867 HB2 LEU 116 HB2 LEU 116 1.137 0.502 6.498 868 HB3 LEU 116 HB1 LEU 116 2.769 0.387 7.153 869 HG LEU 116 HG LEU 116 2.441 -2.177 6.489 870 HD11 LEU 116 HD11 LEU 116 0.061 -1.177 5.578 871 HD12 LEU 116 HD12 LEU 116 0.822 -2.670 5.028 872 HD13 LEU 116 HD13 LEU 116 1.056 -1.175 4.122 873 HD21 LEU 116 HD21 LEU 116 3.030 -0.102 4.389 874 HD22 LEU 116 HD22 LEU 116 3.662 -1.745 4.494 875 HD23 LEU 116 HD23 LEU 116 4.147 -0.537 5.678 876 H ASN 117 HN ASN 117 2.867 -2.427 9.195 877 HA ASN 117 HA ASN 117 3.627 -0.923 11.458 878 HB2 ASN 117 HB2 ASN 117 4.102 -2.907 12.024 879 HB3 ASN 117 HB1 ASN 117 4.417 -3.479 10.404 880 HD21 ASN 117 HD21 ASN 117 5.687 -2.537 13.370 881 HD22 ASN 117 HD22 ASN 117 7.367 -2.634 12.982 882 H THR 118 HN THR 118 4.221 0.703 11.216 883 HA THR 118 HA THR 118 5.685 1.865 9.102 884 HB THR 118 HB THR 118 3.831 2.829 10.424 885 HG1 THR 118 HG1 THR 118 4.574 4.625 9.604 886 HG21 THR 118 HG21 THR 118 3.965 3.341 12.570 887 HG22 THR 118 HG22 THR 118 5.593 4.007 12.404 888 HG23 THR 118 HG23 THR 118 5.366 2.272 12.600 889 H THR 119 HN THR 119 6.976 -0.064 11.184 890 HA THR 119 HA THR 119 9.015 1.450 12.427 891 HB THR 119 HB THR 119 8.456 -0.938 12.949 892 HG1 THR 119 HG1 THR 119 10.296 -0.557 13.896 893 HG21 THR 119 HG21 THR 119 8.759 -1.499 10.344 894 HG22 THR 119 HG22 THR 119 8.935 -2.690 11.633 895 HG23 THR 119 HG23 THR 119 10.364 -1.923 10.940 896 H SER 120 HN SER 120 8.500 1.974 9.440 897 HA SER 120 HA SER 120 11.035 2.760 8.717 898 HB2 SER 120 HB2 SER 120 10.184 0.080 7.766 899 HB3 SER 120 HB1 SER 120 10.815 1.169 6.531 900 HG SER 120 HG SER 120 12.102 0.256 8.881 901 H LYS 121 HN LYS 121 10.622 4.476 7.460 902 HA LYS 121 HA LYS 121 7.953 5.034 6.627 903 HB2 LYS 121 HB2 LYS 121 9.338 6.772 7.475 904 HB3 LYS 121 HB1 LYS 121 10.568 6.474 6.255 905 HG2 LYS 121 HG2 LYS 121 8.273 6.967 4.781 906 HG3 LYS 121 HG1 LYS 121 8.182 8.114 6.119 907 HD2 LYS 121 HD2 LYS 121 10.846 8.181 5.246 908 HD3 LYS 121 HD1 LYS 121 9.864 8.157 3.779 909 HE2 LYS 121 HE2 LYS 121 8.809 10.148 4.291 910 HE3 LYS 121 HE1 LYS 121 9.132 9.993 6.017 911 HZ1 LYS 121 HZ1 LYS 121 11.611 10.156 5.023 912 HZ2 LYS 121 HZ2 LYS 121 10.726 11.486 5.580 913 HZ3 LYS 121 HZ3 LYS 121 10.772 11.135 3.926 914 H ASP 122 HN ASP 122 10.996 4.186 5.076 915 HA ASP 122 HA ASP 122 9.979 4.245 2.433 916 HB2 ASP 122 HB2 ASP 122 12.374 2.998 3.735 917 HB3 ASP 122 HB1 ASP 122 11.976 2.665 2.054 918 H ASN 123 HN ASN 123 9.170 2.446 5.092 919 HA ASN 123 HA ASN 123 9.002 -0.154 4.104 920 HB2 ASN 123 HB2 ASN 123 8.718 0.063 6.470 921 HB3 ASN 123 HB1 ASN 123 7.572 1.376 6.249 922 HD21 ASN 123 HD21 ASN 123 7.501 -1.432 4.288 923 HD22 ASN 123 HD22 ASN 123 5.984 -1.950 4.821 924 H LEU 124 HN LEU 124 6.445 2.219 4.373 925 HA LEU 124 HA LEU 124 4.673 0.718 2.777 926 HB2 LEU 124 HB2 LEU 124 4.246 3.578 2.601 927 HB3 LEU 124 HB1 LEU 124 3.172 2.326 3.184 928 HG LEU 124 HG LEU 124 3.578 3.922 4.905 929 HD11 LEU 124 HD11 LEU 124 4.708 1.170 5.182 930 HD12 LEU 124 HD12 LEU 124 3.294 1.890 5.954 931 HD13 LEU 124 HD13 LEU 124 4.910 2.298 6.525 932 HD21 LEU 124 HD21 LEU 124 5.519 5.032 4.756 933 HD22 LEU 124 HD22 LEU 124 6.313 3.694 3.906 934 HD23 LEU 124 HD23 LEU 124 6.203 3.685 5.670 935 H LEU 125 HN LEU 125 6.568 3.595 2.097 936 HA LEU 125 HA LEU 125 6.004 3.767 -0.611 937 HB2 LEU 125 HB2 LEU 125 8.377 4.627 1.015 938 HB3 LEU 125 HB1 LEU 125 8.162 5.047 -0.655 939 HG LEU 125 HG LEU 125 5.913 6.066 0.089 940 HD11 LEU 125 HD11 LEU 125 6.999 5.054 2.539 941 HD12 LEU 125 HD12 LEU 125 5.406 5.749 2.225 942 HD13 LEU 125 HD13 LEU 125 6.757 6.800 2.656 943 HD21 LEU 125 HD21 LEU 125 7.163 7.844 -0.433 944 HD22 LEU 125 HD22 LEU 125 8.633 7.081 0.173 945 HD23 LEU 125 HD23 LEU 125 7.567 7.946 1.281 946 H TYR 126 HN TYR 126 8.677 2.131 1.062 947 HA TYR 126 HA TYR 126 9.464 1.021 -1.559 948 HB2 TYR 126 HB2 TYR 126 10.941 2.110 0.715 949 HB3 TYR 126 HB1 TYR 126 11.579 0.593 0.120 950 HD1 TYR 126 HD2 TYR 126 10.136 3.652 -1.460 951 HD2 TYR 126 HD1 TYR 126 13.388 0.919 -1.284 952 HE1 TYR 126 HE2 TYR 126 11.260 4.885 -3.264 953 HE2 TYR 126 HE1 TYR 126 14.524 2.144 -3.086 954 HH TYR 126 HH TYR 126 13.838 5.151 -3.975 955 H GLY 127 HN GLY 127 8.718 0.277 1.795 956 HA2 GLY 127 HA2 GLY 127 7.735 -1.895 2.315 957 HA3 GLY 127 HA1 GLY 127 8.628 -2.582 0.970 958 H LYS 128 HN LYS 128 10.163 -0.350 3.101 959 HA LYS 128 HA LYS 128 12.145 -2.235 3.819 960 HB2 LYS 128 HB2 LYS 128 11.565 0.549 4.803 961 HB3 LYS 128 HB1 LYS 128 13.021 -0.353 5.133 962 HG2 LYS 128 HG2 LYS 128 13.222 -0.491 2.558 963 HG3 LYS 128 HG1 LYS 128 12.107 0.882 2.596 964 HD2 LYS 128 HD2 LYS 128 13.642 2.243 3.728 965 HD3 LYS 128 HD1 LYS 128 14.567 0.862 4.310 966 HE2 LYS 128 HE2 LYS 128 15.611 2.265 2.453 967 HE3 LYS 128 HE1 LYS 128 15.599 0.516 2.243 968 HZ1 LYS 128 HZ1 LYS 128 14.466 0.750 0.373 969 HZ2 LYS 128 HZ2 LYS 128 14.593 2.429 0.513 970 HZ3 LYS 128 HZ3 LYS 128 13.246 1.630 1.144 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 27.433 29.244 -25.470 2 H2 MET 1 HT2 MET 1 26.133 30.207 -24.899 3 H3 MET 1 HT3 MET 1 27.296 30.879 -25.968 4 HA MET 1 HA MET 1 25.050 30.187 -26.869 5 HB2 MET 1 HB2 MET 1 27.716 30.246 -27.874 6 HB3 MET 1 HB1 MET 1 26.877 28.919 -28.666 7 HG2 MET 1 HG2 MET 1 25.360 31.424 -28.516 8 HG3 MET 1 HG1 MET 1 26.829 31.497 -29.489 9 HE1 MET 1 HE1 MET 1 23.666 31.840 -30.543 10 HE2 MET 1 HE2 MET 1 23.217 30.666 -29.306 11 HE3 MET 1 HE3 MET 1 22.917 30.313 -31.007 12 H ARG 2 HN ARG 2 23.634 28.567 -26.878 13 HA ARG 2 HA ARG 2 24.351 25.965 -25.923 14 HB2 ARG 2 HB2 ARG 2 21.742 26.849 -27.161 15 HB3 ARG 2 HB1 ARG 2 22.002 25.430 -26.155 16 HG2 ARG 2 HG2 ARG 2 22.231 26.690 -24.216 17 HG3 ARG 2 HG1 ARG 2 22.573 28.174 -25.107 18 HD2 ARG 2 HD2 ARG 2 20.414 28.599 -24.560 19 HD3 ARG 2 HD1 ARG 2 20.132 27.703 -26.050 20 HE ARG 2 HE ARG 2 19.823 25.711 -24.564 21 HH11 ARG 2 HH11 ARG 2 19.220 28.944 -23.366 22 HH12 ARG 2 HH12 ARG 2 18.100 28.415 -22.160 23 HH21 ARG 2 HH21 ARG 2 18.351 25.029 -22.977 24 HH22 ARG 2 HH22 ARG 2 17.605 26.197 -21.939 25 H GLY 3 HN GLY 3 23.780 23.960 -27.087 26 HA2 GLY 3 HA2 GLY 3 23.374 22.832 -29.178 27 HA3 GLY 3 HA1 GLY 3 24.064 24.217 -30.008 28 H SER 4 HN SER 4 25.899 23.499 -27.298 29 HA SER 4 HA SER 4 28.118 22.654 -28.853 30 HB2 SER 4 HB2 SER 4 27.581 23.174 -25.982 31 HB3 SER 4 HB1 SER 4 28.925 22.090 -26.344 32 HG SER 4 HG SER 4 28.794 24.768 -26.572 33 H HIS 5 HN HIS 5 28.931 20.675 -29.248 34 HA HIS 5 HA HIS 5 27.493 18.371 -28.104 35 HB2 HIS 5 HB2 HIS 5 27.436 18.976 -30.690 36 HB3 HIS 5 HB1 HIS 5 28.977 18.126 -30.681 37 HD1 HIS 5 HD1 HIS 5 25.916 17.324 -31.774 38 HD2 HIS 5 HD2 HIS 5 28.201 15.617 -28.753 39 HE1 HIS 5 HE1 HIS 5 25.035 14.985 -31.505 40 HE2 HIS 5 HE2 HIS 5 26.497 13.941 -29.738 41 H HIS 6 HN HIS 6 30.595 19.754 -28.931 42 HA HIS 6 HA HIS 6 32.069 17.403 -28.135 43 HB2 HIS 6 HB2 HIS 6 34.067 18.932 -28.467 44 HB3 HIS 6 HB1 HIS 6 33.070 18.643 -29.888 45 HD1 HIS 6 HD1 HIS 6 34.261 20.911 -30.721 46 HD2 HIS 6 HD2 HIS 6 31.520 21.302 -27.621 47 HE1 HIS 6 HE1 HIS 6 33.678 23.356 -30.641 48 HE2 HIS 6 HE2 HIS 6 31.984 23.561 -28.789 49 H HIS 7 HN HIS 7 31.883 16.951 -26.007 50 HA HIS 7 HA HIS 7 32.855 19.000 -24.137 51 HB2 HIS 7 HB2 HIS 7 30.411 17.261 -23.826 52 HB3 HIS 7 HB1 HIS 7 31.212 18.013 -22.451 53 HD1 HIS 7 HD1 HIS 7 28.410 18.559 -24.430 54 HD2 HIS 7 HD2 HIS 7 31.527 21.022 -23.209 55 HE1 HIS 7 HE1 HIS 7 27.533 20.907 -24.638 56 HE2 HIS 7 HE2 HIS 7 29.448 22.383 -23.928 57 H HIS 8 HN HIS 8 34.435 18.307 -22.841 58 HA HIS 8 HA HIS 8 35.205 15.507 -22.978 59 HB2 HIS 8 HB2 HIS 8 36.550 18.053 -22.335 60 HB3 HIS 8 HB1 HIS 8 37.091 16.664 -21.399 61 HD1 HIS 8 HD1 HIS 8 36.803 14.564 -23.737 62 HD2 HIS 8 HD2 HIS 8 38.751 18.225 -23.979 63 HE1 HIS 8 HE1 HIS 8 38.451 14.325 -25.621 64 HE2 HIS 8 HE2 HIS 8 39.565 16.577 -25.798 65 H HIS 9 HN HIS 9 33.246 14.916 -21.706 66 HA HIS 9 HA HIS 9 33.809 15.139 -18.823 67 HB2 HIS 9 HB2 HIS 9 31.393 15.001 -18.399 68 HB3 HIS 9 HB1 HIS 9 31.787 16.402 -19.388 69 HD1 HIS 9 HD1 HIS 9 30.574 12.834 -19.922 70 HD2 HIS 9 HD2 HIS 9 30.208 16.630 -21.566 71 HE1 HIS 9 HE1 HIS 9 28.899 12.602 -21.783 72 HE2 HIS 9 HE2 HIS 9 28.621 14.932 -22.698 73 H HIS 10 HN HIS 10 32.470 13.301 -17.647 74 HA HIS 10 HA HIS 10 32.871 10.758 -19.130 75 HB2 HIS 10 HB2 HIS 10 34.324 11.680 -16.885 76 HB3 HIS 10 HB1 HIS 10 33.237 10.436 -16.280 77 HD1 HIS 10 HD1 HIS 10 35.097 10.525 -19.592 78 HD2 HIS 10 HD2 HIS 10 34.859 8.266 -16.113 79 HE1 HIS 10 HE1 HIS 10 36.543 8.509 -19.999 80 HE2 HIS 10 HE2 HIS 10 36.499 7.236 -17.825 81 H GLY 11 HN GLY 11 31.805 8.907 -17.750 82 HA2 GLY 11 HA2 GLY 11 29.035 9.779 -17.329 83 HA3 GLY 11 HA1 GLY 11 29.555 8.138 -17.679 84 H SER 12 HN SER 12 31.306 9.924 -15.299 85 HA SER 12 HA SER 12 30.315 8.106 -13.243 86 HB2 SER 12 HB2 SER 12 32.505 10.111 -12.802 87 HB3 SER 12 HB1 SER 12 32.281 8.527 -12.061 88 HG SER 12 HG SER 12 33.225 9.159 -14.642 89 H GLU 13 HN GLU 13 28.913 10.611 -14.332 90 HA GLU 13 HA GLU 13 28.398 11.838 -11.705 91 HB2 GLU 13 HB2 GLU 13 28.609 13.137 -14.415 92 HB3 GLU 13 HB1 GLU 13 27.759 13.908 -13.083 93 HG2 GLU 13 HG2 GLU 13 30.192 13.173 -11.990 94 HG3 GLU 13 HG1 GLU 13 30.596 13.719 -13.616 95 HA PRO 14 HA PRO 14 24.544 9.972 -13.707 96 HB2 PRO 14 HB2 PRO 14 23.917 8.313 -11.647 97 HB3 PRO 14 HB1 PRO 14 24.950 7.830 -12.996 98 HG2 PRO 14 HG2 PRO 14 25.723 8.751 -10.254 99 HG3 PRO 14 HG1 PRO 14 26.384 7.413 -11.212 100 HD2 PRO 14 HD2 PRO 14 27.636 9.796 -11.024 101 HD3 PRO 14 HD1 PRO 14 27.692 8.814 -12.503 102 H THR 15 HN THR 15 22.555 10.793 -13.328 103 HA THR 15 HA THR 15 21.926 11.867 -10.682 104 HB THR 15 HB THR 15 20.894 13.868 -12.098 105 HG1 THR 15 HG1 THR 15 22.365 14.412 -13.776 106 HG21 THR 15 HG21 THR 15 23.589 14.634 -11.962 107 HG22 THR 15 HG22 THR 15 23.304 13.538 -10.610 108 HG23 THR 15 HG23 THR 15 22.299 14.975 -10.809 109 H THR 16 HN THR 16 20.930 9.540 -11.703 110 HA THR 16 HA THR 16 18.286 10.156 -12.796 111 HB THR 16 HB THR 16 19.138 7.355 -12.250 112 HG1 THR 16 HG1 THR 16 20.373 7.367 -14.179 113 HG21 THR 16 HG21 THR 16 18.287 7.191 -14.688 114 HG22 THR 16 HG22 THR 16 17.566 8.766 -14.353 115 HG23 THR 16 HG23 THR 16 17.130 7.369 -13.368 116 HA PRO 17 HA PRO 17 16.347 9.763 -8.832 117 HB2 PRO 17 HB2 PRO 17 13.854 9.006 -9.615 118 HB3 PRO 17 HB1 PRO 17 14.451 10.662 -9.752 119 HG2 PRO 17 HG2 PRO 17 14.296 8.526 -11.843 120 HG3 PRO 17 HG1 PRO 17 13.888 10.248 -11.970 121 HD2 PRO 17 HD2 PRO 17 16.217 9.262 -12.895 122 HD3 PRO 17 HD1 PRO 17 16.099 10.886 -12.189 123 H THR 18 HN THR 18 16.276 8.199 -7.339 124 HA THR 18 HA THR 18 15.829 5.425 -8.229 125 HB THR 18 HB THR 18 17.783 6.256 -6.079 126 HG1 THR 18 HG1 THR 18 18.461 6.939 -8.170 127 HG21 THR 18 HG21 THR 18 17.467 4.068 -5.594 128 HG22 THR 18 HG22 THR 18 18.676 3.895 -6.867 129 HG23 THR 18 HG23 THR 18 16.967 3.658 -7.234 130 H THR 19 HN THR 19 13.670 6.682 -7.408 131 HA THR 19 HA THR 19 13.300 5.907 -4.578 132 HB THR 19 HB THR 19 11.647 7.597 -4.354 133 HG1 THR 19 HG1 THR 19 11.872 8.376 -7.045 134 HG21 THR 19 HG21 THR 19 13.594 8.773 -4.087 135 HG22 THR 19 HG22 THR 19 12.814 9.679 -5.384 136 HG23 THR 19 HG23 THR 19 14.099 8.531 -5.760 137 H ASN 20 HN ASN 20 13.156 3.980 -6.583 138 HA ASN 20 HA ASN 20 10.486 3.574 -7.495 139 HB2 ASN 20 HB2 ASN 20 12.551 1.401 -7.214 140 HB3 ASN 20 HB1 ASN 20 11.253 1.532 -8.396 141 HD21 ASN 20 HD21 ASN 20 11.655 4.252 -9.074 142 HD22 ASN 20 HD22 ASN 20 13.134 4.361 -9.961 143 H LEU 21 HN LEU 21 8.814 2.646 -6.520 144 HA LEU 21 HA LEU 21 8.813 2.074 -3.777 145 HB2 LEU 21 HB2 LEU 21 6.735 0.977 -5.631 146 HB3 LEU 21 HB1 LEU 21 6.542 1.587 -4.000 147 HG LEU 21 HG LEU 21 7.399 3.553 -6.048 148 HD11 LEU 21 HD11 LEU 21 4.666 2.300 -5.993 149 HD12 LEU 21 HD12 LEU 21 5.774 2.422 -7.359 150 HD13 LEU 21 HD13 LEU 21 5.006 3.872 -6.714 151 HD21 LEU 21 HD21 LEU 21 6.539 3.628 -3.428 152 HD22 LEU 21 HD22 LEU 21 5.131 4.160 -4.346 153 HD23 LEU 21 HD23 LEU 21 6.671 5.000 -4.527 154 H LYS 22 HN LYS 22 10.424 0.528 -3.406 155 HA LYS 22 HA LYS 22 10.774 -1.885 -4.667 156 HB2 LYS 22 HB2 LYS 22 11.609 -0.696 -2.193 157 HB3 LYS 22 HB1 LYS 22 11.265 -2.402 -1.974 158 HG2 LYS 22 HG2 LYS 22 12.775 -2.966 -3.797 159 HG3 LYS 22 HG1 LYS 22 13.107 -1.254 -4.054 160 HD2 LYS 22 HD2 LYS 22 14.005 -1.128 -1.751 161 HD3 LYS 22 HD1 LYS 22 13.756 -2.867 -1.589 162 HE2 LYS 22 HE2 LYS 22 15.163 -2.866 -3.851 163 HE3 LYS 22 HE1 LYS 22 15.778 -1.366 -3.157 164 HZ1 LYS 22 HZ1 LYS 22 16.279 -4.087 -2.373 165 HZ2 LYS 22 HZ2 LYS 22 15.875 -3.086 -1.071 166 HZ3 LYS 22 HZ3 LYS 22 17.183 -2.690 -2.067 167 H ILE 23 HN ILE 23 10.355 -4.076 -3.750 168 HA ILE 23 HA ILE 23 7.588 -4.523 -3.741 169 HB ILE 23 HB ILE 23 9.973 -5.987 -4.165 170 HG12 ILE 23 HG12 ILE 23 7.503 -7.403 -4.675 171 HG13 ILE 23 HG11 ILE 23 7.412 -5.714 -5.139 172 HG21 ILE 23 HG21 ILE 23 8.071 -7.382 -2.293 173 HG22 ILE 23 HG22 ILE 23 9.764 -7.000 -1.991 174 HG23 ILE 23 HG23 ILE 23 9.333 -8.180 -3.228 175 HD11 ILE 23 HD11 ILE 23 9.595 -7.572 -6.028 176 HD12 ILE 23 HD12 ILE 23 9.292 -5.926 -6.595 177 HD13 ILE 23 HD13 ILE 23 8.143 -7.214 -6.963 178 H TYR 24 HN TYR 24 6.290 -5.629 -2.372 179 HA TYR 24 HA TYR 24 6.787 -5.378 0.512 180 HB2 TYR 24 HB2 TYR 24 4.449 -5.227 -1.261 181 HB3 TYR 24 HB1 TYR 24 4.201 -6.039 0.249 182 HD1 TYR 24 HD2 TYR 24 5.470 -2.803 -1.109 183 HD2 TYR 24 HD1 TYR 24 3.520 -4.842 2.057 184 HE1 TYR 24 HE2 TYR 24 4.982 -0.656 -0.029 185 HE2 TYR 24 HE1 TYR 24 3.013 -2.707 3.144 186 HH TYR 24 HH TYR 24 2.739 -0.342 2.468 187 H LYS 25 HN LYS 25 5.617 -7.304 1.687 188 HA LYS 25 HA LYS 25 5.970 -9.730 0.054 189 HB2 LYS 25 HB2 LYS 25 6.668 -9.191 2.900 190 HB3 LYS 25 HB1 LYS 25 6.315 -10.829 2.351 191 HG2 LYS 25 HG2 LYS 25 8.073 -10.479 0.571 192 HG3 LYS 25 HG1 LYS 25 8.525 -9.008 1.433 193 HD2 LYS 25 HD2 LYS 25 9.218 -10.215 3.334 194 HD3 LYS 25 HD1 LYS 25 8.406 -11.685 2.797 195 HE2 LYS 25 HE2 LYS 25 10.010 -12.055 1.103 196 HE3 LYS 25 HE1 LYS 25 10.679 -10.434 1.280 197 HZ1 LYS 25 HZ1 LYS 25 12.193 -11.488 2.531 198 HZ2 LYS 25 HZ2 LYS 25 11.202 -12.826 2.820 199 HZ3 LYS 25 HZ3 LYS 25 11.014 -11.422 3.743 200 H VAL 26 HN VAL 26 3.970 -10.481 -0.454 201 HA VAL 26 HA VAL 26 1.796 -9.982 1.322 202 HB VAL 26 HB VAL 26 1.131 -11.868 -0.760 203 HG11 VAL 26 HG11 VAL 26 0.272 -9.054 -0.329 204 HG12 VAL 26 HG12 VAL 26 -0.242 -10.376 0.717 205 HG13 VAL 26 HG13 VAL 26 -0.660 -10.391 -1.001 206 HG21 VAL 26 HG21 VAL 26 2.307 -11.026 -2.450 207 HG22 VAL 26 HG22 VAL 26 2.924 -9.720 -1.441 208 HG23 VAL 26 HG23 VAL 26 1.374 -9.546 -2.253 209 H ASP 27 HN ASP 27 2.567 -10.967 3.042 210 HA ASP 27 HA ASP 27 3.070 -13.780 3.160 211 HB2 ASP 27 HB2 ASP 27 3.096 -11.567 5.153 212 HB3 ASP 27 HB1 ASP 27 3.109 -13.213 5.747 213 H ASP 28 HN ASP 28 0.333 -11.743 3.673 214 HA ASP 28 HA ASP 28 -1.442 -13.926 3.654 215 HB2 ASP 28 HB2 ASP 28 -0.307 -14.001 6.004 216 HB3 ASP 28 HB1 ASP 28 -1.393 -12.666 6.369 217 H LEU 29 HN LEU 29 -3.162 -13.106 2.709 218 HA LEU 29 HA LEU 29 -4.223 -10.602 3.694 219 HB2 LEU 29 HB2 LEU 29 -3.736 -9.503 1.874 220 HB3 LEU 29 HB1 LEU 29 -3.159 -10.947 1.114 221 HG LEU 29 HG LEU 29 -6.072 -10.680 1.276 222 HD11 LEU 29 HD11 LEU 29 -4.357 -8.787 -0.242 223 HD12 LEU 29 HD12 LEU 29 -5.795 -8.484 0.741 224 HD13 LEU 29 HD13 LEU 29 -5.946 -9.257 -0.843 225 HD21 LEU 29 HD21 LEU 29 -4.362 -11.350 -1.070 226 HD22 LEU 29 HD22 LEU 29 -6.014 -11.861 -0.712 227 HD23 LEU 29 HD23 LEU 29 -4.665 -12.491 0.238 228 H GLN 30 HN GLN 30 -6.319 -10.498 3.895 229 HA GLN 30 HA GLN 30 -7.981 -12.747 3.034 230 HB2 GLN 30 HB2 GLN 30 -7.421 -11.697 5.729 231 HB3 GLN 30 HB1 GLN 30 -9.125 -11.863 5.364 232 HG2 GLN 30 HG2 GLN 30 -8.171 -13.833 6.481 233 HG3 GLN 30 HG1 GLN 30 -8.868 -14.198 4.902 234 HE21 GLN 30 HE21 GLN 30 -7.327 -14.067 3.085 235 HE22 GLN 30 HE22 GLN 30 -5.725 -14.648 3.337 236 H LYS 31 HN LYS 31 -10.306 -12.319 2.984 237 HA LYS 31 HA LYS 31 -10.843 -9.754 1.901 238 HB2 LYS 31 HB2 LYS 31 -12.093 -12.235 1.817 239 HB3 LYS 31 HB1 LYS 31 -13.197 -11.224 2.746 240 HG2 LYS 31 HG2 LYS 31 -12.139 -10.740 -0.020 241 HG3 LYS 31 HG1 LYS 31 -13.792 -11.051 0.470 242 HD2 LYS 31 HD2 LYS 31 -12.449 -8.749 1.713 243 HD3 LYS 31 HD1 LYS 31 -12.882 -8.599 0.007 244 HE2 LYS 31 HE2 LYS 31 -14.800 -7.824 1.011 245 HE3 LYS 31 HE1 LYS 31 -15.179 -9.537 0.826 246 HZ1 LYS 31 HZ1 LYS 31 -15.709 -9.270 2.998 247 HZ2 LYS 31 HZ2 LYS 31 -14.600 -8.021 3.247 248 HZ3 LYS 31 HZ3 LYS 31 -14.066 -9.618 3.196 249 H ILE 32 HN ILE 32 -10.567 -8.161 3.347 250 HA ILE 32 HA ILE 32 -11.624 -8.511 6.069 251 HB ILE 32 HB ILE 32 -9.166 -7.117 5.053 252 HG12 ILE 32 HG12 ILE 32 -9.800 -9.861 5.746 253 HG13 ILE 32 HG11 ILE 32 -8.447 -9.202 4.845 254 HG21 ILE 32 HG21 ILE 32 -10.127 -7.497 7.858 255 HG22 ILE 32 HG22 ILE 32 -9.674 -5.999 7.041 256 HG23 ILE 32 HG23 ILE 32 -8.426 -7.199 7.442 257 HD11 ILE 32 HD11 ILE 32 -7.104 -9.277 6.570 258 HD12 ILE 32 HD12 ILE 32 -8.268 -10.423 7.207 259 HD13 ILE 32 HD13 ILE 32 -8.333 -8.731 7.696 260 H ASN 33 HN ASN 33 -13.124 -7.129 6.718 261 HA ASN 33 HA ASN 33 -14.454 -5.303 6.919 262 HB2 ASN 33 HB2 ASN 33 -11.814 -4.075 6.171 263 HB3 ASN 33 HB1 ASN 33 -13.244 -3.075 6.385 264 HD21 ASN 33 HD21 ASN 33 -11.831 -5.858 8.074 265 HD22 ASN 33 HD22 ASN 33 -11.887 -5.147 9.644 266 H GLY 34 HN GLY 34 -14.621 -6.779 4.525 267 HA2 GLY 34 HA2 GLY 34 -15.835 -6.627 2.585 268 HA3 GLY 34 HA1 GLY 34 -16.005 -4.912 2.896 269 H ILE 35 HN ILE 35 -12.780 -5.627 3.100 270 HA ILE 35 HA ILE 35 -12.269 -5.275 0.247 271 HB ILE 35 HB ILE 35 -10.344 -3.764 1.654 272 HG12 ILE 35 HG12 ILE 35 -12.878 -2.386 2.249 273 HG13 ILE 35 HG11 ILE 35 -12.547 -3.782 3.255 274 HG21 ILE 35 HG21 ILE 35 -11.178 -3.452 -0.669 275 HG22 ILE 35 HG22 ILE 35 -11.079 -1.959 0.263 276 HG23 ILE 35 HG23 ILE 35 -12.642 -2.735 0.004 277 HD11 ILE 35 HD11 ILE 35 -10.537 -1.609 2.854 278 HD12 ILE 35 HD12 ILE 35 -10.580 -2.863 4.095 279 HD13 ILE 35 HD13 ILE 35 -11.766 -1.557 4.119 280 H TRP 36 HN TRP 36 -10.432 -6.355 -0.449 281 HA TRP 36 HA TRP 36 -9.377 -8.398 1.161 282 HB2 TRP 36 HB2 TRP 36 -8.443 -7.121 -1.413 283 HB3 TRP 36 HB1 TRP 36 -7.546 -8.430 -0.653 284 HD1 TRP 36 HD1 TRP 36 -10.244 -7.867 -3.082 285 HE1 TRP 36 HE1 TRP 36 -11.526 -10.047 -3.557 286 HE3 TRP 36 HE3 TRP 36 -8.464 -10.716 0.773 287 HZ2 TRP 36 HZ2 TRP 36 -11.755 -12.629 -2.447 288 HZ3 TRP 36 HZ3 TRP 36 -9.270 -13.030 0.998 289 HH2 TRP 36 HH2 TRP 36 -10.882 -13.965 -0.580 290 H GLN 37 HN GLN 37 -7.732 -8.386 2.673 291 HA GLN 37 HA GLN 37 -6.183 -5.892 2.888 292 HB2 GLN 37 HB2 GLN 37 -7.646 -6.084 4.737 293 HB3 GLN 37 HB1 GLN 37 -7.176 -7.749 5.027 294 HG2 GLN 37 HG2 GLN 37 -4.824 -6.304 5.194 295 HG3 GLN 37 HG1 GLN 37 -6.038 -5.301 5.961 296 HE21 GLN 37 HE21 GLN 37 -5.415 -8.808 5.921 297 HE22 GLN 37 HE22 GLN 37 -5.354 -8.971 7.657 298 H VAL 38 HN VAL 38 -4.030 -5.957 3.332 299 HA VAL 38 HA VAL 38 -2.796 -8.597 2.879 300 HB VAL 38 HB VAL 38 -1.631 -5.849 2.308 301 HG11 VAL 38 HG11 VAL 38 -0.741 -8.681 1.797 302 HG12 VAL 38 HG12 VAL 38 0.174 -7.321 2.443 303 HG13 VAL 38 HG13 VAL 38 -0.228 -7.378 0.727 304 HG21 VAL 38 HG21 VAL 38 -2.118 -7.002 -0.119 305 HG22 VAL 38 HG22 VAL 38 -3.165 -5.823 0.673 306 HG23 VAL 38 HG23 VAL 38 -3.511 -7.547 0.817 307 H ARG 39 HN ARG 39 -0.902 -9.221 3.830 308 HA ARG 39 HA ARG 39 0.173 -7.641 6.029 309 HB2 ARG 39 HB2 ARG 39 -0.910 -10.447 6.364 310 HB3 ARG 39 HB1 ARG 39 0.149 -9.655 7.508 311 HG2 ARG 39 HG2 ARG 39 -1.431 -8.157 8.163 312 HG3 ARG 39 HG1 ARG 39 -2.375 -8.323 6.688 313 HD2 ARG 39 HD2 ARG 39 -2.061 -10.494 8.758 314 HD3 ARG 39 HD1 ARG 39 -3.417 -9.369 8.705 315 HE ARG 39 HE ARG 39 -3.312 -10.489 6.203 316 HH11 ARG 39 HH11 ARG 39 -3.650 -11.693 9.461 317 HH12 ARG 39 HH12 ARG 39 -4.594 -13.065 8.988 318 HH21 ARG 39 HH21 ARG 39 -4.551 -12.289 5.580 319 HH22 ARG 39 HH22 ARG 39 -5.106 -13.404 6.783 320 H ASN 40 HN ASN 40 2.394 -7.895 6.241 321 HA ASN 40 HA ASN 40 3.581 -10.200 4.928 322 HB2 ASN 40 HB2 ASN 40 5.500 -8.054 5.092 323 HB3 ASN 40 HB1 ASN 40 5.111 -9.107 3.768 324 HD21 ASN 40 HD21 ASN 40 5.754 -6.261 3.959 325 HD22 ASN 40 HD22 ASN 40 4.538 -5.528 2.987 326 H ASN 41 HN ASN 41 5.425 -10.873 5.840 327 HA ASN 41 HA ASN 41 5.381 -10.994 8.594 328 HB2 ASN 41 HB2 ASN 41 7.798 -11.993 8.181 329 HB3 ASN 41 HB1 ASN 41 6.365 -12.854 7.644 330 HD21 ASN 41 HD21 ASN 41 7.207 -10.015 5.965 331 HD22 ASN 41 HD22 ASN 41 7.764 -10.743 4.534 332 H ILE 42 HN ILE 42 6.855 -8.599 6.567 333 HA ILE 42 HA ILE 42 8.916 -7.835 8.327 334 HB ILE 42 HB ILE 42 7.738 -6.254 6.093 335 HG12 ILE 42 HG12 ILE 42 9.985 -7.397 5.085 336 HG13 ILE 42 HG11 ILE 42 9.344 -8.703 6.072 337 HG21 ILE 42 HG21 ILE 42 9.646 -5.009 6.126 338 HG22 ILE 42 HG22 ILE 42 10.566 -6.253 6.972 339 HG23 ILE 42 HG23 ILE 42 9.350 -5.313 7.833 340 HD11 ILE 42 HD11 ILE 42 7.103 -7.985 4.937 341 HD12 ILE 42 HD12 ILE 42 8.219 -9.104 4.160 342 HD13 ILE 42 HD13 ILE 42 8.197 -7.412 3.678 343 H LEU 43 HN LEU 43 5.898 -6.471 7.186 344 HA LEU 43 HA LEU 43 5.893 -4.573 9.372 345 HB2 LEU 43 HB2 LEU 43 4.051 -4.667 7.007 346 HB3 LEU 43 HB1 LEU 43 4.219 -3.362 8.160 347 HG LEU 43 HG LEU 43 5.453 -2.474 6.523 348 HD11 LEU 43 HD11 LEU 43 7.004 -3.108 8.460 349 HD12 LEU 43 HD12 LEU 43 7.734 -2.591 6.941 350 HD13 LEU 43 HD13 LEU 43 7.664 -4.305 7.348 351 HD21 LEU 43 HD21 LEU 43 5.506 -5.197 5.516 352 HD22 LEU 43 HD22 LEU 43 6.954 -4.266 5.130 353 HD23 LEU 43 HD23 LEU 43 5.363 -3.663 4.654 354 H VAL 44 HN VAL 44 4.580 -7.573 8.483 355 HA VAL 44 HA VAL 44 2.710 -7.354 10.680 356 HB VAL 44 HB VAL 44 1.617 -8.481 8.199 357 HG11 VAL 44 HG11 VAL 44 0.774 -8.503 10.773 358 HG12 VAL 44 HG12 VAL 44 -0.284 -8.674 9.378 359 HG13 VAL 44 HG13 VAL 44 -0.076 -7.096 10.141 360 HG21 VAL 44 HG21 VAL 44 0.833 -6.476 7.397 361 HG22 VAL 44 HG22 VAL 44 2.403 -5.990 8.021 362 HG23 VAL 44 HG23 VAL 44 0.950 -5.691 8.969 363 HA PRO 45 HA PRO 45 5.151 -11.295 10.566 364 HB2 PRO 45 HB2 PRO 45 4.567 -10.565 13.395 365 HB3 PRO 45 HB1 PRO 45 6.019 -11.339 12.754 366 HG2 PRO 45 HG2 PRO 45 6.090 -8.818 13.376 367 HG3 PRO 45 HG1 PRO 45 6.737 -9.303 11.791 368 HD2 PRO 45 HD2 PRO 45 4.099 -8.057 12.465 369 HD3 PRO 45 HD1 PRO 45 5.193 -7.716 11.136 370 H THR 46 HN THR 46 2.381 -10.027 12.158 371 HA THR 46 HA THR 46 0.498 -11.833 11.352 372 HB THR 46 HB THR 46 1.870 -13.488 12.639 373 HG1 THR 46 HG1 THR 46 0.107 -14.504 13.349 374 HG21 THR 46 HG21 THR 46 1.688 -11.522 14.693 375 HG22 THR 46 HG22 THR 46 2.604 -13.028 14.664 376 HG23 THR 46 HG23 THR 46 0.935 -13.021 15.238 377 H ASP 47 HN ASP 47 -1.573 -11.515 12.337 378 HA ASP 47 HA ASP 47 -3.191 -10.429 13.554 379 HB2 ASP 47 HB2 ASP 47 -1.228 -9.000 15.174 380 HB3 ASP 47 HB1 ASP 47 -2.772 -9.669 15.661 381 H PHE 48 HN PHE 48 -2.806 -9.122 11.263 382 HA PHE 48 HA PHE 48 -2.212 -6.371 11.736 383 HB2 PHE 48 HB2 PHE 48 -2.057 -7.985 9.550 384 HB3 PHE 48 HB1 PHE 48 -3.573 -7.166 9.246 385 HD1 PHE 48 HD1 PHE 48 -1.525 -4.914 11.046 386 HD2 PHE 48 HD2 PHE 48 -2.028 -6.661 7.202 387 HE1 PHE 48 HE1 PHE 48 -0.287 -3.061 10.009 388 HE2 PHE 48 HE2 PHE 48 -0.769 -4.830 6.195 389 HZ PHE 48 HZ PHE 48 0.096 -3.025 7.591 390 H THR 49 HN THR 49 -3.790 -5.261 12.749 391 HA THR 49 HA THR 49 -6.338 -6.064 13.273 392 HB THR 49 HB THR 49 -6.143 -3.196 12.665 393 HG1 THR 49 HG1 THR 49 -4.815 -2.985 14.646 394 HG21 THR 49 HG21 THR 49 -6.935 -3.007 14.983 395 HG22 THR 49 HG22 THR 49 -6.942 -4.770 15.076 396 HG23 THR 49 HG23 THR 49 -7.982 -3.937 13.911 397 H TRP 50 HN TRP 50 -7.269 -7.059 11.610 398 HA TRP 50 HA TRP 50 -7.589 -6.408 8.977 399 HB2 TRP 50 HB2 TRP 50 -9.474 -7.619 10.975 400 HB3 TRP 50 HB1 TRP 50 -9.910 -7.480 9.331 401 HD1 TRP 50 HD1 TRP 50 -6.309 -8.364 9.742 402 HE1 TRP 50 HE1 TRP 50 -5.939 -10.870 9.305 403 HE3 TRP 50 HE3 TRP 50 -11.184 -9.902 9.677 404 HZ2 TRP 50 HZ2 TRP 50 -7.503 -13.192 8.973 405 HZ3 TRP 50 HZ3 TRP 50 -11.660 -12.284 9.289 406 HH2 TRP 50 HH2 TRP 50 -9.857 -13.894 8.945 407 H VAL 51 HN VAL 51 -9.060 -4.958 11.751 408 HA VAL 51 HA VAL 51 -11.267 -3.690 10.727 409 HB VAL 51 HB VAL 51 -10.621 -3.761 13.138 410 HG11 VAL 51 HG11 VAL 51 -9.090 -2.325 14.098 411 HG12 VAL 51 HG12 VAL 51 -9.061 -1.263 12.691 412 HG13 VAL 51 HG13 VAL 51 -8.277 -2.841 12.620 413 HG21 VAL 51 HG21 VAL 51 -11.151 -0.946 12.909 414 HG22 VAL 51 HG22 VAL 51 -12.217 -2.244 13.450 415 HG23 VAL 51 HG23 VAL 51 -12.098 -1.860 11.733 416 H ASP 52 HN ASP 52 -8.113 -2.346 11.185 417 HA ASP 52 HA ASP 52 -8.448 -0.707 8.825 418 HB2 ASP 52 HB2 ASP 52 -9.420 0.538 10.692 419 HB3 ASP 52 HB1 ASP 52 -7.886 0.444 11.529 420 H ASN 53 HN ASN 53 -6.425 -2.328 10.966 421 HA ASN 53 HA ASN 53 -4.068 -0.931 10.068 422 HB2 ASN 53 HB2 ASN 53 -4.280 -3.306 11.901 423 HB3 ASN 53 HB1 ASN 53 -2.810 -2.422 11.557 424 HD21 ASN 53 HD21 ASN 53 -5.370 -0.246 11.698 425 HD22 ASN 53 HD22 ASN 53 -5.230 0.224 13.346 426 H GLY 54 HN GLY 54 -5.904 -3.453 9.071 427 HA2 GLY 54 HA2 GLY 54 -3.826 -4.847 7.755 428 HA3 GLY 54 HA1 GLY 54 -5.563 -5.069 7.595 429 H ILE 55 HN ILE 55 -3.393 -4.637 5.628 430 HA ILE 55 HA ILE 55 -4.010 -2.098 4.474 431 HB ILE 55 HB ILE 55 -1.932 -2.452 3.732 432 HG12 ILE 55 HG12 ILE 55 -1.925 -4.038 1.629 433 HG13 ILE 55 HG11 ILE 55 -3.651 -3.784 1.789 434 HG21 ILE 55 HG21 ILE 55 -1.507 -4.319 5.046 435 HG22 ILE 55 HG22 ILE 55 -0.849 -4.557 3.430 436 HG23 ILE 55 HG23 ILE 55 -2.355 -5.341 3.901 437 HD11 ILE 55 HD11 ILE 55 -2.912 -2.125 0.357 438 HD12 ILE 55 HD12 ILE 55 -1.539 -1.742 1.400 439 HD13 ILE 55 HD13 ILE 55 -3.176 -1.345 1.913 440 H ALA 56 HN ALA 56 -5.773 -1.709 3.238 441 HA ALA 56 HA ALA 56 -7.240 -3.878 2.155 442 HB1 ALA 56 HB1 ALA 56 -8.694 -2.141 2.577 443 HB2 ALA 56 HB2 ALA 56 -8.376 -1.876 0.863 444 HB3 ALA 56 HB3 ALA 56 -7.529 -0.916 2.076 445 H ALA 57 HN ALA 57 -5.819 -4.993 1.003 446 HA ALA 57 HA ALA 57 -3.935 -4.325 -0.656 447 HB1 ALA 57 HB1 ALA 57 -5.070 -6.629 -0.187 448 HB2 ALA 57 HB2 ALA 57 -4.016 -6.395 -1.581 449 HB3 ALA 57 HB3 ALA 57 -5.769 -6.349 -1.782 450 H ASP 58 HN ASP 58 -7.298 -3.926 -1.495 451 HA ASP 58 HA ASP 58 -7.091 -3.502 -4.219 452 HB2 ASP 58 HB2 ASP 58 -9.208 -3.635 -2.866 453 HB3 ASP 58 HB1 ASP 58 -8.905 -1.966 -2.443 454 H ASP 59 HN ASP 59 -6.360 -1.416 -1.558 455 HA ASP 59 HA ASP 59 -6.057 0.991 -2.975 456 HB2 ASP 59 HB2 ASP 59 -4.633 0.195 -0.442 457 HB3 ASP 59 HB1 ASP 59 -5.129 1.788 -0.952 458 H VAL 60 HN VAL 60 -3.918 -1.750 -2.381 459 HA VAL 60 HA VAL 60 -1.691 -0.246 -3.445 460 HB VAL 60 HB VAL 60 -0.314 -2.028 -2.704 461 HG11 VAL 60 HG11 VAL 60 -0.797 -1.810 -0.270 462 HG12 VAL 60 HG12 VAL 60 -2.268 -0.949 -0.734 463 HG13 VAL 60 HG13 VAL 60 -0.694 -0.300 -1.170 464 HG21 VAL 60 HG21 VAL 60 -2.156 -3.502 -1.133 465 HG22 VAL 60 HG22 VAL 60 -1.064 -4.073 -2.400 466 HG23 VAL 60 HG23 VAL 60 -2.669 -3.482 -2.813 467 H ILE 61 HN ILE 61 -0.126 -1.974 -4.619 468 HA ILE 61 HA ILE 61 -1.667 -3.315 -6.658 469 HB ILE 61 HB ILE 61 0.260 -2.162 -8.118 470 HG12 ILE 61 HG12 ILE 61 -0.742 0.098 -6.602 471 HG13 ILE 61 HG11 ILE 61 0.439 -0.842 -5.765 472 HG21 ILE 61 HG21 ILE 61 -1.531 -1.038 -9.063 473 HG22 ILE 61 HG22 ILE 61 -2.194 -0.656 -7.462 474 HG23 ILE 61 HG23 ILE 61 -2.366 -2.296 -8.132 475 HD11 ILE 61 HD11 ILE 61 2.117 -0.212 -7.093 476 HD12 ILE 61 HD12 ILE 61 1.067 1.193 -7.293 477 HD13 ILE 61 HD13 ILE 61 1.080 -0.083 -8.512 478 H GLU 62 HN GLU 62 -0.984 -5.329 -6.541 479 HA GLU 62 HA GLU 62 1.496 -6.146 -5.536 480 HB2 GLU 62 HB2 GLU 62 0.828 -8.346 -6.296 481 HB3 GLU 62 HB1 GLU 62 -0.485 -7.549 -5.472 482 HG2 GLU 62 HG2 GLU 62 -1.796 -7.666 -7.259 483 HG3 GLU 62 HG1 GLU 62 -0.530 -7.073 -8.328 484 H VAL 63 HN VAL 63 3.411 -6.192 -6.377 485 HA VAL 63 HA VAL 63 3.639 -6.039 -9.300 486 HB VAL 63 HB VAL 63 6.035 -5.437 -8.781 487 HG11 VAL 63 HG11 VAL 63 3.673 -3.771 -8.286 488 HG12 VAL 63 HG12 VAL 63 5.033 -3.522 -9.382 489 HG13 VAL 63 HG13 VAL 63 5.200 -3.135 -7.673 490 HG21 VAL 63 HG21 VAL 63 5.124 -4.780 -6.022 491 HG22 VAL 63 HG22 VAL 63 6.761 -4.962 -6.650 492 HG23 VAL 63 HG23 VAL 63 5.752 -6.386 -6.395 493 H THR 64 HN THR 64 5.395 -7.322 -10.296 494 HA THR 64 HA THR 64 5.470 -9.975 -9.117 495 HB THR 64 HB THR 64 6.208 -10.787 -11.173 496 HG1 THR 64 HG1 THR 64 7.452 -8.323 -11.406 497 HG21 THR 64 HG21 THR 64 5.117 -9.152 -12.968 498 HG22 THR 64 HG22 THR 64 4.355 -8.523 -11.509 499 HG23 THR 64 HG23 THR 64 4.172 -10.223 -11.936 500 H SER 65 HN SER 65 7.559 -11.136 -8.971 501 HA SER 65 HA SER 65 9.259 -10.191 -7.146 502 HB2 SER 65 HB2 SER 65 9.288 -12.492 -8.069 503 HB3 SER 65 HB1 SER 65 10.159 -11.892 -9.479 504 HG SER 65 HG SER 65 11.801 -11.176 -7.986 505 H ASN 66 HN ASN 66 9.455 -9.381 -10.562 506 HA ASN 66 HA ASN 66 11.983 -8.107 -10.324 507 HB2 ASN 66 HB2 ASN 66 10.528 -9.081 -12.405 508 HB3 ASN 66 HB1 ASN 66 10.336 -7.344 -12.560 509 HD21 ASN 66 HD21 ASN 66 12.001 -6.123 -13.282 510 HD22 ASN 66 HD22 ASN 66 13.536 -6.763 -13.751 511 H GLY 67 HN GLY 67 8.931 -7.297 -9.424 512 HA2 GLY 67 HA2 GLY 67 8.307 -5.343 -8.293 513 HA3 GLY 67 HA1 GLY 67 9.619 -4.486 -9.088 514 H THR 68 HN THR 68 7.552 -6.534 -10.955 515 HA THR 68 HA THR 68 6.779 -4.355 -12.591 516 HB THR 68 HB THR 68 6.600 -7.259 -12.684 517 HG1 THR 68 HG1 THR 68 7.035 -6.847 -14.834 518 HG21 THR 68 HG21 THR 68 4.799 -7.269 -14.380 519 HG22 THR 68 HG22 THR 68 4.389 -5.630 -13.868 520 HG23 THR 68 HG23 THR 68 4.255 -6.969 -12.730 521 H ARG 69 HN ARG 69 5.218 -2.973 -12.155 522 HA ARG 69 HA ARG 69 3.277 -3.460 -10.126 523 HB2 ARG 69 HB2 ARG 69 4.118 -1.210 -11.783 524 HB3 ARG 69 HB1 ARG 69 2.388 -1.226 -11.465 525 HG2 ARG 69 HG2 ARG 69 2.702 -1.100 -9.142 526 HG3 ARG 69 HG1 ARG 69 4.411 -1.523 -9.269 527 HD2 ARG 69 HD2 ARG 69 3.463 0.920 -10.664 528 HD3 ARG 69 HD1 ARG 69 3.605 0.972 -8.911 529 HE ARG 69 HE ARG 69 5.948 0.487 -9.145 530 HH11 ARG 69 HH11 ARG 69 4.310 1.323 -12.123 531 HH12 ARG 69 HH12 ARG 69 5.768 1.773 -12.936 532 HH21 ARG 69 HH21 ARG 69 7.857 1.076 -10.226 533 HH22 ARG 69 HH22 ARG 69 7.779 1.633 -11.864 534 H THR 70 HN THR 70 1.155 -3.886 -10.218 535 HA THR 70 HA THR 70 -0.642 -5.055 -11.001 536 HB THR 70 HB THR 70 -1.293 -2.754 -11.374 537 HG1 THR 70 HG1 THR 70 -2.414 -4.740 -12.455 538 HG21 THR 70 HG21 THR 70 0.067 -1.612 -12.762 539 HG22 THR 70 HG22 THR 70 -1.162 -2.082 -13.937 540 HG23 THR 70 HG23 THR 70 0.341 -2.993 -13.822 541 H SER 71 HN SER 71 0.556 -6.930 -11.651 542 HA SER 71 HA SER 71 1.094 -7.217 -14.505 543 HB2 SER 71 HB2 SER 71 2.694 -8.078 -12.756 544 HB3 SER 71 HB1 SER 71 1.472 -9.269 -12.314 545 HG SER 71 HG SER 71 3.258 -9.419 -14.255 546 H ASP 72 HN ASP 72 -0.861 -8.740 -11.966 547 HA ASP 72 HA ASP 72 -2.393 -10.199 -13.991 548 HB2 ASP 72 HB2 ASP 72 -3.444 -11.295 -11.979 549 HB3 ASP 72 HB1 ASP 72 -1.713 -11.561 -12.157 550 H GLN 73 HN GLN 73 -2.590 -7.329 -12.180 551 HA GLN 73 HA GLN 73 -4.189 -5.709 -12.075 552 HB2 GLN 73 HB2 GLN 73 -5.107 -7.389 -14.261 553 HB3 GLN 73 HB1 GLN 73 -6.457 -6.689 -13.379 554 HG2 GLN 73 HG2 GLN 73 -5.999 -4.593 -14.069 555 HG3 GLN 73 HG1 GLN 73 -4.255 -4.853 -14.062 556 HE21 GLN 73 HE21 GLN 73 -6.094 -3.671 -16.074 557 HE22 GLN 73 HE22 GLN 73 -5.780 -4.540 -17.535 558 H VAL 74 HN VAL 74 -4.214 -8.478 -10.535 559 HA VAL 74 HA VAL 74 -6.461 -7.736 -8.847 560 HB VAL 74 HB VAL 74 -7.438 -9.331 -10.440 561 HG11 VAL 74 HG11 VAL 74 -5.658 -11.468 -9.332 562 HG12 VAL 74 HG12 VAL 74 -5.192 -10.535 -10.755 563 HG13 VAL 74 HG13 VAL 74 -6.668 -11.501 -10.777 564 HG21 VAL 74 HG21 VAL 74 -8.574 -10.624 -8.860 565 HG22 VAL 74 HG22 VAL 74 -8.025 -9.221 -7.944 566 HG23 VAL 74 HG23 VAL 74 -7.161 -10.752 -7.814 567 H LEU 75 HN LEU 75 -5.435 -7.483 -6.955 568 HA LEU 75 HA LEU 75 -3.021 -8.674 -6.245 569 HB2 LEU 75 HB2 LEU 75 -4.826 -6.863 -5.085 570 HB3 LEU 75 HB1 LEU 75 -4.503 -8.083 -3.880 571 HG LEU 75 HG LEU 75 -2.167 -6.940 -5.300 572 HD11 LEU 75 HD11 LEU 75 -3.187 -5.391 -2.990 573 HD12 LEU 75 HD12 LEU 75 -3.915 -5.098 -4.568 574 HD13 LEU 75 HD13 LEU 75 -2.179 -4.880 -4.344 575 HD21 LEU 75 HD21 LEU 75 -1.032 -7.498 -3.381 576 HD22 LEU 75 HD22 LEU 75 -2.306 -8.718 -3.380 577 HD23 LEU 75 HD23 LEU 75 -2.450 -7.291 -2.353 578 H GLN 76 HN GLN 76 -2.436 -10.287 -4.962 579 HA GLN 76 HA GLN 76 -4.323 -12.098 -3.751 580 HB2 GLN 76 HB2 GLN 76 -2.351 -13.198 -5.758 581 HB3 GLN 76 HB1 GLN 76 -3.615 -14.072 -4.910 582 HG2 GLN 76 HG2 GLN 76 -4.712 -11.917 -6.485 583 HG3 GLN 76 HG1 GLN 76 -3.734 -12.999 -7.465 584 HE21 GLN 76 HE21 GLN 76 -5.947 -13.428 -4.722 585 HE22 GLN 76 HE22 GLN 76 -6.923 -14.633 -5.482 586 H LYS 77 HN LYS 77 -3.441 -12.932 -1.944 587 HA LYS 77 HA LYS 77 -0.809 -12.092 -1.203 588 HB2 LYS 77 HB2 LYS 77 -1.222 -12.884 0.959 589 HB3 LYS 77 HB1 LYS 77 -2.697 -12.120 0.390 590 HG2 LYS 77 HG2 LYS 77 -3.749 -13.954 1.065 591 HG3 LYS 77 HG1 LYS 77 -3.038 -14.738 -0.347 592 HD2 LYS 77 HD2 LYS 77 -1.019 -14.826 1.537 593 HD3 LYS 77 HD1 LYS 77 -2.480 -15.116 2.483 594 HE2 LYS 77 HE2 LYS 77 -2.828 -16.665 0.218 595 HE3 LYS 77 HE1 LYS 77 -1.115 -16.838 0.592 596 HZ1 LYS 77 HZ1 LYS 77 -2.009 -17.226 2.984 597 HZ2 LYS 77 HZ2 LYS 77 -2.038 -18.490 1.861 598 HZ3 LYS 77 HZ3 LYS 77 -3.451 -17.621 2.191 599 H GLY 78 HN GLY 78 0.893 -13.315 -0.453 600 HA2 GLY 78 HA2 GLY 78 1.794 -15.573 -0.075 601 HA3 GLY 78 HA1 GLY 78 0.942 -16.060 -1.537 602 H GLY 79 HN GLY 79 2.331 -12.900 -1.554 603 HA2 GLY 79 HA2 GLY 79 4.822 -13.897 -2.709 604 HA3 GLY 79 HA1 GLY 79 3.735 -13.097 -3.826 605 H TYR 80 HN TYR 80 3.809 -10.988 -4.002 606 HA TYR 80 HA TYR 80 4.919 -9.292 -1.948 607 HB2 TYR 80 HB2 TYR 80 6.298 -8.410 -4.187 608 HB3 TYR 80 HB1 TYR 80 6.992 -9.287 -2.830 609 HD1 TYR 80 HD1 TYR 80 5.116 -10.031 -5.982 610 HD2 TYR 80 HD2 TYR 80 8.255 -11.147 -3.336 611 HE1 TYR 80 HE1 TYR 80 5.719 -11.879 -7.487 612 HE2 TYR 80 HE2 TYR 80 8.869 -12.997 -4.834 613 HH TYR 80 HH TYR 80 8.548 -13.903 -6.885 614 H PHE 81 HN PHE 81 4.659 -6.987 -2.504 615 HA PHE 81 HA PHE 81 3.074 -6.388 -4.822 616 HB2 PHE 81 HB2 PHE 81 1.267 -5.232 -3.534 617 HB3 PHE 81 HB1 PHE 81 1.231 -6.984 -3.449 618 HD1 PHE 81 HD2 PHE 81 2.769 -7.896 -1.417 619 HD2 PHE 81 HD1 PHE 81 0.795 -4.110 -1.601 620 HE1 PHE 81 HE2 PHE 81 2.688 -7.800 1.052 621 HE2 PHE 81 HE1 PHE 81 0.716 -4.013 0.824 622 HZ PHE 81 HZ PHE 81 1.664 -5.857 2.176 623 H VAL 82 HN VAL 82 2.379 -4.053 -4.740 624 HA VAL 82 HA VAL 82 4.370 -2.449 -3.324 625 HB VAL 82 HB VAL 82 4.136 -2.840 -6.233 626 HG11 VAL 82 HG11 VAL 82 4.170 -0.704 -7.002 627 HG12 VAL 82 HG12 VAL 82 5.033 -0.096 -5.592 628 HG13 VAL 82 HG13 VAL 82 3.294 -0.360 -5.514 629 HG21 VAL 82 HG21 VAL 82 6.477 -2.296 -6.192 630 HG22 VAL 82 HG22 VAL 82 6.120 -3.386 -4.853 631 HG23 VAL 82 HG23 VAL 82 6.344 -1.664 -4.552 632 H ILE 83 HN ILE 83 3.376 -0.834 -2.318 633 HA ILE 83 HA ILE 83 0.576 -0.443 -2.667 634 HB ILE 83 HB ILE 83 2.614 1.058 -1.109 635 HG12 ILE 83 HG12 ILE 83 2.128 -0.226 0.705 636 HG13 ILE 83 HG11 ILE 83 0.440 -0.385 0.258 637 HG21 ILE 83 HG21 ILE 83 0.466 1.902 0.106 638 HG22 ILE 83 HG22 ILE 83 -0.277 1.578 -1.459 639 HG23 ILE 83 HG23 ILE 83 1.067 2.713 -1.338 640 HD11 ILE 83 HD11 ILE 83 0.989 -2.130 -1.306 641 HD12 ILE 83 HD12 ILE 83 1.660 -2.510 0.277 642 HD13 ILE 83 HD13 ILE 83 2.706 -1.902 -0.996 643 H ASN 84 HN ASN 84 -0.209 0.607 -4.350 644 HA ASN 84 HA ASN 84 1.185 2.309 -6.005 645 HB2 ASN 84 HB2 ASN 84 -1.426 1.346 -5.802 646 HB3 ASN 84 HB1 ASN 84 -1.585 3.088 -5.774 647 HD21 ASN 84 HD21 ASN 84 0.410 3.891 -7.419 648 HD22 ASN 84 HD22 ASN 84 0.101 3.331 -9.018 649 HA PRO 85 HA PRO 85 1.638 5.752 -3.070 650 HB2 PRO 85 HB2 PRO 85 3.135 7.317 -4.641 651 HB3 PRO 85 HB1 PRO 85 3.816 5.843 -3.926 652 HG2 PRO 85 HG2 PRO 85 2.552 6.177 -6.642 653 HG3 PRO 85 HG1 PRO 85 4.156 5.566 -6.260 654 HD2 PRO 85 HD2 PRO 85 2.212 3.849 -6.674 655 HD3 PRO 85 HD1 PRO 85 3.322 3.586 -5.307 656 H ASN 86 HN ASN 86 0.626 5.836 -6.323 657 HA ASN 86 HA ASN 86 -0.420 8.450 -6.233 658 HB2 ASN 86 HB2 ASN 86 -0.236 6.304 -8.214 659 HB3 ASN 86 HB1 ASN 86 -1.711 7.247 -8.338 660 HD21 ASN 86 HD21 ASN 86 1.722 7.876 -7.719 661 HD22 ASN 86 HD22 ASN 86 1.862 9.181 -8.842 662 H ASN 87 HN ASN 87 -1.586 5.298 -5.490 663 HA ASN 87 HA ASN 87 -4.357 6.053 -5.257 664 HB2 ASN 87 HB2 ASN 87 -2.776 3.725 -5.267 665 HB3 ASN 87 HB1 ASN 87 -3.652 3.817 -3.752 666 HD21 ASN 87 HD21 ASN 87 -4.042 1.835 -5.465 667 HD22 ASN 87 HD22 ASN 87 -5.623 1.923 -6.162 668 H VAL 88 HN VAL 88 -1.565 6.638 -3.659 669 HA VAL 88 HA VAL 88 -2.559 6.445 -1.028 670 HB VAL 88 HB VAL 88 0.102 6.990 -2.261 671 HG11 VAL 88 HG11 VAL 88 -0.990 7.627 0.408 672 HG12 VAL 88 HG12 VAL 88 0.336 8.379 -0.483 673 HG13 VAL 88 HG13 VAL 88 0.607 6.865 0.384 674 HG21 VAL 88 HG21 VAL 88 0.351 4.811 -1.926 675 HG22 VAL 88 HG22 VAL 88 -1.352 4.754 -1.436 676 HG23 VAL 88 HG23 VAL 88 -0.091 4.985 -0.212 677 H LYS 89 HN LYS 89 -3.072 7.953 0.074 678 HA LYS 89 HA LYS 89 -3.284 10.641 -0.907 679 HB2 LYS 89 HB2 LYS 89 -4.115 9.484 1.712 680 HB3 LYS 89 HB1 LYS 89 -4.547 11.070 1.122 681 HG2 LYS 89 HG2 LYS 89 -6.303 9.287 1.005 682 HG3 LYS 89 HG1 LYS 89 -6.008 10.192 -0.473 683 HD2 LYS 89 HD2 LYS 89 -4.665 7.572 0.038 684 HD3 LYS 89 HD1 LYS 89 -6.318 7.640 -0.572 685 HE2 LYS 89 HE2 LYS 89 -4.420 9.354 -1.989 686 HE3 LYS 89 HE1 LYS 89 -4.068 7.629 -2.081 687 HZ1 LYS 89 HZ1 LYS 89 -5.772 8.923 -3.703 688 HZ2 LYS 89 HZ2 LYS 89 -6.841 8.331 -2.533 689 HZ3 LYS 89 HZ3 LYS 89 -5.840 7.264 -3.383 690 H SER 90 HN SER 90 -1.861 8.786 1.626 691 HA SER 90 HA SER 90 0.536 10.226 1.811 692 HB2 SER 90 HB2 SER 90 0.274 11.953 3.255 693 HB3 SER 90 HB1 SER 90 -1.398 11.890 2.703 694 HG SER 90 HG SER 90 -1.946 10.743 4.521 695 H VAL 91 HN VAL 91 1.654 9.967 4.010 696 HA VAL 91 HA VAL 91 0.986 7.378 5.159 697 HB VAL 91 HB VAL 91 3.547 7.941 5.976 698 HG11 VAL 91 HG11 VAL 91 2.232 6.166 4.046 699 HG12 VAL 91 HG12 VAL 91 3.301 5.780 5.395 700 HG13 VAL 91 HG13 VAL 91 3.980 6.321 3.857 701 HG21 VAL 91 HG21 VAL 91 3.962 9.749 4.525 702 HG22 VAL 91 HG22 VAL 91 3.177 8.938 3.169 703 HG23 VAL 91 HG23 VAL 91 4.731 8.357 3.764 704 H GLY 92 HN GLY 92 0.109 7.564 7.099 705 HA2 GLY 92 HA2 GLY 92 0.228 10.023 8.548 706 HA3 GLY 92 HA1 GLY 92 -0.824 8.658 8.872 707 H THR 93 HN THR 93 -0.045 9.664 10.903 708 HA THR 93 HA THR 93 2.491 9.057 12.043 709 HB THR 93 HB THR 93 -0.065 10.209 12.885 710 HG1 THR 93 HG1 THR 93 1.848 11.399 12.646 711 HG21 THR 93 HG21 THR 93 1.485 8.534 14.812 712 HG22 THR 93 HG22 THR 93 -0.247 8.513 14.482 713 HG23 THR 93 HG23 THR 93 0.475 9.889 15.318 714 HA PRO 94 HA PRO 94 2.156 4.868 12.964 715 HB2 PRO 94 HB2 PRO 94 4.352 4.667 14.363 716 HB3 PRO 94 HB1 PRO 94 4.423 5.255 12.693 717 HG2 PRO 94 HG2 PRO 94 4.310 6.896 15.191 718 HG3 PRO 94 HG1 PRO 94 5.522 6.956 13.902 719 HD2 PRO 94 HD2 PRO 94 3.434 8.619 13.954 720 HD3 PRO 94 HD1 PRO 94 4.098 7.982 12.432 721 H MET 95 HN MET 95 1.876 3.419 14.629 722 HA MET 95 HA MET 95 1.456 4.354 17.343 723 HB2 MET 95 HB2 MET 95 -0.774 3.159 15.691 724 HB3 MET 95 HB1 MET 95 -0.826 3.324 17.441 725 HG2 MET 95 HG2 MET 95 -0.452 5.805 17.065 726 HG3 MET 95 HG1 MET 95 -0.799 5.489 15.367 727 HE1 MET 95 HE1 MET 95 -2.650 7.625 16.912 728 HE2 MET 95 HE2 MET 95 -2.085 6.829 18.381 729 HE3 MET 95 HE3 MET 95 -3.813 6.922 18.039 730 H LYS 96 HN LYS 96 1.933 2.781 18.822 731 HA LYS 96 HA LYS 96 2.829 0.231 17.763 732 HB2 LYS 96 HB2 LYS 96 2.839 1.173 20.637 733 HB3 LYS 96 HB1 LYS 96 3.747 -0.175 19.967 734 HG2 LYS 96 HG2 LYS 96 5.421 1.147 19.347 735 HG3 LYS 96 HG1 LYS 96 4.325 2.296 18.577 736 HD2 LYS 96 HD2 LYS 96 3.898 3.373 20.698 737 HD3 LYS 96 HD1 LYS 96 4.865 2.162 21.543 738 HE2 LYS 96 HE2 LYS 96 5.943 4.012 19.422 739 HE3 LYS 96 HE1 LYS 96 6.037 4.334 21.152 740 HZ1 LYS 96 HZ1 LYS 96 7.010 1.732 20.523 741 HZ2 LYS 96 HZ2 LYS 96 7.785 2.998 21.334 742 HZ3 LYS 96 HZ3 LYS 96 7.841 2.916 19.646 743 H GLY 97 HN GLY 97 1.652 -1.619 17.780 744 HA2 GLY 97 HA2 GLY 97 -0.150 -2.256 19.880 745 HA3 GLY 97 HA1 GLY 97 -1.041 -1.640 18.502 746 H SER 98 HN SER 98 0.128 -2.744 16.350 747 HA SER 98 HA SER 98 -0.820 -5.399 16.422 748 HB2 SER 98 HB2 SER 98 0.511 -3.658 14.433 749 HB3 SER 98 HB1 SER 98 0.685 -5.373 14.163 750 HG SER 98 HG SER 98 -1.365 -3.925 13.524 751 H GLY 99 HN GLY 99 0.545 -5.953 18.401 752 HA2 GLY 99 HA2 GLY 99 2.040 -7.815 18.782 753 HA3 GLY 99 HA1 GLY 99 3.046 -7.212 17.477 754 H GLY 100 HN GLY 100 3.416 -4.580 18.125 755 HA2 GLY 100 HA2 GLY 100 3.869 -3.678 20.605 756 HA3 GLY 100 HA1 GLY 100 5.173 -4.822 20.376 757 H LEU 101 HN LEU 101 5.007 -3.985 17.401 758 HA LEU 101 HA LEU 101 7.117 -2.113 17.440 759 HB2 LEU 101 HB2 LEU 101 5.584 -2.692 15.018 760 HB3 LEU 101 HB1 LEU 101 7.296 -2.554 15.267 761 HG LEU 101 HG LEU 101 7.069 -4.824 16.495 762 HD11 LEU 101 HD11 LEU 101 4.497 -4.748 16.274 763 HD12 LEU 101 HD12 LEU 101 5.308 -6.231 15.780 764 HD13 LEU 101 HD13 LEU 101 4.793 -5.060 14.572 765 HD21 LEU 101 HD21 LEU 101 8.009 -4.017 14.252 766 HD22 LEU 101 HD22 LEU 101 6.610 -4.875 13.593 767 HD23 LEU 101 HD23 LEU 101 7.809 -5.744 14.561 768 H SER 102 HN SER 102 6.384 -0.878 15.057 769 HA SER 102 HA SER 102 4.444 1.119 15.935 770 HB2 SER 102 HB2 SER 102 7.139 1.307 14.760 771 HB3 SER 102 HB1 SER 102 5.930 2.468 14.177 772 HG SER 102 HG SER 102 5.547 2.922 16.466 773 H TRP 103 HN TRP 103 2.717 1.082 14.760 774 HA TRP 103 HA TRP 103 2.785 0.267 11.965 775 HB2 TRP 103 HB2 TRP 103 0.635 -0.153 14.018 776 HB3 TRP 103 HB1 TRP 103 0.592 -0.671 12.363 777 HD1 TRP 103 HD1 TRP 103 3.246 -1.039 15.104 778 HE1 TRP 103 HE1 TRP 103 4.141 -3.390 15.062 779 HE3 TRP 103 HE3 TRP 103 0.239 -3.076 11.513 780 HZ2 TRP 103 HZ2 TRP 103 3.659 -5.849 13.769 781 HZ3 TRP 103 HZ3 TRP 103 0.540 -5.435 10.937 782 HH2 TRP 103 HH2 TRP 103 2.205 -6.795 12.062 783 H ALA 104 HN ALA 104 2.362 1.944 10.762 784 HA ALA 104 HA ALA 104 0.988 4.238 11.885 785 HB1 ALA 104 HB1 ALA 104 3.201 4.729 11.143 786 HB2 ALA 104 HB2 ALA 104 2.032 5.583 10.134 787 HB3 ALA 104 HB3 ALA 104 2.822 4.128 9.527 788 H GLN 105 HN GLN 105 -0.468 5.430 10.976 789 HA GLN 105 HA GLN 105 -2.362 4.082 9.376 790 HB2 GLN 105 HB2 GLN 105 -2.671 5.759 11.358 791 HB3 GLN 105 HB1 GLN 105 -2.539 6.963 10.092 792 HG2 GLN 105 HG2 GLN 105 -4.387 6.134 8.964 793 HG3 GLN 105 HG1 GLN 105 -4.408 4.671 9.935 794 HE21 GLN 105 HE21 GLN 105 -6.675 5.214 10.263 795 HE22 GLN 105 HE22 GLN 105 -7.105 6.351 11.489 796 H VAL 106 HN VAL 106 -1.834 3.982 7.148 797 HA VAL 106 HA VAL 106 -0.932 6.490 5.974 798 HB VAL 106 HB VAL 106 -0.680 3.620 5.105 799 HG11 VAL 106 HG11 VAL 106 0.687 5.262 3.297 800 HG12 VAL 106 HG12 VAL 106 -0.953 5.909 3.421 801 HG13 VAL 106 HG13 VAL 106 -0.702 4.232 2.976 802 HG21 VAL 106 HG21 VAL 106 1.208 5.844 5.827 803 HG22 VAL 106 HG22 VAL 106 1.740 4.383 4.985 804 HG23 VAL 106 HG23 VAL 106 1.024 4.257 6.597 805 H ASN 107 HN ASN 107 -2.158 7.501 4.498 806 HA ASN 107 HA ASN 107 -4.917 6.696 4.366 807 HB2 ASN 107 HB2 ASN 107 -3.398 9.190 4.106 808 HB3 ASN 107 HB1 ASN 107 -4.727 9.042 2.967 809 HD21 ASN 107 HD21 ASN 107 -6.843 8.573 3.832 810 HD22 ASN 107 HD22 ASN 107 -7.263 9.170 5.397 811 H PHE 108 HN PHE 108 -5.222 5.164 2.838 812 HA PHE 108 HA PHE 108 -4.080 5.532 0.257 813 HB2 PHE 108 HB2 PHE 108 -5.625 3.213 1.412 814 HB3 PHE 108 HB1 PHE 108 -4.986 3.294 -0.204 815 HD1 PHE 108 HD2 PHE 108 -3.613 3.876 3.208 816 HD2 PHE 108 HD1 PHE 108 -3.216 1.892 -0.530 817 HE1 PHE 108 HE2 PHE 108 -1.583 2.756 4.015 818 HE2 PHE 108 HE1 PHE 108 -1.187 0.770 0.285 819 HZ PHE 108 HZ PHE 108 -0.366 1.204 2.558 820 H THR 109 HN THR 109 -5.388 4.833 -1.476 821 HA THR 109 HA THR 109 -7.395 6.501 -2.173 822 HB THR 109 HB THR 109 -6.091 5.372 -3.752 823 HG1 THR 109 HG1 THR 109 -8.685 4.259 -4.004 824 HG21 THR 109 HG21 THR 109 -7.193 2.765 -3.658 825 HG22 THR 109 HG22 THR 109 -6.545 3.213 -2.079 826 HG23 THR 109 HG23 THR 109 -5.518 3.282 -3.497 827 H THR 110 HN THR 110 -8.001 3.074 -1.784 828 HA THR 110 HA THR 110 -10.836 3.471 -1.661 829 HB THR 110 HB THR 110 -9.788 0.793 -1.209 830 HG1 THR 110 HG1 THR 110 -9.291 2.093 -3.669 831 HG21 THR 110 HG21 THR 110 -11.873 0.465 -1.922 832 HG22 THR 110 HG22 THR 110 -11.197 0.725 -3.530 833 HG23 THR 110 HG23 THR 110 -11.965 2.060 -2.669 834 H GLY 111 HN GLY 111 -8.512 1.812 0.420 835 HA2 GLY 111 HA2 GLY 111 -10.377 1.454 2.500 836 HA3 GLY 111 HA1 GLY 111 -8.653 1.167 2.601 837 H GLY 112 HN GLY 112 -8.764 4.244 1.529 838 HA2 GLY 112 HA2 GLY 112 -8.429 6.259 2.545 839 HA3 GLY 112 HA1 GLY 112 -9.625 5.723 3.715 840 H ASN 113 HN ASN 113 -8.933 4.716 5.629 841 HA ASN 113 HA ASN 113 -6.162 5.249 6.268 842 HB2 ASN 113 HB2 ASN 113 -7.006 4.275 8.541 843 HB3 ASN 113 HB1 ASN 113 -7.506 5.889 8.077 844 HD21 ASN 113 HD21 ASN 113 -8.572 2.675 7.111 845 HD22 ASN 113 HD22 ASN 113 -10.232 2.886 7.554 846 H VAL 114 HN VAL 114 -4.638 3.754 6.331 847 HA VAL 114 HA VAL 114 -5.321 0.936 6.533 848 HB VAL 114 HB VAL 114 -3.459 1.832 4.374 849 HG11 VAL 114 HG11 VAL 114 -3.761 -0.409 3.523 850 HG12 VAL 114 HG12 VAL 114 -4.955 -0.728 4.785 851 HG13 VAL 114 HG13 VAL 114 -3.267 -0.450 5.220 852 HG21 VAL 114 HG21 VAL 114 -6.418 1.628 4.281 853 HG22 VAL 114 HG22 VAL 114 -5.501 1.069 2.884 854 HG23 VAL 114 HG23 VAL 114 -5.343 2.737 3.432 855 H TRP 115 HN TRP 115 -4.017 0.220 8.091 856 HA TRP 115 HA TRP 115 -1.655 1.791 8.648 857 HB2 TRP 115 HB2 TRP 115 -3.009 -0.333 10.249 858 HB3 TRP 115 HB1 TRP 115 -1.554 0.499 10.757 859 HD1 TRP 115 HD1 TRP 115 -5.132 1.369 9.665 860 HE1 TRP 115 HE1 TRP 115 -5.845 3.361 11.052 861 HE3 TRP 115 HE3 TRP 115 -0.791 2.230 12.138 862 HZ2 TRP 115 HZ2 TRP 115 -4.737 5.122 12.867 863 HZ3 TRP 115 HZ3 TRP 115 -0.688 4.139 13.716 864 HH2 TRP 115 HH2 TRP 115 -2.645 5.563 14.078 865 H LEU 116 HN LEU 116 0.331 0.909 9.180 866 HA LEU 116 HA LEU 116 0.962 -1.758 8.255 867 HB2 LEU 116 HB2 LEU 116 1.157 0.412 6.513 868 HB3 LEU 116 HB1 LEU 116 2.796 0.172 7.108 869 HG LEU 116 HG LEU 116 1.964 -2.396 6.467 870 HD11 LEU 116 HD11 LEU 116 0.051 -0.911 5.321 871 HD12 LEU 116 HD12 LEU 116 0.628 -2.437 4.652 872 HD13 LEU 116 HD13 LEU 116 1.246 -0.909 4.024 873 HD21 LEU 116 HD21 LEU 116 3.860 -2.339 5.304 874 HD22 LEU 116 HD22 LEU 116 3.994 -0.648 5.779 875 HD23 LEU 116 HD23 LEU 116 3.258 -1.071 4.239 876 H ASN 117 HN ASN 117 2.866 -2.494 9.234 877 HA ASN 117 HA ASN 117 3.668 -0.950 11.450 878 HB2 ASN 117 HB2 ASN 117 4.085 -2.942 12.033 879 HB3 ASN 117 HB1 ASN 117 4.431 -3.534 10.427 880 HD21 ASN 117 HD21 ASN 117 5.647 -2.507 13.407 881 HD22 ASN 117 HD22 ASN 117 7.333 -2.637 13.058 882 H THR 118 HN THR 118 4.234 0.655 11.140 883 HA THR 118 HA THR 118 5.710 1.764 9.007 884 HB THR 118 HB THR 118 3.807 2.705 10.301 885 HG1 THR 118 HG1 THR 118 4.949 4.891 10.354 886 HG21 THR 118 HG21 THR 118 3.955 3.398 12.407 887 HG22 THR 118 HG22 THR 118 5.603 4.000 12.201 888 HG23 THR 118 HG23 THR 118 5.319 2.286 12.487 889 H THR 119 HN THR 119 7.032 -0.056 11.195 890 HA THR 119 HA THR 119 8.975 1.571 12.413 891 HB THR 119 HB THR 119 10.281 -0.729 12.240 892 HG1 THR 119 HG1 THR 119 9.071 -1.895 10.916 893 HG21 THR 119 HG21 THR 119 9.216 0.283 14.286 894 HG22 THR 119 HG22 THR 119 9.298 -1.479 14.237 895 HG23 THR 119 HG23 THR 119 7.783 -0.656 13.874 896 H SER 120 HN SER 120 8.546 1.987 9.399 897 HA SER 120 HA SER 120 11.106 2.754 8.726 898 HB2 SER 120 HB2 SER 120 10.179 0.107 7.649 899 HB3 SER 120 HB1 SER 120 11.146 1.173 6.630 900 HG SER 120 HG SER 120 12.768 0.311 7.645 901 H LYS 121 HN LYS 121 10.638 4.489 7.532 902 HA LYS 121 HA LYS 121 8.026 4.981 6.560 903 HB2 LYS 121 HB2 LYS 121 9.520 6.704 7.418 904 HB3 LYS 121 HB1 LYS 121 10.608 6.453 6.061 905 HG2 LYS 121 HG2 LYS 121 9.461 7.902 4.834 906 HG3 LYS 121 HG1 LYS 121 7.993 6.945 5.042 907 HD2 LYS 121 HD2 LYS 121 9.015 9.017 6.982 908 HD3 LYS 121 HD1 LYS 121 7.720 9.270 5.811 909 HE2 LYS 121 HE2 LYS 121 7.158 6.910 7.313 910 HE3 LYS 121 HE1 LYS 121 7.544 8.217 8.432 911 HZ1 LYS 121 HZ1 LYS 121 5.801 9.511 7.641 912 HZ2 LYS 121 HZ2 LYS 121 5.137 7.956 7.692 913 HZ3 LYS 121 HZ3 LYS 121 5.633 8.613 6.215 914 H ASP 122 HN ASP 122 11.105 4.077 5.113 915 HA ASP 122 HA ASP 122 10.182 4.099 2.440 916 HB2 ASP 122 HB2 ASP 122 12.459 2.709 3.818 917 HB3 ASP 122 HB1 ASP 122 12.144 2.530 2.096 918 H ASN 123 HN ASN 123 9.228 2.351 5.091 919 HA ASN 123 HA ASN 123 9.005 -0.256 4.116 920 HB2 ASN 123 HB2 ASN 123 8.672 -0.003 6.478 921 HB3 ASN 123 HB1 ASN 123 7.571 1.341 6.217 922 HD21 ASN 123 HD21 ASN 123 7.458 -1.489 4.289 923 HD22 ASN 123 HD22 ASN 123 5.918 -1.958 4.801 924 H LEU 124 HN LEU 124 6.545 2.197 4.325 925 HA LEU 124 HA LEU 124 4.729 0.783 2.717 926 HB2 LEU 124 HB2 LEU 124 4.530 3.693 2.585 927 HB3 LEU 124 HB1 LEU 124 3.309 2.509 3.002 928 HG LEU 124 HG LEU 124 3.686 3.925 4.862 929 HD11 LEU 124 HD11 LEU 124 4.728 1.114 5.063 930 HD12 LEU 124 HD12 LEU 124 3.230 1.802 5.695 931 HD13 LEU 124 HD13 LEU 124 4.765 2.163 6.483 932 HD21 LEU 124 HD21 LEU 124 6.444 3.685 3.990 933 HD22 LEU 124 HD22 LEU 124 6.272 3.457 5.737 934 HD23 LEU 124 HD23 LEU 124 5.675 4.936 4.982 935 H LEU 125 HN LEU 125 6.711 3.588 2.053 936 HA LEU 125 HA LEU 125 6.218 3.752 -0.667 937 HB2 LEU 125 HB2 LEU 125 8.581 4.555 1.004 938 HB3 LEU 125 HB1 LEU 125 8.418 4.964 -0.674 939 HG LEU 125 HG LEU 125 6.190 6.072 0.015 940 HD11 LEU 125 HD11 LEU 125 5.636 5.829 2.150 941 HD12 LEU 125 HD12 LEU 125 7.040 6.805 2.589 942 HD13 LEU 125 HD13 LEU 125 7.181 5.045 2.493 943 HD21 LEU 125 HD21 LEU 125 7.352 7.950 -0.279 944 HD22 LEU 125 HD22 LEU 125 8.835 7.001 -0.170 945 HD23 LEU 125 HD23 LEU 125 8.158 7.750 1.277 946 H TYR 126 HN TYR 126 8.828 2.073 1.085 947 HA TYR 126 HA TYR 126 9.616 0.905 -1.509 948 HB2 TYR 126 HB2 TYR 126 11.101 2.057 0.707 949 HB3 TYR 126 HB1 TYR 126 11.708 0.481 0.236 950 HD1 TYR 126 HD2 TYR 126 10.421 3.517 -1.508 951 HD2 TYR 126 HD1 TYR 126 13.487 0.587 -1.238 952 HE1 TYR 126 HE2 TYR 126 11.590 4.576 -3.398 953 HE2 TYR 126 HE1 TYR 126 14.667 1.631 -3.125 954 HH TYR 126 HH TYR 126 14.758 3.961 -4.175 955 H GLY 127 HN GLY 127 8.813 0.204 1.839 956 HA2 GLY 127 HA2 GLY 127 7.800 -1.952 2.360 957 HA3 GLY 127 HA1 GLY 127 8.706 -2.660 1.033 958 H LYS 128 HN LYS 128 10.222 -0.432 3.180 959 HA LYS 128 HA LYS 128 12.170 -2.335 3.939 960 HB2 LYS 128 HB2 LYS 128 11.601 0.469 4.861 961 HB3 LYS 128 HB1 LYS 128 13.031 -0.447 5.271 962 HG2 LYS 128 HG2 LYS 128 13.314 -0.655 2.703 963 HG3 LYS 128 HG1 LYS 128 12.236 0.746 2.675 964 HD2 LYS 128 HD2 LYS 128 13.765 2.049 3.968 965 HD3 LYS 128 HD1 LYS 128 14.723 0.627 4.378 966 HE2 LYS 128 HE2 LYS 128 15.371 0.389 2.020 967 HE3 LYS 128 HE1 LYS 128 14.451 1.843 1.632 968 HZ1 LYS 128 HZ1 LYS 128 16.974 1.583 3.120 969 HZ2 LYS 128 HZ2 LYS 128 15.954 2.892 3.448 970 HZ3 LYS 128 HZ3 LYS 128 16.563 2.666 1.887 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 16.547 38.251 -14.209 2 H2 MET 1 HT2 MET 1 16.416 37.154 -12.896 3 H3 MET 1 HT3 MET 1 16.171 36.606 -14.503 4 HA MET 1 HA MET 1 18.496 37.342 -14.951 5 HB2 MET 1 HB2 MET 1 18.432 37.362 -11.928 6 HB3 MET 1 HB1 MET 1 19.910 37.358 -12.881 7 HG2 MET 1 HG2 MET 1 18.989 39.474 -13.977 8 HG3 MET 1 HG1 MET 1 17.843 39.511 -12.639 9 HE1 MET 1 HE1 MET 1 22.392 40.118 -12.382 10 HE2 MET 1 HE2 MET 1 21.415 40.466 -13.809 11 HE3 MET 1 HE3 MET 1 21.625 38.801 -13.269 12 H ARG 2 HN ARG 2 17.234 35.177 -15.564 13 HA ARG 2 HA ARG 2 17.644 32.875 -14.002 14 HB2 ARG 2 HB2 ARG 2 16.766 33.490 -16.724 15 HB3 ARG 2 HB1 ARG 2 17.616 31.957 -16.603 16 HG2 ARG 2 HG2 ARG 2 15.868 31.940 -14.450 17 HG3 ARG 2 HG1 ARG 2 14.942 32.661 -15.767 18 HD2 ARG 2 HD2 ARG 2 16.390 30.015 -15.813 19 HD3 ARG 2 HD1 ARG 2 14.645 30.260 -15.765 20 HE ARG 2 HE ARG 2 15.961 31.471 -18.027 21 HH11 ARG 2 HH11 ARG 2 14.412 28.596 -16.791 22 HH12 ARG 2 HH12 ARG 2 14.006 27.989 -18.361 23 HH21 ARG 2 HH21 ARG 2 15.429 30.671 -20.092 24 HH22 ARG 2 HH22 ARG 2 14.586 29.165 -20.234 25 H GLY 3 HN GLY 3 19.030 31.006 -14.671 26 HA2 GLY 3 HA2 GLY 3 21.711 31.996 -15.425 27 HA3 GLY 3 HA1 GLY 3 21.431 30.695 -14.277 28 H SER 4 HN SER 4 22.686 31.146 -17.143 29 HA SER 4 HA SER 4 21.415 28.837 -18.433 30 HB2 SER 4 HB2 SER 4 22.538 31.311 -19.421 31 HB3 SER 4 HB1 SER 4 23.320 29.930 -20.189 32 HG SER 4 HG SER 4 21.085 29.156 -20.540 33 H HIS 5 HN HIS 5 23.321 28.685 -16.171 34 HA HIS 5 HA HIS 5 25.713 27.560 -17.389 35 HB2 HIS 5 HB2 HIS 5 25.771 29.004 -15.307 36 HB3 HIS 5 HB1 HIS 5 25.032 27.655 -14.450 37 HD1 HIS 5 HD1 HIS 5 27.768 27.291 -17.025 38 HD2 HIS 5 HD2 HIS 5 27.210 26.961 -12.921 39 HE1 HIS 5 HE1 HIS 5 29.890 26.277 -16.138 40 HE2 HIS 5 HE2 HIS 5 29.498 26.011 -13.663 41 H HIS 6 HN HIS 6 23.224 26.462 -15.076 42 HA HIS 6 HA HIS 6 23.453 23.777 -16.234 43 HB2 HIS 6 HB2 HIS 6 23.244 22.868 -13.858 44 HB3 HIS 6 HB1 HIS 6 24.807 23.539 -14.312 45 HD1 HIS 6 HD1 HIS 6 21.795 24.267 -12.184 46 HD2 HIS 6 HD2 HIS 6 25.613 25.762 -12.863 47 HE1 HIS 6 HE1 HIS 6 22.196 25.944 -10.354 48 HE2 HIS 6 HE2 HIS 6 24.526 26.812 -10.764 49 H HIS 7 HN HIS 7 21.525 23.107 -16.859 50 HA HIS 7 HA HIS 7 19.133 24.270 -15.624 51 HB2 HIS 7 HB2 HIS 7 19.713 23.024 -18.286 52 HB3 HIS 7 HB1 HIS 7 18.062 23.013 -17.674 53 HD1 HIS 7 HD1 HIS 7 19.470 26.039 -16.470 54 HD2 HIS 7 HD2 HIS 7 18.036 24.767 -20.157 55 HE1 HIS 7 HE1 HIS 7 18.973 28.141 -17.759 56 HE2 HIS 7 HE2 HIS 7 18.044 27.346 -19.962 57 H HIS 8 HN HIS 8 17.674 23.058 -14.521 58 HA HIS 8 HA HIS 8 17.774 20.163 -14.684 59 HB2 HIS 8 HB2 HIS 8 19.227 21.452 -12.683 60 HB3 HIS 8 HB1 HIS 8 17.750 20.925 -11.882 61 HD1 HIS 8 HD1 HIS 8 17.447 18.271 -13.601 62 HD2 HIS 8 HD2 HIS 8 20.855 19.510 -11.573 63 HE1 HIS 8 HE1 HIS 8 18.777 16.178 -13.182 64 HE2 HIS 8 HE2 HIS 8 20.869 16.962 -12.017 65 H HIS 9 HN HIS 9 15.696 20.459 -15.559 66 HA HIS 9 HA HIS 9 13.630 20.717 -13.512 67 HB2 HIS 9 HB2 HIS 9 13.865 22.937 -14.670 68 HB3 HIS 9 HB1 HIS 9 13.420 22.139 -16.174 69 HD1 HIS 9 HD1 HIS 9 11.078 22.683 -16.710 70 HD2 HIS 9 HD2 HIS 9 11.630 22.135 -12.628 71 HE1 HIS 9 HE1 HIS 9 8.800 22.957 -15.681 72 HE2 HIS 9 HE2 HIS 9 9.179 22.731 -13.200 73 H HIS 10 HN HIS 10 13.780 20.403 -17.058 74 HA HIS 10 HA HIS 10 11.783 18.330 -17.064 75 HB2 HIS 10 HB2 HIS 10 12.732 20.162 -18.918 76 HB3 HIS 10 HB1 HIS 10 13.320 18.619 -19.532 77 HD1 HIS 10 HD1 HIS 10 11.005 20.415 -20.802 78 HD2 HIS 10 HD2 HIS 10 10.505 16.987 -18.509 79 HE1 HIS 10 HE1 HIS 10 8.731 19.531 -21.405 80 HE2 HIS 10 HE2 HIS 10 8.403 17.525 -19.916 81 H GLY 11 HN GLY 11 15.182 18.384 -16.673 82 HA2 GLY 11 HA2 GLY 11 15.626 15.750 -17.810 83 HA3 GLY 11 HA1 GLY 11 16.828 16.768 -17.037 84 H SER 12 HN SER 12 13.715 15.566 -15.811 85 HA SER 12 HA SER 12 15.197 14.277 -13.617 86 HB2 SER 12 HB2 SER 12 12.975 14.521 -12.366 87 HB3 SER 12 HB1 SER 12 13.891 16.000 -12.653 88 HG SER 12 HG SER 12 12.509 16.495 -14.342 89 H GLU 13 HN GLU 13 13.559 13.593 -16.391 90 HA GLU 13 HA GLU 13 12.459 11.072 -15.341 91 HB2 GLU 13 HB2 GLU 13 11.638 12.907 -17.524 92 HB3 GLU 13 HB1 GLU 13 11.437 11.187 -17.826 93 HG2 GLU 13 HG2 GLU 13 10.339 11.315 -15.399 94 HG3 GLU 13 HG1 GLU 13 10.023 12.964 -15.940 95 HA PRO 14 HA PRO 14 16.197 9.804 -17.734 96 HB2 PRO 14 HB2 PRO 14 16.973 7.851 -16.043 97 HB3 PRO 14 HB1 PRO 14 17.373 9.550 -15.766 98 HG2 PRO 14 HG2 PRO 14 15.197 7.894 -14.546 99 HG3 PRO 14 HG1 PRO 14 16.290 9.054 -13.768 100 HD2 PRO 14 HD2 PRO 14 13.730 9.661 -14.465 101 HD3 PRO 14 HD1 PRO 14 15.034 10.865 -14.421 102 H THR 15 HN THR 15 16.725 7.703 -18.701 103 HA THR 15 HA THR 15 14.288 6.176 -19.221 104 HB THR 15 HB THR 15 16.889 5.860 -20.696 105 HG1 THR 15 HG1 THR 15 14.955 7.895 -20.953 106 HG21 THR 15 HG21 THR 15 15.748 4.726 -22.232 107 HG22 THR 15 HG22 THR 15 14.376 5.832 -22.171 108 HG23 THR 15 HG23 THR 15 14.522 4.541 -20.977 109 H THR 16 HN THR 16 16.974 5.968 -17.268 110 HA THR 16 HA THR 16 16.957 3.028 -17.296 111 HB THR 16 HB THR 16 19.005 4.767 -15.933 112 HG1 THR 16 HG1 THR 16 19.218 3.676 -18.536 113 HG21 THR 16 HG21 THR 16 20.353 2.617 -16.737 114 HG22 THR 16 HG22 THR 16 18.760 1.890 -16.528 115 HG23 THR 16 HG23 THR 16 19.537 2.713 -15.177 116 HA PRO 17 HA PRO 17 14.754 3.743 -13.409 117 HB2 PRO 17 HB2 PRO 17 13.511 1.375 -13.288 118 HB3 PRO 17 HB1 PRO 17 12.991 2.631 -14.420 119 HG2 PRO 17 HG2 PRO 17 14.656 0.197 -14.924 120 HG3 PRO 17 HG1 PRO 17 13.355 0.888 -15.910 121 HD2 PRO 17 HD2 PRO 17 16.042 1.269 -16.387 122 HD3 PRO 17 HD1 PRO 17 14.762 2.372 -16.929 123 H THR 18 HN THR 18 15.912 3.646 -11.596 124 HA THR 18 HA THR 18 16.902 1.069 -10.667 125 HB THR 18 HB THR 18 19.066 2.376 -9.959 126 HG1 THR 18 HG1 THR 18 18.177 4.358 -10.915 127 HG21 THR 18 HG21 THR 18 20.011 1.952 -12.361 128 HG22 THR 18 HG22 THR 18 18.463 1.137 -12.591 129 HG23 THR 18 HG23 THR 18 19.557 0.608 -11.313 130 H THR 19 HN THR 19 14.755 2.888 -9.894 131 HA THR 19 HA THR 19 15.036 2.785 -7.108 132 HB THR 19 HB THR 19 16.625 4.612 -7.381 133 HG1 THR 19 HG1 THR 19 15.548 6.147 -6.065 134 HG21 THR 19 HG21 THR 19 16.416 6.178 -8.918 135 HG22 THR 19 HG22 THR 19 14.954 6.765 -8.127 136 HG23 THR 19 HG23 THR 19 14.842 5.530 -9.380 137 H ASN 20 HN ASN 20 12.959 2.048 -7.035 138 HA ASN 20 HA ASN 20 10.874 3.980 -7.105 139 HB2 ASN 20 HB2 ASN 20 11.383 2.992 -9.587 140 HB3 ASN 20 HB1 ASN 20 10.177 1.842 -9.015 141 HD21 ASN 20 HD21 ASN 20 10.772 5.003 -10.154 142 HD22 ASN 20 HD22 ASN 20 9.143 5.576 -10.102 143 H LEU 21 HN LEU 21 9.439 3.447 -5.662 144 HA LEU 21 HA LEU 21 8.990 2.115 -3.724 145 HB2 LEU 21 HB2 LEU 21 7.174 1.408 -5.990 146 HB3 LEU 21 HB1 LEU 21 6.758 1.359 -4.287 147 HG LEU 21 HG LEU 21 7.709 3.965 -5.279 148 HD11 LEU 21 HD11 LEU 21 5.023 3.993 -5.973 149 HD12 LEU 21 HD12 LEU 21 5.658 2.523 -6.701 150 HD13 LEU 21 HD13 LEU 21 6.400 4.081 -7.065 151 HD21 LEU 21 HD21 LEU 21 6.941 4.015 -3.104 152 HD22 LEU 21 HD22 LEU 21 5.601 2.918 -3.440 153 HD23 LEU 21 HD23 LEU 21 5.540 4.586 -4.013 154 H LYS 22 HN LYS 22 10.406 0.493 -3.126 155 HA LYS 22 HA LYS 22 10.877 -1.866 -4.552 156 HB2 LYS 22 HB2 LYS 22 11.484 -0.816 -1.900 157 HB3 LYS 22 HB1 LYS 22 11.271 -2.552 -1.924 158 HG2 LYS 22 HG2 LYS 22 13.142 -1.038 -3.726 159 HG3 LYS 22 HG1 LYS 22 13.616 -1.858 -2.237 160 HD2 LYS 22 HD2 LYS 22 12.217 -3.791 -3.640 161 HD3 LYS 22 HD1 LYS 22 13.128 -2.944 -4.890 162 HE2 LYS 22 HE2 LYS 22 15.169 -3.524 -3.979 163 HE3 LYS 22 HE1 LYS 22 14.497 -3.768 -2.367 164 HZ1 LYS 22 HZ1 LYS 22 13.353 -5.576 -4.239 165 HZ2 LYS 22 HZ2 LYS 22 14.174 -5.906 -2.799 166 HZ3 LYS 22 HZ3 LYS 22 15.040 -5.707 -4.238 167 H ILE 23 HN ILE 23 10.355 -4.065 -3.652 168 HA ILE 23 HA ILE 23 7.571 -4.453 -3.755 169 HB ILE 23 HB ILE 23 9.945 -5.956 -4.111 170 HG12 ILE 23 HG12 ILE 23 7.433 -7.288 -4.706 171 HG13 ILE 23 HG11 ILE 23 7.462 -5.603 -5.204 172 HG21 ILE 23 HG21 ILE 23 9.660 -6.989 -1.966 173 HG22 ILE 23 HG22 ILE 23 9.210 -8.146 -3.218 174 HG23 ILE 23 HG23 ILE 23 7.961 -7.311 -2.301 175 HD11 ILE 23 HD11 ILE 23 8.190 -6.991 -7.013 176 HD12 ILE 23 HD12 ILE 23 9.440 -7.711 -6.003 177 HD13 ILE 23 HD13 ILE 23 9.532 -6.003 -6.442 178 H TYR 24 HN TYR 24 6.237 -5.601 -2.407 179 HA TYR 24 HA TYR 24 6.684 -5.319 0.486 180 HB2 TYR 24 HB2 TYR 24 4.376 -5.171 -1.316 181 HB3 TYR 24 HB1 TYR 24 4.104 -6.007 0.177 182 HD1 TYR 24 HD1 TYR 24 5.381 -2.758 -1.119 183 HD2 TYR 24 HD2 TYR 24 3.410 -4.838 2.004 184 HE1 TYR 24 HE1 TYR 24 4.869 -0.626 -0.021 185 HE2 TYR 24 HE2 TYR 24 2.899 -2.722 3.119 186 HH TYR 24 HH TYR 24 2.616 -0.360 2.473 187 H LYS 25 HN LYS 25 5.554 -7.257 1.672 188 HA LYS 25 HA LYS 25 5.952 -9.681 0.041 189 HB2 LYS 25 HB2 LYS 25 6.604 -9.137 2.899 190 HB3 LYS 25 HB1 LYS 25 6.310 -10.778 2.327 191 HG2 LYS 25 HG2 LYS 25 8.183 -9.275 0.665 192 HG3 LYS 25 HG1 LYS 25 8.736 -9.510 2.322 193 HD2 LYS 25 HD2 LYS 25 7.721 -11.741 0.570 194 HD3 LYS 25 HD1 LYS 25 9.424 -11.300 0.700 195 HE2 LYS 25 HE2 LYS 25 8.481 -11.542 3.329 196 HE3 LYS 25 HE1 LYS 25 7.821 -12.918 2.452 197 HZ1 LYS 25 HZ1 LYS 25 10.371 -12.877 1.606 198 HZ2 LYS 25 HZ2 LYS 25 9.803 -13.826 2.886 199 HZ3 LYS 25 HZ3 LYS 25 10.546 -12.340 3.202 200 H VAL 26 HN VAL 26 3.977 -10.445 -0.490 201 HA VAL 26 HA VAL 26 1.772 -9.989 1.251 202 HB VAL 26 HB VAL 26 1.195 -11.922 -0.818 203 HG11 VAL 26 HG11 VAL 26 -0.299 -10.540 0.585 204 HG12 VAL 26 HG12 VAL 26 -0.611 -10.430 -1.154 205 HG13 VAL 26 HG13 VAL 26 0.257 -9.137 -0.322 206 HG21 VAL 26 HG21 VAL 26 2.353 -11.048 -2.505 207 HG22 VAL 26 HG22 VAL 26 2.931 -9.729 -1.492 208 HG23 VAL 26 HG23 VAL 26 1.384 -9.591 -2.315 209 H ASP 27 HN ASP 27 2.504 -10.928 3.007 210 HA ASP 27 HA ASP 27 3.048 -13.738 3.174 211 HB2 ASP 27 HB2 ASP 27 3.034 -11.496 5.142 212 HB3 ASP 27 HB1 ASP 27 3.093 -13.141 5.743 213 H ASP 28 HN ASP 28 0.291 -11.709 3.661 214 HA ASP 28 HA ASP 28 -1.462 -13.914 3.682 215 HB2 ASP 28 HB2 ASP 28 -0.321 -13.899 6.042 216 HB3 ASP 28 HB1 ASP 28 -1.463 -12.600 6.365 217 H LEU 29 HN LEU 29 -3.206 -13.117 2.704 218 HA LEU 29 HA LEU 29 -4.250 -10.573 3.615 219 HB2 LEU 29 HB2 LEU 29 -3.698 -9.599 1.735 220 HB3 LEU 29 HB1 LEU 29 -3.281 -11.115 1.009 221 HG LEU 29 HG LEU 29 -6.148 -10.655 1.297 222 HD11 LEU 29 HD11 LEU 29 -6.037 -9.254 -0.849 223 HD12 LEU 29 HD12 LEU 29 -4.415 -8.846 -0.294 224 HD13 LEU 29 HD13 LEU 29 -5.816 -8.483 0.724 225 HD21 LEU 29 HD21 LEU 29 -4.813 -12.506 0.167 226 HD22 LEU 29 HD22 LEU 29 -4.669 -11.369 -1.174 227 HD23 LEU 29 HD23 LEU 29 -6.263 -11.890 -0.619 228 H GLN 30 HN GLN 30 -6.341 -10.467 3.887 229 HA GLN 30 HA GLN 30 -8.032 -12.733 3.112 230 HB2 GLN 30 HB2 GLN 30 -7.384 -11.669 5.764 231 HB3 GLN 30 HB1 GLN 30 -9.106 -11.722 5.454 232 HG2 GLN 30 HG2 GLN 30 -8.384 -13.733 6.558 233 HG3 GLN 30 HG1 GLN 30 -8.942 -14.096 4.925 234 HE21 GLN 30 HE21 GLN 30 -7.176 -13.910 3.273 235 HE22 GLN 30 HE22 GLN 30 -5.656 -14.615 3.677 236 H LYS 31 HN LYS 31 -10.343 -12.302 3.093 237 HA LYS 31 HA LYS 31 -10.889 -9.732 2.009 238 HB2 LYS 31 HB2 LYS 31 -12.174 -12.203 1.935 239 HB3 LYS 31 HB1 LYS 31 -13.250 -11.169 2.874 240 HG2 LYS 31 HG2 LYS 31 -12.314 -10.859 0.055 241 HG3 LYS 31 HG1 LYS 31 -13.944 -10.898 0.692 242 HD2 LYS 31 HD2 LYS 31 -12.595 -8.736 1.916 243 HD3 LYS 31 HD1 LYS 31 -12.312 -8.645 0.177 244 HE2 LYS 31 HE2 LYS 31 -15.045 -9.300 0.607 245 HE3 LYS 31 HE1 LYS 31 -14.640 -7.930 1.637 246 HZ1 LYS 31 HZ1 LYS 31 -15.372 -7.109 -0.460 247 HZ2 LYS 31 HZ2 LYS 31 -14.304 -8.112 -1.306 248 HZ3 LYS 31 HZ3 LYS 31 -13.704 -6.839 -0.368 249 H ILE 32 HN ILE 32 -10.611 -8.151 3.450 250 HA ILE 32 HA ILE 32 -11.602 -8.540 6.188 251 HB ILE 32 HB ILE 32 -9.188 -7.100 5.128 252 HG12 ILE 32 HG12 ILE 32 -9.762 -9.861 5.771 253 HG13 ILE 32 HG11 ILE 32 -8.420 -9.160 4.885 254 HG21 ILE 32 HG21 ILE 32 -9.640 -6.016 7.143 255 HG22 ILE 32 HG22 ILE 32 -8.371 -7.213 7.487 256 HG23 ILE 32 HG23 ILE 32 -10.058 -7.531 7.953 257 HD11 ILE 32 HD11 ILE 32 -8.297 -8.748 7.745 258 HD12 ILE 32 HD12 ILE 32 -7.072 -9.274 6.603 259 HD13 ILE 32 HD13 ILE 32 -8.230 -10.430 7.230 260 H ASN 33 HN ASN 33 -13.194 -7.258 6.772 261 HA ASN 33 HA ASN 33 -14.578 -5.486 7.016 262 HB2 ASN 33 HB2 ASN 33 -11.908 -4.285 6.592 263 HB3 ASN 33 HB1 ASN 33 -13.281 -3.212 6.349 264 HD21 ASN 33 HD21 ASN 33 -12.007 -5.589 8.635 265 HD22 ASN 33 HD22 ASN 33 -12.562 -4.780 10.056 266 H GLY 34 HN GLY 34 -14.704 -6.903 4.609 267 HA2 GLY 34 HA2 GLY 34 -15.893 -6.751 2.658 268 HA3 GLY 34 HA1 GLY 34 -16.122 -5.049 3.002 269 H ILE 35 HN ILE 35 -12.879 -5.698 3.192 270 HA ILE 35 HA ILE 35 -12.369 -5.235 0.352 271 HB ILE 35 HB ILE 35 -10.456 -3.759 1.797 272 HG12 ILE 35 HG12 ILE 35 -12.961 -2.413 2.522 273 HG13 ILE 35 HG11 ILE 35 -12.657 -3.885 3.423 274 HG21 ILE 35 HG21 ILE 35 -10.799 -2.444 0.045 275 HG22 ILE 35 HG22 ILE 35 -12.407 -2.027 0.637 276 HG23 ILE 35 HG23 ILE 35 -12.189 -3.435 -0.402 277 HD11 ILE 35 HD11 ILE 35 -10.241 -2.671 3.554 278 HD12 ILE 35 HD12 ILE 35 -11.500 -2.583 4.783 279 HD13 ILE 35 HD13 ILE 35 -11.346 -1.296 3.586 280 H TRP 36 HN TRP 36 -10.563 -6.330 -0.386 281 HA TRP 36 HA TRP 36 -9.463 -8.386 1.182 282 HB2 TRP 36 HB2 TRP 36 -8.555 -7.086 -1.395 283 HB3 TRP 36 HB1 TRP 36 -7.663 -8.411 -0.654 284 HD1 TRP 36 HD1 TRP 36 -10.305 -7.828 -3.108 285 HE1 TRP 36 HE1 TRP 36 -11.632 -9.983 -3.581 286 HE3 TRP 36 HE3 TRP 36 -8.684 -10.661 0.825 287 HZ2 TRP 36 HZ2 TRP 36 -11.952 -12.543 -2.435 288 HZ3 TRP 36 HZ3 TRP 36 -9.554 -12.951 1.071 289 HH2 TRP 36 HH2 TRP 36 -11.155 -13.871 -0.527 290 H GLN 37 HN GLN 37 -7.789 -8.379 2.650 291 HA GLN 37 HA GLN 37 -6.256 -5.875 2.852 292 HB2 GLN 37 HB2 GLN 37 -7.669 -6.095 4.734 293 HB3 GLN 37 HB1 GLN 37 -7.189 -7.763 4.990 294 HG2 GLN 37 HG2 GLN 37 -4.834 -6.332 5.128 295 HG3 GLN 37 HG1 GLN 37 -6.026 -5.322 5.917 296 HE21 GLN 37 HE21 GLN 37 -5.386 -8.828 5.854 297 HE22 GLN 37 HE22 GLN 37 -5.308 -9.000 7.591 298 H VAL 38 HN VAL 38 -4.094 -5.932 3.302 299 HA VAL 38 HA VAL 38 -2.858 -8.561 2.798 300 HB VAL 38 HB VAL 38 -1.697 -5.813 2.214 301 HG11 VAL 38 HG11 VAL 38 -0.320 -7.363 0.620 302 HG12 VAL 38 HG12 VAL 38 -0.837 -8.657 1.700 303 HG13 VAL 38 HG13 VAL 38 0.099 -7.305 2.333 304 HG21 VAL 38 HG21 VAL 38 -2.236 -7.049 -0.202 305 HG22 VAL 38 HG22 VAL 38 -3.189 -5.765 0.544 306 HG23 VAL 38 HG23 VAL 38 -3.650 -7.453 0.775 307 H ARG 39 HN ARG 39 -0.944 -9.175 3.740 308 HA ARG 39 HA ARG 39 0.115 -7.589 5.944 309 HB2 ARG 39 HB2 ARG 39 -0.910 -10.420 6.276 310 HB3 ARG 39 HB1 ARG 39 0.089 -9.579 7.437 311 HG2 ARG 39 HG2 ARG 39 -1.565 -8.239 8.125 312 HG3 ARG 39 HG1 ARG 39 -2.374 -8.222 6.567 313 HD2 ARG 39 HD2 ARG 39 -3.560 -9.427 8.457 314 HD3 ARG 39 HD1 ARG 39 -3.383 -10.309 6.943 315 HE ARG 39 HE ARG 39 -1.366 -11.349 8.112 316 HH11 ARG 39 HH11 ARG 39 -4.242 -10.296 9.800 317 HH12 ARG 39 HH12 ARG 39 -4.072 -11.461 11.067 318 HH21 ARG 39 HH21 ARG 39 -1.157 -12.888 9.779 319 HH22 ARG 39 HH22 ARG 39 -2.327 -12.931 11.055 320 H ASN 40 HN ASN 40 2.335 -7.883 6.244 321 HA ASN 40 HA ASN 40 3.556 -10.138 4.886 322 HB2 ASN 40 HB2 ASN 40 5.432 -7.950 5.044 323 HB3 ASN 40 HB1 ASN 40 5.072 -9.032 3.733 324 HD21 ASN 40 HD21 ASN 40 5.652 -6.177 3.892 325 HD22 ASN 40 HD22 ASN 40 4.431 -5.483 2.903 326 H ASN 41 HN ASN 41 5.416 -10.788 5.770 327 HA ASN 41 HA ASN 41 5.426 -10.935 8.521 328 HB2 ASN 41 HB2 ASN 41 7.816 -11.905 8.105 329 HB3 ASN 41 HB1 ASN 41 6.422 -12.751 7.450 330 HD21 ASN 41 HD21 ASN 41 7.041 -9.866 5.830 331 HD22 ASN 41 HD22 ASN 41 7.810 -10.498 4.454 332 H ILE 42 HN ILE 42 6.822 -8.491 6.490 333 HA ILE 42 HA ILE 42 8.870 -7.689 8.249 334 HB ILE 42 HB ILE 42 7.663 -6.147 5.997 335 HG12 ILE 42 HG12 ILE 42 9.949 -7.214 5.015 336 HG13 ILE 42 HG11 ILE 42 9.371 -8.530 6.026 337 HG21 ILE 42 HG21 ILE 42 9.116 -4.986 7.609 338 HG22 ILE 42 HG22 ILE 42 9.711 -4.979 5.952 339 HG23 ILE 42 HG23 ILE 42 10.418 -6.072 7.143 340 HD11 ILE 42 HD11 ILE 42 8.024 -7.237 3.705 341 HD12 ILE 42 HD12 ILE 42 7.126 -8.150 4.920 342 HD13 ILE 42 HD13 ILE 42 8.392 -8.938 3.977 343 H LEU 43 HN LEU 43 5.813 -6.394 7.116 344 HA LEU 43 HA LEU 43 5.779 -4.494 9.300 345 HB2 LEU 43 HB2 LEU 43 3.905 -4.652 6.966 346 HB3 LEU 43 HB1 LEU 43 4.048 -3.340 8.114 347 HG LEU 43 HG LEU 43 5.198 -2.433 6.411 348 HD11 LEU 43 HD11 LEU 43 6.778 -2.695 8.300 349 HD12 LEU 43 HD12 LEU 43 7.566 -2.571 6.729 350 HD13 LEU 43 HD13 LEU 43 7.410 -4.138 7.512 351 HD21 LEU 43 HD21 LEU 43 5.351 -5.163 5.487 352 HD22 LEU 43 HD22 LEU 43 6.822 -4.254 5.136 353 HD23 LEU 43 HD23 LEU 43 5.258 -3.658 4.571 354 H VAL 44 HN VAL 44 4.552 -7.535 8.440 355 HA VAL 44 HA VAL 44 2.693 -7.357 10.649 356 HB VAL 44 HB VAL 44 1.604 -8.538 8.193 357 HG11 VAL 44 HG11 VAL 44 -0.298 -8.722 9.380 358 HG12 VAL 44 HG12 VAL 44 -0.079 -7.148 10.151 359 HG13 VAL 44 HG13 VAL 44 0.782 -8.560 10.761 360 HG21 VAL 44 HG21 VAL 44 0.846 -6.574 7.321 361 HG22 VAL 44 HG22 VAL 44 2.334 -5.990 8.052 362 HG23 VAL 44 HG23 VAL 44 0.804 -5.782 8.892 363 HA PRO 45 HA PRO 45 5.234 -11.228 10.577 364 HB2 PRO 45 HB2 PRO 45 4.606 -10.495 13.395 365 HB3 PRO 45 HB1 PRO 45 6.085 -11.232 12.772 366 HG2 PRO 45 HG2 PRO 45 6.079 -8.706 13.378 367 HG3 PRO 45 HG1 PRO 45 6.756 -9.183 11.803 368 HD2 PRO 45 HD2 PRO 45 4.077 -8.007 12.439 369 HD3 PRO 45 HD1 PRO 45 5.172 -7.647 11.119 370 H THR 46 HN THR 46 2.418 -10.021 12.138 371 HA THR 46 HA THR 46 0.588 -11.871 11.325 372 HB THR 46 HB THR 46 1.982 -13.497 12.610 373 HG1 THR 46 HG1 THR 46 0.235 -14.560 13.170 374 HG21 THR 46 HG21 THR 46 2.721 -12.210 14.473 375 HG22 THR 46 HG22 THR 46 1.718 -13.533 15.067 376 HG23 THR 46 HG23 THR 46 1.061 -11.900 14.979 377 H ASP 47 HN ASP 47 -1.499 -11.568 12.246 378 HA ASP 47 HA ASP 47 -3.151 -10.513 13.448 379 HB2 ASP 47 HB2 ASP 47 -1.201 -9.107 15.113 380 HB3 ASP 47 HB1 ASP 47 -2.774 -9.732 15.565 381 H PHE 48 HN PHE 48 -2.742 -9.174 11.181 382 HA PHE 48 HA PHE 48 -2.150 -6.430 11.681 383 HB2 PHE 48 HB2 PHE 48 -2.042 -8.013 9.464 384 HB3 PHE 48 HB1 PHE 48 -3.560 -7.183 9.202 385 HD1 PHE 48 HD1 PHE 48 -1.524 -4.930 10.991 386 HD2 PHE 48 HD2 PHE 48 -2.000 -6.683 7.143 387 HE1 PHE 48 HE1 PHE 48 -0.308 -3.061 9.954 388 HE2 PHE 48 HE2 PHE 48 -0.760 -4.839 6.134 389 HZ PHE 48 HZ PHE 48 0.080 -3.022 7.533 390 H THR 49 HN THR 49 -3.711 -5.331 12.727 391 HA THR 49 HA THR 49 -6.242 -6.136 13.301 392 HB THR 49 HB THR 49 -6.059 -3.264 12.695 393 HG1 THR 49 HG1 THR 49 -4.348 -4.544 14.565 394 HG21 THR 49 HG21 THR 49 -7.878 -3.934 13.973 395 HG22 THR 49 HG22 THR 49 -6.767 -3.105 15.069 396 HG23 THR 49 HG23 THR 49 -6.864 -4.867 15.081 397 H TRP 50 HN TRP 50 -7.217 -7.128 11.653 398 HA TRP 50 HA TRP 50 -7.613 -6.453 9.035 399 HB2 TRP 50 HB2 TRP 50 -9.448 -7.674 11.071 400 HB3 TRP 50 HB1 TRP 50 -9.932 -7.511 9.444 401 HD1 TRP 50 HD1 TRP 50 -6.328 -8.491 9.876 402 HE1 TRP 50 HE1 TRP 50 -6.028 -10.989 9.348 403 HE3 TRP 50 HE3 TRP 50 -11.244 -9.859 9.630 404 HZ2 TRP 50 HZ2 TRP 50 -7.660 -13.244 8.890 405 HZ3 TRP 50 HZ3 TRP 50 -11.790 -12.207 9.141 406 HH2 TRP 50 HH2 TRP 50 -10.034 -13.864 8.779 407 H VAL 51 HN VAL 51 -8.986 -5.018 11.864 408 HA VAL 51 HA VAL 51 -11.232 -3.753 10.938 409 HB VAL 51 HB VAL 51 -10.425 -3.822 13.325 410 HG11 VAL 51 HG11 VAL 51 -8.167 -2.795 12.705 411 HG12 VAL 51 HG12 VAL 51 -8.948 -2.251 14.189 412 HG13 VAL 51 HG13 VAL 51 -9.020 -1.253 12.738 413 HG21 VAL 51 HG21 VAL 51 -12.147 -2.459 13.645 414 HG22 VAL 51 HG22 VAL 51 -12.023 -1.928 11.968 415 HG23 VAL 51 HG23 VAL 51 -11.134 -1.074 13.229 416 H ASP 52 HN ASP 52 -8.063 -2.402 11.242 417 HA ASP 52 HA ASP 52 -8.483 -0.796 8.880 418 HB2 ASP 52 HB2 ASP 52 -9.419 0.475 10.753 419 HB3 ASP 52 HB1 ASP 52 -7.858 0.413 11.544 420 H ASN 53 HN ASN 53 -6.406 -2.380 10.994 421 HA ASN 53 HA ASN 53 -4.076 -0.979 10.042 422 HB2 ASN 53 HB2 ASN 53 -4.225 -3.366 11.866 423 HB3 ASN 53 HB1 ASN 53 -2.778 -2.454 11.499 424 HD21 ASN 53 HD21 ASN 53 -5.346 -0.300 11.705 425 HD22 ASN 53 HD22 ASN 53 -5.189 0.148 13.356 426 H GLY 54 HN GLY 54 -5.929 -3.483 9.068 427 HA2 GLY 54 HA2 GLY 54 -3.894 -4.887 7.699 428 HA3 GLY 54 HA1 GLY 54 -5.640 -5.074 7.558 429 H ILE 55 HN ILE 55 -3.470 -4.632 5.572 430 HA ILE 55 HA ILE 55 -4.084 -2.072 4.455 431 HB ILE 55 HB ILE 55 -2.002 -2.432 3.693 432 HG12 ILE 55 HG12 ILE 55 -2.026 -3.995 1.568 433 HG13 ILE 55 HG11 ILE 55 -3.750 -3.725 1.749 434 HG21 ILE 55 HG21 ILE 55 -1.605 -4.331 4.988 435 HG22 ILE 55 HG22 ILE 55 -0.924 -4.525 3.376 436 HG23 ILE 55 HG23 ILE 55 -2.434 -5.322 3.805 437 HD11 ILE 55 HD11 ILE 55 -1.619 -1.713 1.335 438 HD12 ILE 55 HD12 ILE 55 -3.227 -1.291 1.916 439 HD13 ILE 55 HD13 ILE 55 -3.036 -2.050 0.341 440 H ALA 56 HN ALA 56 -5.864 -1.678 3.216 441 HA ALA 56 HA ALA 56 -7.332 -3.849 2.147 442 HB1 ALA 56 HB1 ALA 56 -7.756 -1.019 2.461 443 HB2 ALA 56 HB2 ALA 56 -8.945 -2.298 2.213 444 HB3 ALA 56 HB3 ALA 56 -8.178 -1.526 0.826 445 H ALA 57 HN ALA 57 -5.926 -4.966 0.982 446 HA ALA 57 HA ALA 57 -4.053 -4.339 -0.688 447 HB1 ALA 57 HB1 ALA 57 -5.825 -6.303 -1.931 448 HB2 ALA 57 HB2 ALA 57 -5.398 -6.606 -0.246 449 HB3 ALA 57 HB3 ALA 57 -4.129 -6.433 -1.461 450 H ASP 58 HN ASP 58 -7.412 -3.890 -1.534 451 HA ASP 58 HA ASP 58 -7.215 -3.474 -4.255 452 HB2 ASP 58 HB2 ASP 58 -9.319 -3.553 -2.883 453 HB3 ASP 58 HB1 ASP 58 -8.976 -1.888 -2.471 454 H ASP 59 HN ASP 59 -6.457 -1.364 -1.611 455 HA ASP 59 HA ASP 59 -6.112 1.018 -3.059 456 HB2 ASP 59 HB2 ASP 59 -4.705 0.254 -0.506 457 HB3 ASP 59 HB1 ASP 59 -5.210 1.837 -1.037 458 H VAL 60 HN VAL 60 -4.008 -1.758 -2.485 459 HA VAL 60 HA VAL 60 -1.759 -0.250 -3.491 460 HB VAL 60 HB VAL 60 -0.397 -2.064 -2.791 461 HG11 VAL 60 HG11 VAL 60 -2.351 -1.031 -0.799 462 HG12 VAL 60 HG12 VAL 60 -0.785 -0.358 -1.228 463 HG13 VAL 60 HG13 VAL 60 -0.874 -1.893 -0.361 464 HG21 VAL 60 HG21 VAL 60 -2.709 -3.521 -3.015 465 HG22 VAL 60 HG22 VAL 60 -2.348 -3.526 -1.294 466 HG23 VAL 60 HG23 VAL 60 -1.148 -4.109 -2.454 467 H ILE 61 HN ILE 61 -0.189 -2.003 -4.660 468 HA ILE 61 HA ILE 61 -1.697 -3.239 -6.786 469 HB ILE 61 HB ILE 61 0.305 -2.031 -8.139 470 HG12 ILE 61 HG12 ILE 61 -0.825 0.181 -6.660 471 HG13 ILE 61 HG11 ILE 61 0.296 -0.756 -5.740 472 HG21 ILE 61 HG21 ILE 61 -1.451 -0.929 -9.159 473 HG22 ILE 61 HG22 ILE 61 -2.204 -0.581 -7.592 474 HG23 ILE 61 HG23 ILE 61 -2.321 -2.210 -8.296 475 HD11 ILE 61 HD11 ILE 61 0.856 1.262 -7.544 476 HD12 ILE 61 HD12 ILE 61 1.385 -0.245 -8.298 477 HD13 ILE 61 HD13 ILE 61 1.990 0.209 -6.710 478 H GLU 62 HN GLU 62 -1.025 -5.254 -6.739 479 HA GLU 62 HA GLU 62 1.402 -6.162 -5.685 480 HB2 GLU 62 HB2 GLU 62 0.688 -8.263 -7.089 481 HB3 GLU 62 HB1 GLU 62 -0.186 -7.808 -5.645 482 HG2 GLU 62 HG2 GLU 62 -2.050 -7.296 -6.794 483 HG3 GLU 62 HG1 GLU 62 -1.156 -6.617 -8.150 484 H VAL 63 HN VAL 63 3.352 -6.255 -6.431 485 HA VAL 63 HA VAL 63 3.768 -5.991 -9.328 486 HB VAL 63 HB VAL 63 6.157 -5.412 -8.551 487 HG11 VAL 63 HG11 VAL 63 5.257 -3.039 -7.784 488 HG12 VAL 63 HG12 VAL 63 3.751 -3.703 -8.415 489 HG13 VAL 63 HG13 VAL 63 5.170 -3.584 -9.454 490 HG21 VAL 63 HG21 VAL 63 4.688 -4.916 -5.976 491 HG22 VAL 63 HG22 VAL 63 6.357 -4.468 -6.323 492 HG23 VAL 63 HG23 VAL 63 5.897 -6.170 -6.249 493 H THR 64 HN THR 64 5.628 -7.227 -10.216 494 HA THR 64 HA THR 64 5.672 -9.904 -9.085 495 HB THR 64 HB THR 64 6.554 -10.660 -11.105 496 HG1 THR 64 HG1 THR 64 7.626 -9.261 -12.573 497 HG21 THR 64 HG21 THR 64 4.525 -10.093 -11.924 498 HG22 THR 64 HG22 THR 64 5.534 -9.067 -12.944 499 HG23 THR 64 HG23 THR 64 4.716 -8.383 -11.540 500 H SER 65 HN SER 65 7.738 -11.041 -8.780 501 HA SER 65 HA SER 65 9.323 -10.098 -6.853 502 HB2 SER 65 HB2 SER 65 11.088 -11.674 -7.610 503 HB3 SER 65 HB1 SER 65 9.476 -12.388 -7.629 504 HG SER 65 HG SER 65 11.029 -11.491 -9.813 505 H ASN 66 HN ASN 66 9.757 -9.306 -10.261 506 HA ASN 66 HA ASN 66 12.260 -8.026 -9.854 507 HB2 ASN 66 HB2 ASN 66 10.941 -9.005 -12.026 508 HB3 ASN 66 HB1 ASN 66 10.785 -7.267 -12.205 509 HD21 ASN 66 HD21 ASN 66 12.125 -8.293 -14.144 510 HD22 ASN 66 HD22 ASN 66 13.833 -8.096 -13.976 511 H GLY 67 HN GLY 67 9.140 -7.202 -9.197 512 HA2 GLY 67 HA2 GLY 67 8.451 -5.237 -8.106 513 HA3 GLY 67 HA1 GLY 67 9.802 -4.384 -8.836 514 H THR 68 HN THR 68 7.882 -6.467 -10.797 515 HA THR 68 HA THR 68 7.193 -4.305 -12.491 516 HB THR 68 HB THR 68 7.103 -7.211 -12.585 517 HG1 THR 68 HG1 THR 68 7.280 -5.245 -14.616 518 HG21 THR 68 HG21 THR 68 4.752 -6.952 -12.832 519 HG22 THR 68 HG22 THR 68 5.455 -7.298 -14.411 520 HG23 THR 68 HG23 THR 68 4.976 -5.652 -13.998 521 H ARG 69 HN ARG 69 5.561 -2.972 -12.202 522 HA ARG 69 HA ARG 69 3.465 -3.486 -10.345 523 HB2 ARG 69 HB2 ARG 69 4.362 -1.253 -12.005 524 HB3 ARG 69 HB1 ARG 69 2.610 -1.342 -11.861 525 HG2 ARG 69 HG2 ARG 69 2.627 -0.741 -9.703 526 HG3 ARG 69 HG1 ARG 69 4.068 -1.689 -9.347 527 HD2 ARG 69 HD2 ARG 69 4.689 0.557 -9.027 528 HD3 ARG 69 HD1 ARG 69 5.383 0.084 -10.577 529 HE ARG 69 HE ARG 69 3.063 1.176 -11.333 530 HH11 ARG 69 HH11 ARG 69 5.522 2.304 -9.123 531 HH12 ARG 69 HH12 ARG 69 5.207 3.978 -9.433 532 HH21 ARG 69 HH21 ARG 69 2.654 3.379 -11.742 533 HH22 ARG 69 HH22 ARG 69 3.583 4.588 -10.920 534 H THR 70 HN THR 70 1.356 -4.009 -10.656 535 HA THR 70 HA THR 70 0.264 -4.318 -13.325 536 HB THR 70 HB THR 70 -0.388 -6.727 -12.808 537 HG1 THR 70 HG1 THR 70 0.930 -7.794 -11.314 538 HG21 THR 70 HG21 THR 70 2.465 -5.993 -13.340 539 HG22 THR 70 HG22 THR 70 1.231 -6.540 -14.475 540 HG23 THR 70 HG23 THR 70 1.917 -7.666 -13.305 541 H SER 71 HN SER 71 -1.340 -2.888 -12.726 542 HA SER 71 HA SER 71 -2.942 -3.426 -10.355 543 HB2 SER 71 HB2 SER 71 -2.171 -1.096 -11.506 544 HB3 SER 71 HB1 SER 71 -3.773 -1.283 -12.219 545 HG SER 71 HG SER 71 -3.691 -0.150 -10.157 546 H ASP 72 HN ASP 72 -3.128 -3.753 -13.823 547 HA ASP 72 HA ASP 72 -5.877 -3.955 -14.192 548 HB2 ASP 72 HB2 ASP 72 -3.610 -4.289 -15.767 549 HB3 ASP 72 HB1 ASP 72 -4.391 -5.867 -15.818 550 H GLN 73 HN GLN 73 -3.636 -6.207 -12.783 551 HA GLN 73 HA GLN 73 -5.485 -8.443 -12.906 552 HB2 GLN 73 HB2 GLN 73 -2.764 -8.106 -11.638 553 HB3 GLN 73 HB1 GLN 73 -3.698 -9.594 -11.558 554 HG2 GLN 73 HG2 GLN 73 -3.742 -9.276 -14.182 555 HG3 GLN 73 HG1 GLN 73 -2.269 -8.368 -13.844 556 HE21 GLN 73 HE21 GLN 73 -3.799 -11.417 -12.856 557 HE22 GLN 73 HE22 GLN 73 -2.364 -12.371 -12.967 558 H VAL 74 HN VAL 74 -5.436 -9.718 -10.629 559 HA VAL 74 HA VAL 74 -6.619 -7.857 -8.672 560 HB VAL 74 HB VAL 74 -7.081 -10.836 -8.829 561 HG11 VAL 74 HG11 VAL 74 -7.668 -10.139 -6.692 562 HG12 VAL 74 HG12 VAL 74 -9.196 -10.060 -7.569 563 HG13 VAL 74 HG13 VAL 74 -8.281 -8.585 -7.259 564 HG21 VAL 74 HG21 VAL 74 -9.420 -9.739 -9.655 565 HG22 VAL 74 HG22 VAL 74 -8.179 -10.371 -10.737 566 HG23 VAL 74 HG23 VAL 74 -8.253 -8.643 -10.395 567 H LEU 75 HN LEU 75 -5.920 -7.877 -6.558 568 HA LEU 75 HA LEU 75 -3.310 -8.836 -6.049 569 HB2 LEU 75 HB2 LEU 75 -5.071 -7.074 -4.838 570 HB3 LEU 75 HB1 LEU 75 -4.802 -8.305 -3.632 571 HG LEU 75 HG LEU 75 -2.439 -7.113 -5.001 572 HD11 LEU 75 HD11 LEU 75 -2.913 -5.047 -4.356 573 HD12 LEU 75 HD12 LEU 75 -2.839 -5.609 -2.687 574 HD13 LEU 75 HD13 LEU 75 -4.382 -5.583 -3.540 575 HD21 LEU 75 HD21 LEU 75 -2.636 -9.021 -3.159 576 HD22 LEU 75 HD22 LEU 75 -2.623 -7.619 -2.089 577 HD23 LEU 75 HD23 LEU 75 -1.286 -7.888 -3.206 578 H GLN 76 HN GLN 76 -2.564 -10.419 -4.764 579 HA GLN 76 HA GLN 76 -4.317 -12.295 -3.456 580 HB2 GLN 76 HB2 GLN 76 -2.465 -13.252 -5.645 581 HB3 GLN 76 HB1 GLN 76 -3.459 -14.263 -4.615 582 HG2 GLN 76 HG2 GLN 76 -5.214 -14.050 -5.946 583 HG3 GLN 76 HG1 GLN 76 -5.049 -12.302 -6.017 584 HE21 GLN 76 HE21 GLN 76 -5.392 -14.735 -7.952 585 HE22 GLN 76 HE22 GLN 76 -4.356 -14.304 -9.267 586 H LYS 77 HN LYS 77 -3.355 -13.087 -1.713 587 HA LYS 77 HA LYS 77 -0.725 -12.219 -1.030 588 HB2 LYS 77 HB2 LYS 77 -1.056 -12.976 1.104 589 HB3 LYS 77 HB1 LYS 77 -2.662 -12.480 0.588 590 HG2 LYS 77 HG2 LYS 77 -1.863 -15.329 0.259 591 HG3 LYS 77 HG1 LYS 77 -2.292 -14.738 1.862 592 HD2 LYS 77 HD2 LYS 77 -4.465 -14.118 1.140 593 HD3 LYS 77 HD1 LYS 77 -4.050 -14.366 -0.553 594 HE2 LYS 77 HE2 LYS 77 -4.377 -16.589 -0.437 595 HE3 LYS 77 HE1 LYS 77 -3.681 -16.710 1.179 596 HZ1 LYS 77 HZ1 LYS 77 -5.945 -15.397 1.692 597 HZ2 LYS 77 HZ2 LYS 77 -5.808 -17.082 1.752 598 HZ3 LYS 77 HZ3 LYS 77 -6.441 -16.335 0.374 599 H GLY 78 HN GLY 78 1.048 -13.421 -0.394 600 HA2 GLY 78 HA2 GLY 78 2.021 -15.664 -0.145 601 HA3 GLY 78 HA1 GLY 78 1.129 -16.118 -1.592 602 H GLY 79 HN GLY 79 2.418 -12.922 -1.590 603 HA2 GLY 79 HA2 GLY 79 4.905 -13.843 -2.828 604 HA3 GLY 79 HA1 GLY 79 3.768 -13.053 -3.903 605 H TYR 80 HN TYR 80 3.832 -10.958 -4.084 606 HA TYR 80 HA TYR 80 4.918 -9.250 -2.032 607 HB2 TYR 80 HB2 TYR 80 6.152 -8.664 -4.627 608 HB3 TYR 80 HB1 TYR 80 6.875 -8.682 -3.028 609 HD1 TYR 80 HD2 TYR 80 5.928 -10.814 -5.897 610 HD2 TYR 80 HD1 TYR 80 8.197 -10.508 -2.312 611 HE1 TYR 80 HE2 TYR 80 7.109 -12.893 -6.475 612 HE2 TYR 80 HE1 TYR 80 9.387 -12.585 -2.879 613 HH TYR 80 HH TYR 80 9.696 -13.829 -5.645 614 H PHE 81 HN PHE 81 4.611 -6.960 -2.577 615 HA PHE 81 HA PHE 81 3.025 -6.378 -4.901 616 HB2 PHE 81 HB2 PHE 81 1.192 -5.247 -3.620 617 HB3 PHE 81 HB1 PHE 81 1.174 -7.000 -3.541 618 HD1 PHE 81 HD1 PHE 81 2.727 -7.893 -1.507 619 HD2 PHE 81 HD2 PHE 81 0.683 -4.146 -1.684 620 HE1 PHE 81 HE1 PHE 81 2.639 -7.805 0.962 621 HE2 PHE 81 HE2 PHE 81 0.603 -4.052 0.740 622 HZ PHE 81 HZ PHE 81 1.582 -5.881 2.088 623 H VAL 82 HN VAL 82 2.318 -4.045 -4.810 624 HA VAL 82 HA VAL 82 4.280 -2.471 -3.330 625 HB VAL 82 HB VAL 82 4.328 -2.973 -6.167 626 HG11 VAL 82 HG11 VAL 82 3.286 -0.372 -5.499 627 HG12 VAL 82 HG12 VAL 82 3.589 -1.080 -7.080 628 HG13 VAL 82 HG13 VAL 82 4.873 -0.214 -6.241 629 HG21 VAL 82 HG21 VAL 82 6.143 -1.198 -4.547 630 HG22 VAL 82 HG22 VAL 82 6.531 -2.106 -6.008 631 HG23 VAL 82 HG23 VAL 82 6.208 -2.959 -4.499 632 H ILE 83 HN ILE 83 3.285 -0.880 -2.330 633 HA ILE 83 HA ILE 83 0.499 -0.460 -2.701 634 HB ILE 83 HB ILE 83 2.538 1.025 -1.124 635 HG12 ILE 83 HG12 ILE 83 1.999 -0.234 0.703 636 HG13 ILE 83 HG11 ILE 83 0.331 -0.421 0.202 637 HG21 ILE 83 HG21 ILE 83 -0.336 1.588 -1.511 638 HG22 ILE 83 HG22 ILE 83 1.022 2.700 -1.336 639 HG23 ILE 83 HG23 ILE 83 0.374 1.873 0.077 640 HD11 ILE 83 HD11 ILE 83 1.579 -2.527 0.267 641 HD12 ILE 83 HD12 ILE 83 2.659 -1.907 -0.974 642 HD13 ILE 83 HD13 ILE 83 0.956 -2.160 -1.339 643 H ASN 84 HN ASN 84 -0.269 0.604 -4.390 644 HA ASN 84 HA ASN 84 1.126 2.314 -6.028 645 HB2 ASN 84 HB2 ASN 84 -1.492 1.390 -5.820 646 HB3 ASN 84 HB1 ASN 84 -1.632 3.129 -5.720 647 HD21 ASN 84 HD21 ASN 84 0.355 3.971 -7.369 648 HD22 ASN 84 HD22 ASN 84 0.004 3.481 -8.984 649 HA PRO 85 HA PRO 85 1.665 5.690 -3.024 650 HB2 PRO 85 HB2 PRO 85 3.223 7.233 -4.546 651 HB3 PRO 85 HB1 PRO 85 3.848 5.709 -3.885 652 HG2 PRO 85 HG2 PRO 85 2.573 6.175 -6.575 653 HG3 PRO 85 HG1 PRO 85 4.165 5.513 -6.235 654 HD2 PRO 85 HD2 PRO 85 2.174 3.856 -6.675 655 HD3 PRO 85 HD1 PRO 85 3.286 3.524 -5.324 656 H ASN 86 HN ASN 86 0.668 5.854 -6.275 657 HA ASN 86 HA ASN 86 -0.286 8.499 -6.156 658 HB2 ASN 86 HB2 ASN 86 -0.220 6.331 -8.158 659 HB3 ASN 86 HB1 ASN 86 -1.547 7.466 -8.323 660 HD21 ASN 86 HD21 ASN 86 1.861 7.763 -7.400 661 HD22 ASN 86 HD22 ASN 86 2.246 8.992 -8.552 662 H ASN 87 HN ASN 87 -1.531 5.372 -5.471 663 HA ASN 87 HA ASN 87 -4.292 6.178 -5.255 664 HB2 ASN 87 HB2 ASN 87 -2.747 3.824 -5.263 665 HB3 ASN 87 HB1 ASN 87 -3.645 3.918 -3.764 666 HD21 ASN 87 HD21 ASN 87 -4.038 1.950 -5.478 667 HD22 ASN 87 HD22 ASN 87 -5.605 2.064 -6.202 668 H VAL 88 HN VAL 88 -1.488 6.670 -3.631 669 HA VAL 88 HA VAL 88 -2.510 6.507 -1.008 670 HB VAL 88 HB VAL 88 0.185 6.955 -2.214 671 HG11 VAL 88 HG11 VAL 88 -0.919 7.636 0.443 672 HG12 VAL 88 HG12 VAL 88 0.443 8.342 -0.437 673 HG13 VAL 88 HG13 VAL 88 0.653 6.822 0.437 674 HG21 VAL 88 HG21 VAL 88 0.340 4.770 -1.878 675 HG22 VAL 88 HG22 VAL 88 -1.357 4.775 -1.365 676 HG23 VAL 88 HG23 VAL 88 -0.071 4.977 -0.160 677 H LYS 89 HN LYS 89 -3.010 8.042 0.064 678 HA LYS 89 HA LYS 89 -3.131 10.713 -0.947 679 HB2 LYS 89 HB2 LYS 89 -3.928 9.629 1.717 680 HB3 LYS 89 HB1 LYS 89 -4.325 11.220 1.110 681 HG2 LYS 89 HG2 LYS 89 -6.146 9.497 1.055 682 HG3 LYS 89 HG1 LYS 89 -5.846 10.355 -0.451 683 HD2 LYS 89 HD2 LYS 89 -4.592 7.702 0.111 684 HD3 LYS 89 HD1 LYS 89 -6.245 7.819 -0.488 685 HE2 LYS 89 HE2 LYS 89 -4.303 9.427 -1.962 686 HE3 LYS 89 HE1 LYS 89 -4.002 7.691 -2.009 687 HZ1 LYS 89 HZ1 LYS 89 -5.808 7.339 -3.274 688 HZ2 LYS 89 HZ2 LYS 89 -5.669 8.978 -3.662 689 HZ3 LYS 89 HZ3 LYS 89 -6.754 8.483 -2.464 690 H SER 90 HN SER 90 -1.761 8.894 1.639 691 HA SER 90 HA SER 90 0.735 10.121 1.719 692 HB2 SER 90 HB2 SER 90 0.657 12.004 2.966 693 HB3 SER 90 HB1 SER 90 -1.045 12.023 2.516 694 HG SER 90 HG SER 90 -1.594 11.256 4.469 695 H VAL 91 HN VAL 91 1.850 9.871 3.955 696 HA VAL 91 HA VAL 91 0.927 7.394 5.161 697 HB VAL 91 HB VAL 91 3.360 7.792 6.258 698 HG11 VAL 91 HG11 VAL 91 2.246 6.223 4.091 699 HG12 VAL 91 HG12 VAL 91 3.344 5.737 5.387 700 HG13 VAL 91 HG13 VAL 91 3.987 6.466 3.915 701 HG21 VAL 91 HG21 VAL 91 3.914 9.785 5.057 702 HG22 VAL 91 HG22 VAL 91 3.505 9.025 3.519 703 HG23 VAL 91 HG23 VAL 91 4.908 8.470 4.430 704 H GLY 92 HN GLY 92 0.419 7.372 7.361 705 HA2 GLY 92 HA2 GLY 92 0.254 9.989 8.618 706 HA3 GLY 92 HA1 GLY 92 -0.849 8.653 8.903 707 H THR 93 HN THR 93 -0.156 9.678 10.992 708 HA THR 93 HA THR 93 2.261 9.127 12.294 709 HB THR 93 HB THR 93 -0.300 9.181 13.792 710 HG1 THR 93 HG1 THR 93 0.601 11.361 12.234 711 HG21 THR 93 HG21 THR 93 1.782 9.440 14.990 712 HG22 THR 93 HG22 THR 93 0.827 10.920 15.067 713 HG23 THR 93 HG23 THR 93 2.201 10.813 13.969 714 HA PRO 94 HA PRO 94 2.018 4.865 13.041 715 HB2 PRO 94 HB2 PRO 94 4.257 4.673 14.366 716 HB3 PRO 94 HB1 PRO 94 4.274 5.301 12.706 717 HG2 PRO 94 HG2 PRO 94 4.178 6.889 15.241 718 HG3 PRO 94 HG1 PRO 94 5.382 6.989 13.946 719 HD2 PRO 94 HD2 PRO 94 3.288 8.628 14.030 720 HD3 PRO 94 HD1 PRO 94 3.914 7.996 12.491 721 H MET 95 HN MET 95 1.780 3.397 14.693 722 HA MET 95 HA MET 95 1.444 4.300 17.436 723 HB2 MET 95 HB2 MET 95 -0.826 2.936 15.974 724 HB3 MET 95 HB1 MET 95 -0.806 3.381 17.672 725 HG2 MET 95 HG2 MET 95 -0.286 5.666 15.992 726 HG3 MET 95 HG1 MET 95 -1.786 4.869 15.550 727 HE1 MET 95 HE1 MET 95 -3.540 7.334 16.975 728 HE2 MET 95 HE2 MET 95 -4.266 5.830 17.544 729 HE3 MET 95 HE3 MET 95 -3.481 5.890 15.965 730 H LYS 96 HN LYS 96 1.926 2.700 18.894 731 HA LYS 96 HA LYS 96 2.849 0.183 17.778 732 HB2 LYS 96 HB2 LYS 96 3.654 -0.258 20.105 733 HB3 LYS 96 HB1 LYS 96 4.305 1.213 19.396 734 HG2 LYS 96 HG2 LYS 96 3.218 2.566 20.856 735 HG3 LYS 96 HG1 LYS 96 1.841 1.477 21.014 736 HD2 LYS 96 HD2 LYS 96 4.167 0.187 22.056 737 HD3 LYS 96 HD1 LYS 96 4.037 1.795 22.770 738 HE2 LYS 96 HE2 LYS 96 1.452 0.889 22.876 739 HE3 LYS 96 HE1 LYS 96 2.381 -0.581 23.169 740 HZ1 LYS 96 HZ1 LYS 96 2.939 1.919 24.647 741 HZ2 LYS 96 HZ2 LYS 96 3.365 0.335 25.058 742 HZ3 LYS 96 HZ3 LYS 96 1.752 0.830 25.169 743 H GLY 97 HN GLY 97 1.714 -1.687 17.799 744 HA2 GLY 97 HA2 GLY 97 -0.044 -2.379 19.916 745 HA3 GLY 97 HA1 GLY 97 -0.969 -1.763 18.560 746 H SER 98 HN SER 98 0.162 -2.820 16.375 747 HA SER 98 HA SER 98 -0.724 -5.496 16.446 748 HB2 SER 98 HB2 SER 98 0.524 -3.718 14.428 749 HB3 SER 98 HB1 SER 98 0.703 -5.429 14.142 750 HG SER 98 HG SER 98 -1.676 -3.931 14.384 751 H GLY 99 HN GLY 99 0.704 -6.051 18.378 752 HA2 GLY 99 HA2 GLY 99 2.248 -7.889 18.686 753 HA3 GLY 99 HA1 GLY 99 3.204 -7.242 17.364 754 H GLY 100 HN GLY 100 3.540 -4.619 18.043 755 HA2 GLY 100 HA2 GLY 100 4.042 -3.736 20.516 756 HA3 GLY 100 HA1 GLY 100 5.357 -4.859 20.247 757 H LEU 101 HN LEU 101 5.099 -3.995 17.279 758 HA LEU 101 HA LEU 101 7.186 -2.095 17.286 759 HB2 LEU 101 HB2 LEU 101 5.591 -2.674 14.901 760 HB3 LEU 101 HB1 LEU 101 7.307 -2.502 15.098 761 HG LEU 101 HG LEU 101 7.157 -4.792 16.310 762 HD11 LEU 101 HD11 LEU 101 5.424 -6.234 15.543 763 HD12 LEU 101 HD12 LEU 101 4.822 -4.993 14.448 764 HD13 LEU 101 HD13 LEU 101 4.602 -4.810 16.180 765 HD21 LEU 101 HD21 LEU 101 7.847 -5.683 14.339 766 HD22 LEU 101 HD22 LEU 101 8.046 -3.945 14.075 767 HD23 LEU 101 HD23 LEU 101 6.635 -4.786 13.418 768 H SER 102 HN SER 102 6.391 -0.829 14.948 769 HA SER 102 HA SER 102 4.414 1.098 15.902 770 HB2 SER 102 HB2 SER 102 7.090 1.399 14.723 771 HB3 SER 102 HB1 SER 102 5.844 2.525 14.154 772 HG SER 102 HG SER 102 7.233 2.763 16.324 773 H TRP 103 HN TRP 103 2.671 1.045 14.763 774 HA TRP 103 HA TRP 103 2.704 0.277 11.955 775 HB2 TRP 103 HB2 TRP 103 0.587 -0.180 14.034 776 HB3 TRP 103 HB1 TRP 103 0.526 -0.685 12.374 777 HD1 TRP 103 HD1 TRP 103 3.236 -1.044 15.065 778 HE1 TRP 103 HE1 TRP 103 4.143 -3.394 15.006 779 HE3 TRP 103 HE3 TRP 103 0.176 -3.104 11.521 780 HZ2 TRP 103 HZ2 TRP 103 3.662 -5.850 13.710 781 HZ3 TRP 103 HZ3 TRP 103 0.488 -5.458 10.937 782 HH2 TRP 103 HH2 TRP 103 2.186 -6.805 12.027 783 H ALA 104 HN ALA 104 2.269 1.947 10.774 784 HA ALA 104 HA ALA 104 0.896 4.236 11.908 785 HB1 ALA 104 HB1 ALA 104 3.116 4.709 11.148 786 HB2 ALA 104 HB2 ALA 104 1.938 5.583 10.171 787 HB3 ALA 104 HB3 ALA 104 2.706 4.132 9.532 788 H GLN 105 HN GLN 105 -0.544 5.443 10.990 789 HA GLN 105 HA GLN 105 -2.436 4.108 9.370 790 HB2 GLN 105 HB2 GLN 105 -2.756 5.754 11.374 791 HB3 GLN 105 HB1 GLN 105 -2.611 6.979 10.129 792 HG2 GLN 105 HG2 GLN 105 -4.453 6.163 8.972 793 HG3 GLN 105 HG1 GLN 105 -4.494 4.699 9.942 794 HE21 GLN 105 HE21 GLN 105 -6.820 5.574 10.001 795 HE22 GLN 105 HE22 GLN 105 -7.208 6.597 11.337 796 H VAL 106 HN VAL 106 -1.861 4.039 7.155 797 HA VAL 106 HA VAL 106 -0.937 6.562 6.034 798 HB VAL 106 HB VAL 106 -0.710 3.709 5.108 799 HG11 VAL 106 HG11 VAL 106 -0.295 6.237 3.569 800 HG12 VAL 106 HG12 VAL 106 -1.206 4.812 3.113 801 HG13 VAL 106 HG13 VAL 106 0.559 4.749 3.164 802 HG21 VAL 106 HG21 VAL 106 1.210 5.877 5.908 803 HG22 VAL 106 HG22 VAL 106 1.723 4.437 5.025 804 HG23 VAL 106 HG23 VAL 106 0.996 4.273 6.625 805 H ASN 107 HN ASN 107 -2.120 7.582 4.521 806 HA ASN 107 HA ASN 107 -4.895 6.833 4.358 807 HB2 ASN 107 HB2 ASN 107 -3.304 9.283 4.085 808 HB3 ASN 107 HB1 ASN 107 -4.624 9.160 2.933 809 HD21 ASN 107 HD21 ASN 107 -6.636 8.080 4.167 810 HD22 ASN 107 HD22 ASN 107 -7.106 8.968 5.571 811 H PHE 108 HN PHE 108 -5.210 5.291 2.830 812 HA PHE 108 HA PHE 108 -4.029 5.632 0.261 813 HB2 PHE 108 HB2 PHE 108 -5.596 3.334 1.436 814 HB3 PHE 108 HB1 PHE 108 -5.004 3.397 -0.196 815 HD1 PHE 108 HD2 PHE 108 -3.439 4.056 3.118 816 HD2 PHE 108 HD1 PHE 108 -3.350 1.849 -0.514 817 HE1 PHE 108 HE2 PHE 108 -1.409 2.887 3.866 818 HE2 PHE 108 HE1 PHE 108 -1.330 0.678 0.244 819 HZ PHE 108 HZ PHE 108 -0.353 1.196 2.436 820 H THR 109 HN THR 109 -5.339 4.935 -1.485 821 HA THR 109 HA THR 109 -7.322 6.624 -2.206 822 HB THR 109 HB THR 109 -6.019 5.478 -3.772 823 HG1 THR 109 HG1 THR 109 -7.693 5.567 -5.034 824 HG21 THR 109 HG21 THR 109 -5.460 3.387 -3.499 825 HG22 THR 109 HG22 THR 109 -7.135 2.880 -3.681 826 HG23 THR 109 HG23 THR 109 -6.506 3.327 -2.094 827 H THR 110 HN THR 110 -7.973 3.207 -1.813 828 HA THR 110 HA THR 110 -10.803 3.641 -1.710 829 HB THR 110 HB THR 110 -9.839 0.942 -1.251 830 HG1 THR 110 HG1 THR 110 -9.197 2.198 -3.699 831 HG21 THR 110 HG21 THR 110 -11.405 0.315 -2.833 832 HG22 THR 110 HG22 THR 110 -11.371 1.891 -3.626 833 HG23 THR 110 HG23 THR 110 -12.149 1.710 -2.053 834 H GLY 111 HN GLY 111 -8.514 1.939 0.369 835 HA2 GLY 111 HA2 GLY 111 -10.381 1.583 2.442 836 HA3 GLY 111 HA1 GLY 111 -8.655 1.300 2.550 837 H GLY 112 HN GLY 112 -8.722 4.368 1.490 838 HA2 GLY 112 HA2 GLY 112 -8.398 6.381 2.513 839 HA3 GLY 112 HA1 GLY 112 -9.605 5.847 3.673 840 H ASN 113 HN ASN 113 -8.935 4.796 5.573 841 HA ASN 113 HA ASN 113 -6.176 5.324 6.250 842 HB2 ASN 113 HB2 ASN 113 -7.030 4.281 8.484 843 HB3 ASN 113 HB1 ASN 113 -7.568 5.893 8.055 844 HD21 ASN 113 HD21 ASN 113 -8.529 2.639 7.079 845 HD22 ASN 113 HD22 ASN 113 -10.204 2.815 7.482 846 H VAL 114 HN VAL 114 -4.639 3.827 6.321 847 HA VAL 114 HA VAL 114 -5.303 0.994 6.380 848 HB VAL 114 HB VAL 114 -3.365 1.994 4.340 849 HG11 VAL 114 HG11 VAL 114 -4.893 -0.568 4.326 850 HG12 VAL 114 HG12 VAL 114 -3.377 -0.384 5.208 851 HG13 VAL 114 HG13 VAL 114 -3.412 -0.172 3.456 852 HG21 VAL 114 HG21 VAL 114 -5.261 2.968 3.441 853 HG22 VAL 114 HG22 VAL 114 -6.322 1.709 4.075 854 HG23 VAL 114 HG23 VAL 114 -5.283 1.372 2.691 855 H TRP 115 HN TRP 115 -4.087 0.291 8.005 856 HA TRP 115 HA TRP 115 -1.728 1.818 8.660 857 HB2 TRP 115 HB2 TRP 115 -3.153 -0.322 10.166 858 HB3 TRP 115 HB1 TRP 115 -1.699 0.466 10.738 859 HD1 TRP 115 HD1 TRP 115 -5.241 1.396 9.599 860 HE1 TRP 115 HE1 TRP 115 -5.955 3.378 10.999 861 HE3 TRP 115 HE3 TRP 115 -0.921 2.194 12.136 862 HZ2 TRP 115 HZ2 TRP 115 -4.857 5.105 12.845 863 HZ3 TRP 115 HZ3 TRP 115 -0.827 4.084 13.733 864 HH2 TRP 115 HH2 TRP 115 -2.780 5.520 14.084 865 H LEU 116 HN LEU 116 0.247 0.935 9.168 866 HA LEU 116 HA LEU 116 0.873 -1.727 8.228 867 HB2 LEU 116 HB2 LEU 116 1.019 0.365 6.444 868 HB3 LEU 116 HB1 LEU 116 2.652 0.306 7.098 869 HG LEU 116 HG LEU 116 2.333 -2.298 6.541 870 HD11 LEU 116 HD11 LEU 116 1.003 -1.318 4.123 871 HD12 LEU 116 HD12 LEU 116 -0.016 -1.340 5.561 872 HD13 LEU 116 HD13 LEU 116 0.775 -2.820 5.018 873 HD21 LEU 116 HD21 LEU 116 3.986 -0.506 5.692 874 HD22 LEU 116 HD22 LEU 116 2.946 -0.452 4.277 875 HD23 LEU 116 HD23 LEU 116 3.736 -1.960 4.731 876 H ASN 117 HN ASN 117 2.783 -2.466 9.199 877 HA ASN 117 HA ASN 117 3.584 -0.927 11.418 878 HB2 ASN 117 HB2 ASN 117 4.058 -2.902 12.008 879 HB3 ASN 117 HB1 ASN 117 4.342 -3.503 10.394 880 HD21 ASN 117 HD21 ASN 117 5.673 -2.424 13.308 881 HD22 ASN 117 HD22 ASN 117 7.344 -2.560 12.896 882 H THR 118 HN THR 118 4.150 0.690 11.114 883 HA THR 118 HA THR 118 5.605 1.808 8.969 884 HB THR 118 HB THR 118 3.726 2.735 10.338 885 HG1 THR 118 HG1 THR 118 5.774 4.643 10.268 886 HG21 THR 118 HG21 THR 118 5.556 4.097 12.141 887 HG22 THR 118 HG22 THR 118 5.371 2.374 12.458 888 HG23 THR 118 HG23 THR 118 3.953 3.417 12.430 889 H THR 119 HN THR 119 6.910 -0.068 11.088 890 HA THR 119 HA THR 119 8.938 1.500 12.294 891 HB THR 119 HB THR 119 8.364 -0.861 12.920 892 HG1 THR 119 HG1 THR 119 11.103 -0.515 12.294 893 HG21 THR 119 HG21 THR 119 8.962 -2.694 11.713 894 HG22 THR 119 HG22 THR 119 10.252 -1.848 10.858 895 HG23 THR 119 HG23 THR 119 8.570 -1.583 10.400 896 H SER 120 HN SER 120 8.486 1.959 9.305 897 HA SER 120 HA SER 120 11.071 2.591 8.583 898 HB2 SER 120 HB2 SER 120 10.081 -0.062 7.721 899 HB3 SER 120 HB1 SER 120 10.724 0.955 6.433 900 HG SER 120 HG SER 120 12.362 -0.311 7.374 901 H LYS 121 HN LYS 121 10.756 4.301 7.285 902 HA LYS 121 HA LYS 121 8.127 4.952 6.387 903 HB2 LYS 121 HB2 LYS 121 9.719 6.589 7.242 904 HB3 LYS 121 HB1 LYS 121 10.774 6.295 5.866 905 HG2 LYS 121 HG2 LYS 121 9.143 7.188 4.344 906 HG3 LYS 121 HG1 LYS 121 7.954 7.326 5.640 907 HD2 LYS 121 HD2 LYS 121 8.721 9.341 6.186 908 HD3 LYS 121 HD1 LYS 121 10.351 8.700 6.395 909 HE2 LYS 121 HE2 LYS 121 9.885 8.846 3.619 910 HE3 LYS 121 HE1 LYS 121 9.311 10.363 4.309 911 HZ1 LYS 121 HZ1 LYS 121 11.727 9.840 5.534 912 HZ2 LYS 121 HZ2 LYS 121 11.414 11.013 4.357 913 HZ3 LYS 121 HZ3 LYS 121 11.974 9.484 3.899 914 H ASP 122 HN ASP 122 11.157 3.899 4.950 915 HA ASP 122 HA ASP 122 10.229 3.909 2.274 916 HB2 ASP 122 HB2 ASP 122 12.479 2.507 3.681 917 HB3 ASP 122 HB1 ASP 122 12.144 2.264 1.970 918 H ASN 123 HN ASN 123 9.230 2.249 4.961 919 HA ASN 123 HA ASN 123 8.933 -0.374 4.049 920 HB2 ASN 123 HB2 ASN 123 8.608 -0.062 6.400 921 HB3 ASN 123 HB1 ASN 123 7.556 1.315 6.111 922 HD21 ASN 123 HD21 ASN 123 7.325 -1.530 4.221 923 HD22 ASN 123 HD22 ASN 123 5.774 -1.941 4.748 924 H LEU 124 HN LEU 124 6.541 2.155 4.193 925 HA LEU 124 HA LEU 124 4.688 0.753 2.611 926 HB2 LEU 124 HB2 LEU 124 4.562 3.662 2.427 927 HB3 LEU 124 HB1 LEU 124 3.314 2.518 2.877 928 HG LEU 124 HG LEU 124 3.738 3.962 4.704 929 HD11 LEU 124 HD11 LEU 124 4.860 2.181 6.324 930 HD12 LEU 124 HD12 LEU 124 4.635 1.124 4.928 931 HD13 LEU 124 HD13 LEU 124 3.246 1.930 5.660 932 HD21 LEU 124 HD21 LEU 124 5.747 4.931 4.790 933 HD22 LEU 124 HD22 LEU 124 6.485 3.637 3.829 934 HD23 LEU 124 HD23 LEU 124 6.313 3.457 5.580 935 H LEU 125 HN LEU 125 6.772 3.477 1.917 936 HA LEU 125 HA LEU 125 6.283 3.630 -0.804 937 HB2 LEU 125 HB2 LEU 125 8.679 4.358 0.857 938 HB3 LEU 125 HB1 LEU 125 8.539 4.743 -0.829 939 HG LEU 125 HG LEU 125 6.363 5.964 -0.178 940 HD11 LEU 125 HD11 LEU 125 7.227 6.687 2.398 941 HD12 LEU 125 HD12 LEU 125 7.268 4.921 2.322 942 HD13 LEU 125 HD13 LEU 125 5.774 5.787 1.954 943 HD21 LEU 125 HD21 LEU 125 7.546 7.982 0.194 944 HD22 LEU 125 HD22 LEU 125 8.590 6.990 -0.824 945 HD23 LEU 125 HD23 LEU 125 8.920 7.132 0.902 946 H TYR 126 HN TYR 126 8.822 1.867 0.970 947 HA TYR 126 HA TYR 126 9.523 0.593 -1.595 948 HB2 TYR 126 HB2 TYR 126 11.101 1.750 0.551 949 HB3 TYR 126 HB1 TYR 126 11.628 0.132 0.125 950 HD1 TYR 126 HD1 TYR 126 10.335 3.030 -1.818 951 HD2 TYR 126 HD2 TYR 126 13.489 0.230 -1.272 952 HE1 TYR 126 HE1 TYR 126 11.501 3.972 -3.771 953 HE2 TYR 126 HE2 TYR 126 14.667 1.163 -3.220 954 HH TYR 126 HH TYR 126 14.717 2.841 -4.722 955 H GLY 127 HN GLY 127 8.742 0.019 1.781 956 HA2 GLY 127 HA2 GLY 127 7.641 -2.085 2.355 957 HA3 GLY 127 HA1 GLY 127 8.518 -2.858 1.047 958 H LYS 128 HN LYS 128 10.116 -0.638 3.144 959 HA LYS 128 HA LYS 128 12.003 -2.582 3.944 960 HB2 LYS 128 HB2 LYS 128 11.494 0.246 4.833 961 HB3 LYS 128 HB1 LYS 128 12.896 -0.698 5.269 962 HG2 LYS 128 HG2 LYS 128 13.178 -0.939 2.692 963 HG3 LYS 128 HG1 LYS 128 12.168 0.512 2.668 964 HD2 LYS 128 HD2 LYS 128 13.771 1.792 3.769 965 HD3 LYS 128 HD1 LYS 128 14.525 0.380 4.507 966 HE2 LYS 128 HE2 LYS 128 15.526 -0.264 2.431 967 HE3 LYS 128 HE1 LYS 128 14.638 0.984 1.558 968 HZ1 LYS 128 HZ1 LYS 128 16.655 1.516 3.671 969 HZ2 LYS 128 HZ2 LYS 128 15.875 2.669 2.710 970 HZ3 LYS 128 HZ3 LYS 128 16.965 1.583 2.009
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